A0A3Q0KPT1_SCHMA Loading...

Putative high-affinity choline transporter

AlphaFold DB , UniProt , Accession A0A3Q0KPT1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 602 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	72.4	Confident	86.2	Confident	189 Å²	189	64.5 Å²	64.5	93%	0.931	33%	0.33	S	S	*	.				0	133.8	0	-144.6	-175.3	-125.3	0	0	109.3	Y3 D157 R320	M1-Y3 PolarHBondContact O-N 2.71Å; M1-D157 PolarHBondContact N-OD2 2.84Å; M1-R320 PolarHBondContact O-NH2 3.12Å
2	I	83.7	Confident	86.6	Confident	90 Å²	90	65.1 Å²	65.1	46%	0.462	34%	0.339	S	S	.	.			trans	-57.5	127.4	-178.9	-63.3	167.8	0	0	0	110.4	I4 L7 V156	I2-I4 PolarHBondContact O-N 3.06Å; I2-I4 VanDerWaalsContact O-N 3.13Å; I2-L7 HydrophobicContact CG2-CD2 4.38Å; I2-V156 HydrophobicContact CG1-CG1 4.27Å; I2-V156 WeakPolarHBondContact CG1-O 3.2Å
3	Y	86.3	Confident	86.8	Confident	33 Å²	33	61.8 Å²	61.8	13%	0.129	32%	0.32	C	S	.	.			trans	-81.9	86.3	173	-173.4	-123	0	0	0	110.3	M1 P5 G6 L7 I155 R320 P325 S328 L332	M1-Y3 PolarHBondContact O-N 2.71Å; Y3-P5 VanDerWaalsContact C-CD 3.46Å; Y3-P5 VanDerWaalsContact C-N 3.34Å; Y3-P5 HydrophobicContact CD2-CG 4.35Å; Y3-P5 HydrophobicContact CE1-CB 4.04Å; Y3-P5 HydrophobicContact CE2-CB 4.22Å; Y3-P5 HydrophobicContact CE2-CG 3.84Å; Y3-G6 VanDerWaalsContact CD1-N 3.27Å; Y3-G6 PolarHBondContact O-N 2.96Å; Y3-L7 PolarHBondContact O-N 3.13Å; Y3-L7 VanDerWaalsContact O-N 3.11Å; Y3-I155 WeakPolarHBondContact CB-O 2.94Å; Y3-I155 PolarHBondContact N-O 3.28Å; Y3-R320 HydrophobicContact CD1-CG 4.42Å; Y3-R320 HydrophobicContact CG-CG 4.48Å; Y3-P325 WeakPolarHBondContact OH-CA 3.33Å; Y3-P325 PolarHBondContact OH-O 2.84Å; Y3-S328 VanDerWaalsContact CE1-OG 3.22Å; Y3-S328 WeakPolarHBondContact CE1-OG 3.23Å; Y3-S328 WeakPolarHBondContact OH-CB 3.3Å; Y3-S328 PolarHBondContact OH-OG 3.03Å; Y3-L332 HydrophobicContact CD1-CD1 4.18Å; Y3-L332 HydrophobicContact CE1-CD1 4.06Å
4	I	88.5	Confident	86.9	Confident	110 Å²	110	60.6 Å²	60.6	56%	0.564	31%	0.31	S	S	*	.	H	α-helix	trans	-50.4	-45.4	-176.4	-60.4	173.3	0	0	0	112.8	I2 G6 L7 I8	I2-I4 PolarHBondContact O-N 3.06Å; I2-I4 VanDerWaalsContact O-N 3.13Å; I4-G6 VanDerWaalsContact C-N 3.34Å; I4-G6 PolarHBondContact O-N 2.89Å; I4-L7 PolarHBondContact O-N 3.1Å; I4-I8 HydrophobicContact CG2-CD1 3.71Å; I4-I8 HydrophobicContact CG2-CG1 4.28Å; I4-I8 WeakPolarHBondContact O-CG1 3.4Å; I4-I8 PolarHBondContact O-N 3.27Å
5	P	86.8	Confident	87	Confident	48 Å²	48	63.6 Å²	63.6	31%	0.312	33%	0.326	S	S	.	.	H	α-helix	trans	-58.6	-43.6	177.8	-23.9	34.5	0	0	0	112.7	Y3 L7 I8 A9 F329	Y3-P5 VanDerWaalsContact C-CD 3.46Å; Y3-P5 VanDerWaalsContact C-N 3.34Å; Y3-P5 HydrophobicContact CD2-CG 4.35Å; Y3-P5 HydrophobicContact CE1-CB 4.04Å; Y3-P5 HydrophobicContact CE2-CB 4.22Å; Y3-P5 HydrophobicContact CE2-CG 3.84Å; P5-L7 PolarHBondContact O-N 2.97Å; P5-I8 PolarHBondContact O-N 3.1Å; P5-A9 WeakPolarHBondContact O-CB 3.3Å; P5-A9 PolarHBondContact O-N 2.96Å; P5-F329 HydrophobicContact CB-CD2 4.4Å; P5-F329 WeakPolarHBondContact O-CD2 3.37Å; P5-F329 WeakPolarHBondContact O-CE2 3.28Å
6	G	85.2	Confident	87.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-37.8	177.8	0	0	0	0	0	112.9	Y3 I4 A9 I10	Y3-G6 VanDerWaalsContact CD1-N 3.27Å; Y3-G6 PolarHBondContact O-N 2.96Å; I4-G6 VanDerWaalsContact C-N 3.34Å; I4-G6 PolarHBondContact O-N 2.89Å; G6-A9 WeakPolarHBondContact O-CB 3.43Å; G6-A9 PolarHBondContact O-N 3.1Å; G6-I10 PolarHBondContact O-N 3.49Å
7	L	88.6	Confident	87.2	Confident	61 Å²	61	60.9 Å²	60.9	32%	0.319	31%	0.313	S	S	.	.	H	α-helix	trans	-66.1	-45	177.4	179.3	61.8	0	0	0	111.2	I2 Y3 I4 P5 A9 I10 I11 I155 V156	I2-L7 HydrophobicContact CG2-CD2 4.38Å; Y3-L7 PolarHBondContact O-N 3.13Å; Y3-L7 VanDerWaalsContact O-N 3.11Å; I4-L7 PolarHBondContact O-N 3.1Å; P5-L7 PolarHBondContact O-N 2.97Å; L7-A9 VanDerWaalsContact C-N 3.26Å; L7-A9 PolarHBondContact O-N 3.3Å; L7-I10 PolarHBondContact O-N 2.8Å; L7-I11 HydrophobicContact CD1-CD1 4.34Å; L7-I11 HydrophobicContact CG-CD1 4.17Å; L7-I11 WeakPolarHBondContact O-CG1 3.31Å; L7-I11 PolarHBondContact O-N 3.28Å; L7-I11 VanDerWaalsContact O-N 3.11Å; L7-I155 HydrophobicContact CB-CG2 4Å; L7-I155 VanDerWaalsContact N-CG2 3.28Å; L7-V156 HydrophobicContact CD1-CG2 4.21Å
8	I	90.7	Very high	87.1	Confident	84 Å²	84	61.2 Å²	61.2	43%	0.431	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-40.4	175	-64.1	170.4	0	0	0	109.9	I4 P5 I11 V12 F329	I4-I8 HydrophobicContact CG2-CD1 3.71Å; I4-I8 HydrophobicContact CG2-CG1 4.28Å; I4-I8 WeakPolarHBondContact O-CG1 3.4Å; I4-I8 PolarHBondContact O-N 3.27Å; P5-I8 PolarHBondContact O-N 3.1Å; I8-I11 PolarHBondContact O-N 3.14Å; I8-V12 HydrophobicContact CG2-CG2 4.1Å; I8-V12 WeakPolarHBondContact O-CB 3.48Å; I8-V12 VanDerWaalsContact O-CG2 3.29Å; I8-V12 WeakPolarHBondContact O-CG2 3.25Å; I8-V12 PolarHBondContact O-N 2.79Å; I8-F329 HydrophobicContact CB-CE2 4.12Å; I8-F329 HydrophobicContact CG2-CE2 3.89Å; I8-F329 HydrophobicContact CG2-CZ 4.4Å
9	A	89.1	Confident	87.1	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-58.3	-52.1	176.6	0	0	0	0	0	111.7	P5 G6 L7 I11 V12 F13 F329	P5-A9 WeakPolarHBondContact O-CB 3.3Å; P5-A9 PolarHBondContact O-N 2.96Å; G6-A9 WeakPolarHBondContact O-CB 3.43Å; G6-A9 PolarHBondContact O-N 3.1Å; L7-A9 VanDerWaalsContact C-N 3.26Å; L7-A9 PolarHBondContact O-N 3.3Å; A9-I11 VanDerWaalsContact C-N 3.28Å; A9-I11 PolarHBondContact O-N 2.85Å; A9-V12 PolarHBondContact O-N 3.45Å; A9-F13 WeakPolarHBondContact O-CB 3.42Å; A9-F13 VanDerWaalsContact O-CD2 3.28Å; A9-F13 WeakPolarHBondContact O-CD2 3.1Å; A9-F13 PolarHBondContact O-N 2.81Å; A9-F329 VanDerWaalsContact CA-CE2 3.46Å; A9-F329 VanDerWaalsContact CA-CZ 3.49Å; A9-F329 HydrophobicContact CB-CB 4.43Å; A9-F329 HydrophobicContact CB-CD1 3.93Å; A9-F329 HydrophobicContact CB-CD2 3.57Å; A9-F329 HydrophobicContact CB-CE1 3.97Å; A9-F329 HydrophobicContact CB-CE2 3.61Å; A9-F329 HydrophobicContact CB-CG 3.71Å; A9-F329 HydrophobicContact CB-CZ 3.8Å; A9-F329 WeakPolarHBondContact CB-O 3.42Å; A9-F329 VanDerWaalsContact N-CE2 3.33Å
10	I	88	Confident	87.2	Confident	8 Å²	8	63.2 Å²	63.2	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-53.2	-49.2	177.5	-72.4	-175.8	0	0	0	110.6	G6 L7 V12 F13 Y14 L152 I155	G6-I10 PolarHBondContact O-N 3.49Å; L7-I10 PolarHBondContact O-N 2.8Å; I10-V12 PolarHBondContact O-N 2.8Å; I10-F13 PolarHBondContact O-N 2.71Å; I10-Y14 HydrophobicContact CG2-CD2 3.59Å; I10-Y14 HydrophobicContact CG2-CE1 4.31Å; I10-Y14 HydrophobicContact CG2-CE2 3.28Å; I10-Y14 HydrophobicContact CG2-CG 4.21Å; I10-Y14 VanDerWaalsContact O-CB 3.3Å; I10-Y14 WeakPolarHBondContact O-CB 3.22Å; I10-Y14 PolarHBondContact O-N 3.03Å; I10-L152 HydrophobicContact CD1-CD1 3.92Å; I10-I155 HydrophobicContact CD1-CD1 3.42Å; I10-I155 VanDerWaalsContact CD1-CD1 3.42Å; I10-I155 HydrophobicContact CG1-CD1 3.86Å
11	I	89.2	Confident	87.1	Confident	86 Å²	86	60.3 Å²	60.3	44%	0.441	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-48.4	-178.9	-65.9	166.6	0	0	0	110.9	L7 I8 A9 F13 Y14 L15	L7-I11 HydrophobicContact CD1-CD1 4.34Å; L7-I11 HydrophobicContact CG-CD1 4.17Å; L7-I11 WeakPolarHBondContact O-CG1 3.31Å; L7-I11 PolarHBondContact O-N 3.28Å; L7-I11 VanDerWaalsContact O-N 3.11Å; I8-I11 PolarHBondContact O-N 3.14Å; A9-I11 VanDerWaalsContact C-N 3.28Å; A9-I11 PolarHBondContact O-N 2.85Å; I11-F13 PolarHBondContact O-N 3.06Å; I11-Y14 PolarHBondContact O-N 3.06Å; I11-L15 HydrophobicContact CG2-CD1 3.93Å; I11-L15 HydrophobicContact CG2-CG 4.35Å; I11-L15 WeakPolarHBondContact O-CB 3.43Å; I11-L15 VanDerWaalsContact O-CG 3.27Å; I11-L15 WeakPolarHBondContact O-CG 3.48Å; I11-L15 PolarHBondContact O-N 3.01Å
12	V	90.8	Very high	87.7	Confident	72 Å²	72	55.4 Å²	55.4	44%	0.436	28%	0.284	S	S	.	.	H	α-helix	trans	-60.9	-47.3	-179.5	168.2	0	0	0	0	111.1	I8 A9 I10 L15 L16	I8-V12 HydrophobicContact CG2-CG2 4.1Å; I8-V12 WeakPolarHBondContact O-CB 3.48Å; I8-V12 VanDerWaalsContact O-CG2 3.29Å; I8-V12 WeakPolarHBondContact O-CG2 3.25Å; I8-V12 PolarHBondContact O-N 2.79Å; A9-V12 PolarHBondContact O-N 3.45Å; I10-V12 PolarHBondContact O-N 2.8Å; V12-L15 PolarHBondContact O-N 2.94Å; V12-L16 WeakPolarHBondContact O-CB 3.21Å; V12-L16 PolarHBondContact O-N 3.34Å
13	F	89.3	Confident	87.9	Confident	22 Å²	22	57 Å²	57	10%	0.096	28%	0.284	C	S	.	.	H	α-helix	trans	-66.7	-40	179.5	-86.4	-87.9	0	0	0	111.9	A9 I10 I11 L16 I17 C193 F329 V330 A334 A337	A9-F13 WeakPolarHBondContact O-CB 3.42Å; A9-F13 VanDerWaalsContact O-CD2 3.28Å; A9-F13 WeakPolarHBondContact O-CD2 3.1Å; A9-F13 PolarHBondContact O-N 2.81Å; I10-F13 PolarHBondContact O-N 2.71Å; I11-F13 PolarHBondContact O-N 3.06Å; F13-L16 WeakPolarHBondContact O-CB 3.04Å; F13-L16 PolarHBondContact O-N 3.25Å; F13-I17 WeakPolarHBondContact O-CB 3.27Å; F13-I17 WeakPolarHBondContact O-CD1 3.35Å; F13-I17 WeakPolarHBondContact O-CG1 3.5Å; F13-I17 PolarHBondContact O-N 3.08Å; F13-C193 HydrophobicContact CD1-CB 4.47Å; F13-C193 HydrophobicContact CE1-CB 3.79Å; F13-F329 HydrophobicContact CE2-CE1 4.36Å; F13-V330 HydrophobicContact CZ-CG1 4.5Å; F13-A334 HydrophobicContact CE1-CB 4.09Å; F13-A334 HydrophobicContact CZ-CB 4.25Å; F13-A337 HydrophobicContact CB-CB 4.08Å; F13-A337 HydrophobicContact CD1-CB 4.22Å; F13-A337 HydrophobicContact CG-CB 4.49Å
14	Y	87.9	Confident	87.8	Confident	45 Å²	45	55.5 Å²	55.5	18%	0.176	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-40.5	175	-72.9	-4.9	0	0	0	112.5	I10 I11 I17 L18 I170 M340	I10-Y14 HydrophobicContact CG2-CD2 3.59Å; I10-Y14 HydrophobicContact CG2-CE1 4.31Å; I10-Y14 HydrophobicContact CG2-CE2 3.28Å; I10-Y14 HydrophobicContact CG2-CG 4.21Å; I10-Y14 VanDerWaalsContact O-CB 3.3Å; I10-Y14 WeakPolarHBondContact O-CB 3.22Å; I10-Y14 PolarHBondContact O-N 3.03Å; I11-Y14 PolarHBondContact O-N 3.06Å; Y14-I17 HydrophobicContact CD1-CD1 4.46Å; Y14-I17 PolarHBondContact O-N 2.91Å; Y14-L18 VanDerWaalsContact O-CB 3.24Å; Y14-L18 WeakPolarHBondContact O-CB 3.33Å; Y14-L18 PolarHBondContact O-N 3.47Å; Y14-I170 HydrophobicContact CD2-CG2 4.08Å; Y14-I170 HydrophobicContact CE2-CD1 4.35Å; Y14-I170 HydrophobicContact CE2-CG2 3.68Å; Y14-M340 HydrophobicContact CE1-CE 4.34Å; Y14-M340 HydrophobicContact CE2-CE 4.33Å; Y14-M340 WeakPolarHBondContact OH-CE 3.43Å
15	L	88.6	Confident	87.3	Confident	106 Å²	106	51.8 Å²	51.8	56%	0.555	26%	0.264	S	S	*	.	H	α-helix	trans	-64.9	-40.9	174.4	-71.5	176.4	0	0	0	111.9	I11 V12 L18 F19	I11-L15 HydrophobicContact CG2-CD1 3.93Å; I11-L15 HydrophobicContact CG2-CG 4.35Å; I11-L15 WeakPolarHBondContact O-CB 3.43Å; I11-L15 VanDerWaalsContact O-CG 3.27Å; I11-L15 WeakPolarHBondContact O-CG 3.48Å; I11-L15 PolarHBondContact O-N 3.01Å; V12-L15 PolarHBondContact O-N 2.94Å; L15-L18 PolarHBondContact O-N 2.83Å; L15-F19 WeakPolarHBondContact O-CB 3.43Å; L15-F19 PolarHBondContact O-N 2.83Å
16	L	89.7	Confident	86.9	Confident	75 Å²	75	58.6 Å²	58.6	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-58.9	-48.9	174.8	174.8	66.2	0	0	0	111.1	V12 F13 F19 V20 V189	V12-L16 WeakPolarHBondContact O-CB 3.21Å; V12-L16 PolarHBondContact O-N 3.34Å; F13-L16 WeakPolarHBondContact O-CB 3.04Å; F13-L16 PolarHBondContact O-N 3.25Å; L16-F19 WeakPolarHBondContact O-CB 3.31Å; L16-F19 PolarHBondContact O-N 2.92Å; L16-V20 WeakPolarHBondContact O-CG2 3.39Å; L16-V20 PolarHBondContact O-N 3.49Å; L16-V189 HydrophobicContact CD2-CG1 4.38Å
17	I	87.4	Confident	86.5	Confident	7 Å²	7	62.7 Å²	62.7	4%	0.036	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-45	-179.8	-70.1	157.5	0	0	0	110.8	F13 Y14 F19 V20 G21 Y174 T186 Q190 A337	F13-I17 WeakPolarHBondContact O-CB 3.27Å; F13-I17 WeakPolarHBondContact O-CD1 3.35Å; F13-I17 WeakPolarHBondContact O-CG1 3.5Å; F13-I17 PolarHBondContact O-N 3.08Å; Y14-I17 HydrophobicContact CD1-CD1 4.46Å; Y14-I17 PolarHBondContact O-N 2.91Å; I17-F19 VanDerWaalsContact C-N 3.3Å; I17-F19 PolarHBondContact O-N 3.02Å; I17-V20 PolarHBondContact O-N 2.96Å; I17-V20 VanDerWaalsContact O-N 3.17Å; I17-G21 PolarHBondContact O-N 3.4Å; I17-Y174 HydrophobicContact CG2-CE1 4.34Å; I17-Y174 HydrophobicContact CG2-CE2 3.92Å; I17-Y174 WeakPolarHBondContact CG2-OH 3.46Å; I17-Y174 PolarHBondContact O-OH 3.48Å; I17-T186 HydrophobicContact CG2-CG2 4.06Å; I17-Q190 HydrophobicContact CD1-CG 3.77Å; I17-Q190 HydrophobicContact CG1-CG 3.86Å; I17-A337 HydrophobicContact CD1-CB 3.19Å; I17-A337 HydrophobicContact CG1-CB 4.49Å
18	L	84.8	Confident	85.3	Confident	66 Å²	66	60.3 Å²	60.3	35%	0.346	29%	0.292	S	S	.	.	H	α-helix	trans	-58.1	-43.3	175	-178.6	64.8	0	0	0	111.8	Y14 L15 G21 L22 Y174	Y14-L18 VanDerWaalsContact O-CB 3.24Å; Y14-L18 WeakPolarHBondContact O-CB 3.33Å; Y14-L18 PolarHBondContact O-N 3.47Å; L15-L18 PolarHBondContact O-N 2.83Å; L18-G21 PolarHBondContact O-N 2.95Å; L18-L22 HydrophobicContact CD1-CD1 4.14Å; L18-L22 HydrophobicContact CD1-CG 4.17Å; L18-L22 HydrophobicContact CG-CD1 4.03Å; L18-L22 HydrophobicContact CG-CG 4.44Å; L18-L22 WeakPolarHBondContact O-CB 3.45Å; L18-L22 VanDerWaalsContact O-CG 3.24Å; L18-L22 WeakPolarHBondContact O-CG 3.24Å; L18-L22 PolarHBondContact O-N 3.03Å; L18-Y174 HydrophobicContact CB-CE2 4.32Å; L18-Y174 HydrophobicContact CD1-CD2 4.23Å; L18-Y174 HydrophobicContact CD1-CE2 4.07Å
19	F	88.4	Confident	84	Confident	143 Å²	143	64.5 Å²	64.5	63%	0.627	31%	0.307	S	S	*	.	H	α-helix	trans	-60.3	-47.9	175.2	176.2	-96	0	0	0	111.8	L15 L16 I17 G21 L22 W23	L15-F19 WeakPolarHBondContact O-CB 3.43Å; L15-F19 PolarHBondContact O-N 2.83Å; L16-F19 WeakPolarHBondContact O-CB 3.31Å; L16-F19 PolarHBondContact O-N 2.92Å; I17-F19 VanDerWaalsContact C-N 3.3Å; I17-F19 PolarHBondContact O-N 3.02Å; F19-G21 PolarHBondContact O-N 3.3Å; F19-L22 PolarHBondContact O-N 3.45Å; F19-W23 VanDerWaalsContact O-CB 3.31Å; F19-W23 WeakPolarHBondContact O-CB 3.47Å; F19-W23 PolarHBondContact O-N 2.94Å
20	V	88.8	Confident	82.6	Confident	19 Å²	19	69.7 Å²	69.7	12%	0.115	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-43.2	178	174	0	0	0	0	111.2	L16 I17 W23 A24 T186 V189	L16-V20 WeakPolarHBondContact O-CG2 3.39Å; L16-V20 PolarHBondContact O-N 3.49Å; I17-V20 PolarHBondContact O-N 2.96Å; I17-V20 VanDerWaalsContact O-N 3.17Å; V20-W23 PolarHBondContact O-N 3.22Å; V20-A24 VanDerWaalsContact O-CB 3.26Å; V20-A24 WeakPolarHBondContact O-CB 3.31Å; V20-A24 PolarHBondContact O-N 3.05Å; V20-T186 HydrophobicContact CB-CG2 4.26Å; V20-T186 HydrophobicContact CG1-CG2 4.06Å; V20-V189 HydrophobicContact CG1-CG2 4.16Å; V20-V189 HydrophobicContact CG2-CG2 4.28Å
21	G	85.6	Confident	81.1	Confident	2 Å²	2	72.4 Å²	72.4	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-62.9	-48.1	178.9	0	0	0	0	0	112.2	I17 L18 F19 W23 A24 A25 S182	I17-G21 PolarHBondContact O-N 3.4Å; L18-G21 PolarHBondContact O-N 2.95Å; F19-G21 PolarHBondContact O-N 3.3Å; G21-W23 PolarHBondContact O-N 3.07Å; G21-A24 PolarHBondContact O-N 3.06Å; G21-A25 WeakPolarHBondContact O-CB 3.5Å; G21-A25 PolarHBondContact O-N 2.93Å; G21-S182 WeakPolarHBondContact CA-OG 2.94Å; G21-S182 PolarHBondContact O-OG 2.71Å
22	L	85	Confident	79.4	Confident	87 Å²	87	76 Å²	76	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-40.2	176.4	-69.5	175.2	0	0	0	112.2	L18 F19 R26	L18-L22 HydrophobicContact CD1-CD1 4.14Å; L18-L22 HydrophobicContact CD1-CG 4.17Å; L18-L22 HydrophobicContact CG-CD1 4.03Å; L18-L22 HydrophobicContact CG-CG 4.44Å; L18-L22 WeakPolarHBondContact O-CB 3.45Å; L18-L22 VanDerWaalsContact O-CG 3.24Å; L18-L22 WeakPolarHBondContact O-CG 3.24Å; L18-L22 PolarHBondContact O-N 3.03Å; F19-L22 PolarHBondContact O-N 3.45Å; L22-R26 WeakPolarHBondContact O-CG 3.37Å; L22-R26 PolarHBondContact O-N 2.97Å; L22-R26 VanDerWaalsContact O-N 3.15Å
23	W	87.5	Confident	77.6	Confident	124 Å²	124	74.6 Å²	74.6	47%	0.47	37%	0.366	S	S	.	.	H	α-helix	trans	-62.4	-47	174	170.5	82.8	0	0	0	111.7	F19 V20 G21 R26 K27 Y185	F19-W23 VanDerWaalsContact O-CB 3.31Å; F19-W23 WeakPolarHBondContact O-CB 3.47Å; F19-W23 PolarHBondContact O-N 2.94Å; V20-W23 PolarHBondContact O-N 3.22Å; G21-W23 PolarHBondContact O-N 3.07Å; W23-R26 PolarHBondContact O-N 3.3Å; W23-K27 HydrophobicContact CH2-CD 4.18Å; W23-K27 HydrophobicContact CZ2-CD 4.14Å; W23-K27 PolarHBondContact O-N 3.38Å; W23-Y185 HydrophobicContact CZ3-CD1 4.04Å; W23-Y185 HydrophobicContact CZ3-CE1 4.4Å
24	A	84.2	Confident	76	Confident	0 Å²	0	81 Å²	81	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-64.5	-41.2	178.8	0	0	0	0	0	111.8	V20 G21 R26 K27 G28 Y181 Y185	V20-A24 VanDerWaalsContact O-CB 3.26Å; V20-A24 WeakPolarHBondContact O-CB 3.31Å; V20-A24 PolarHBondContact O-N 3.05Å; G21-A24 PolarHBondContact O-N 3.06Å; A24-R26 VanDerWaalsContact C-N 3.33Å; A24-R26 PolarHBondContact O-N 3.48Å; A24-K27 WeakPolarHBondContact O-CB 3.46Å; A24-K27 PolarHBondContact O-N 2.94Å; A24-G28 PolarHBondContact O-N 2.88Å; A24-Y181 HydrophobicContact CB-CD1 4.2Å; A24-Y181 HydrophobicContact CB-CE1 4.44Å; A24-Y181 VanDerWaalsContact O-CD1 3.23Å; A24-Y181 WeakPolarHBondContact O-CD1 3.47Å; A24-Y181 WeakPolarHBondContact O-CE1 3.49Å; A24-Y185 HydrophobicContact CB-CD2 4.12Å; A24-Y185 HydrophobicContact CB-CG 4.05Å
25	A	77.2	Confident	74.8	Confident	33 Å²	33	80.1 Å²	80.1	27%	0.273	41%	0.412	S	S	.	.	H	α-helix	trans	-60.9	-39.4	176.3	0	0	0	0	0	112.4	G21 K29	G21-A25 WeakPolarHBondContact O-CB 3.5Å; G21-A25 PolarHBondContact O-N 2.93Å; A25-K29 PolarHBondContact O-N 2.9Å
26	R	79.1	Confident	73.9	Confident	191 Å²	191	78.2 Å²	78.2	72%	0.721	41%	0.405	S	S	*	.	H	α-helix	trans	-66.8	-40.2	174.2	-72.9	177.9	178.5	174.7	0.6	112.1	L22 W23 A24 T30	L22-R26 WeakPolarHBondContact O-CG 3.37Å; L22-R26 PolarHBondContact O-N 2.97Å; L22-R26 VanDerWaalsContact O-N 3.15Å; W23-R26 PolarHBondContact O-N 3.3Å; A24-R26 VanDerWaalsContact C-N 3.33Å; A24-R26 PolarHBondContact O-N 3.48Å; R26-T30 PolarHBondContact O-N 3.21Å; R26-T30 PolarHBondContact O-OG1 3.36Å
27	K	75.8	Confident	73.2	Confident	85 Å²	85	78.9 Å²	78.9	37%	0.37	41%	0.409	S	S	.	.	H	α-helix	trans	-65.2	-39.4	176.8	-170.2	175.8	-177.3	176.9	0	112.1	W23 A24 T30 N31 Y181	W23-K27 HydrophobicContact CH2-CD 4.18Å; W23-K27 HydrophobicContact CZ2-CD 4.14Å; W23-K27 PolarHBondContact O-N 3.38Å; A24-K27 WeakPolarHBondContact O-CB 3.46Å; A24-K27 PolarHBondContact O-N 2.94Å; K27-T30 PolarHBondContact O-N 3.36Å; K27-N31 PolarHBondContact O-N 3.02Å; K27-Y181 HydrophobicContact CB-CE1 4.39Å
28	G	64.9	Low	72.6	Confident	12 Å²	12	78.8 Å²	78.8	12%	0.124	41%	0.409	C	S	.	.	H	α-helix	trans	-56.4	-49.7	176.2	0	0	0	0	0	112.4	A24 T30 N31	A24-G28 PolarHBondContact O-N 2.88Å; G28-T30 PolarHBondContact O-N 2.8Å; G28-N31 PolarHBondContact O-N 3.28Å
29	K	63.7	Low	72.3	Confident	172 Å²	172	77.7 Å²	77.7	75%	0.748	40%	0.402	S	S	*	.	H	α-helix	trans	-63.6	-23.6	178.9	-70.5	-177.4	178.4	-176.2	0	114.8	A25	A25-K29 PolarHBondContact O-N 2.9Å
30	T	58.5	Low	71.9	Confident	109 Å²	109	73.3 Å²	73.3	67%	0.669	38%	0.383	S	S	*	.	H	α-helix	trans	-83.6	-26.3	-177.3	-51.4	0	0	0	0	111.6	R26 K27 G28 N32	R26-T30 PolarHBondContact O-N 3.21Å; R26-T30 PolarHBondContact O-OG1 3.36Å; K27-T30 PolarHBondContact O-N 3.36Å; G28-T30 PolarHBondContact O-N 2.8Å; T30-N32 PolarHBondContact O-N 3.34Å; T30-N32 VanDerWaalsContact O-N 3.15Å
31	N	57.2	Low	71.4	Confident	64 Å²	64	74.1 Å²	74.1	34%	0.342	39%	0.388	S	S	.	.	S	Bend	trans	-72.2	110	171.3	-71.7	-29.1	0	0	0	107.3	K27 G28 S33	K27-N31 PolarHBondContact O-N 3.02Å; G28-N31 PolarHBondContact O-N 3.28Å; N31-S33 PolarHBondContact O-N 3.03Å; N31-S33 PolarHBondContact O-OG 2.99Å
32	N	52.1	Low	71.1	Confident	163 Å²	163	74.3 Å²	74.3	87%	0.872	39%	0.389	S	S	*	.			trans	-60.7	75.5	174.3	-72.4	-26.5	0	0	0	110.9	T30 T34	T30-N32 PolarHBondContact O-N 3.34Å; T30-N32 VanDerWaalsContact O-N 3.15Å; N32-T34 PolarHBondContact O-N 2.94Å
33	S	52.9	Low	70.9	Confident	41 Å²	41	70.2 Å²	70.2	29%	0.287	37%	0.367	S	S	.	.			trans	-66.9	133.2	175	-27.6	0	0	0	0	108.2	N31 G35 E40	N31-S33 PolarHBondContact O-N 3.03Å; N31-S33 PolarHBondContact O-OG 2.99Å; S33-G35 PolarHBondContact O-N 3.33Å; S33-G35 VanDerWaalsContact O-N 3.1Å; S33-E40 WeakPolarHBondContact CB-OE1 3.21Å; S33-E40 PolarHBondContact OG-OE1 3.38Å
34	T	57.3	Low	70.5	Confident	157 Å²	157	64.7 Å²	64.7	96%	0.963	35%	0.348	S	S	*	.	S	Bend	trans	-74.6	11.6	169.9	56.7	0	0	0	0	112.8	N32	N32-T34 PolarHBondContact O-N 2.94Å
35	G	61.9	Low	70.2	Confident	26 Å²	26	65.6 Å²	65.6	27%	0.268	36%	0.358	S	S	.	.	S	Bend	trans	-90.4	169.8	-174.8	0	0	0	0	0	112.6	S33	S33-G35 PolarHBondContact O-N 3.33Å; S33-G35 VanDerWaalsContact O-N 3.1Å
36	T	70.5	Confident	70.5	Confident	66 Å²	66	66.4 Å²	66.4	41%	0.405	35%	0.353	S	S	.	.			trans	-75.6	154.4	170.1	56.1	0	0	0	0	110.7	T38 E39 E40	T36-T38 PolarHBondContact O-N 3.29Å; T36-T38 VanDerWaalsContact O-N 3.13Å; T36-T38 PolarHBondContact OG1-OG1 3Å; T36-E39 WeakPolarHBondContact O-CA 3.39Å; T36-E39 WeakPolarHBondContact O-CB 3.21Å; T36-E39 PolarHBondContact O-N 3.06Å; T36-E39 WeakPolarHBondContact OG1-CB 3.41Å; T36-E39 PolarHBondContact OG1-N 2.99Å; T36-E40 PolarHBondContact O-N 3.39Å
37	D	74	Confident	70.8	Confident	90 Å²	90	60.6 Å²	60.6	48%	0.481	34%	0.337	S	S	.	.	H	α-helix	trans	-52.4	-36	174.7	-66.8	-13.1	0	0	0	112	E40 V41	D37-E40 PolarHBondContact O-N 3.46Å; D37-V41 WeakPolarHBondContact O-CG2 3.2Å; D37-V41 PolarHBondContact O-N 3.1Å
38	T	76	Confident	71.2	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-70.9	-36.8	175.3	61.9	0	0	0	0	112.6	T36 E40 V41 M42 E369 V372 L373	T36-T38 PolarHBondContact O-N 3.29Å; T36-T38 VanDerWaalsContact O-N 3.13Å; T36-T38 PolarHBondContact OG1-OG1 3Å; T38-E40 VanDerWaalsContact C-N 3.33Å; T38-V41 PolarHBondContact O-N 3.04Å; T38-M42 WeakPolarHBondContact O-CB 3.47Å; T38-M42 WeakPolarHBondContact O-CG 3.42Å; T38-M42 PolarHBondContact O-N 2.92Å; T38-E369 WeakPolarHBondContact CB-OE2 3.39Å; T38-E369 HydrophobicContact CG2-CB 4.06Å; T38-E369 WeakPolarHBondContact CG2-OE2 3.22Å; T38-E369 PolarHBondContact OG1-OE2 3.14Å; T38-V372 HydrophobicContact CG2-CB 4.12Å; T38-V372 HydrophobicContact CG2-CG1 4.04Å; T38-L373 HydrophobicContact CG2-CD2 4.18Å; T38-L373 HydrophobicContact CG2-CG 4.22Å
39	E	78.6	Confident	72.3	Confident	43 Å²	43	57.5 Å²	57.5	20%	0.201	33%	0.327	C	S	.	.	H	α-helix	trans	-67.2	-33.9	175	-171.6	172.4	177.1	0	0	112.1	T36 L43 A44 G45 R46	T36-E39 WeakPolarHBondContact O-CA 3.39Å; T36-E39 WeakPolarHBondContact O-CB 3.21Å; T36-E39 PolarHBondContact O-N 3.06Å; T36-E39 WeakPolarHBondContact OG1-CB 3.41Å; T36-E39 PolarHBondContact OG1-N 2.99Å; E39-L43 HydrophobicContact CG-CB 4.2Å; E39-L43 HydrophobicContact CG-CD1 4.13Å; E39-L43 HydrophobicContact CG-CG 4.49Å; E39-L43 CarbonylContact O-C 3.6Å; E39-L43 WeakPolarHBondContact O-CA 3.24Å; E39-L43 WeakPolarHBondContact O-CB 3.49Å; E39-L43 PolarHBondContact O-N 3.24Å; E39-A44 PolarHBondContact O-N 3.41Å; E39-G45 PolarHBondContact O-N 2.99Å; E39-R46 WeakPolarHBondContact OE1-CD 3.31Å; E39-R46 IonicContact OE1-CZ 3.22Å; E39-R46 IonicContact OE1-NE 2.97Å; E39-R46 PolarHBondContact OE1-NE 2.86Å
40	E	78.6	Confident	73.6	Confident	51 Å²	51	51.9 Å²	51.9	24%	0.238	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-46.3	171.6	-67.6	-163.3	158.5	0	0	111.7	S33 T36 D37 T38 A44	S33-E40 WeakPolarHBondContact CB-OE1 3.21Å; S33-E40 PolarHBondContact OG-OE1 3.38Å; T36-E40 PolarHBondContact O-N 3.39Å; D37-E40 PolarHBondContact O-N 3.46Å; T38-E40 VanDerWaalsContact C-N 3.33Å; E40-A44 WeakPolarHBondContact O-CA 3.41Å; E40-A44 PolarHBondContact O-N 2.51Å
41	V	78	Confident	75.2	Confident	36 Å²	36	52.1 Å²	52.1	22%	0.218	30%	0.302	C	S	.	.	H	α-helix	trans	-71.5	-41.3	-179.2	175.9	0	0	0	0	111.8	D37 T38 L180 L373 M376	D37-V41 WeakPolarHBondContact O-CG2 3.2Å; D37-V41 PolarHBondContact O-N 3.1Å; T38-V41 PolarHBondContact O-N 3.04Å; V41-L180 WeakPolarHBondContact O-CB 3.17Å; V41-L180 PolarHBondContact O-N 2.84Å; V41-L373 HydrophobicContact CB-CD2 3.91Å; V41-L373 HydrophobicContact CG1-CD2 3.98Å; V41-L373 HydrophobicContact CG2-CD2 3.86Å; V41-M376 HydrophobicContact CG1-CE 3.48Å; V41-M376 VanDerWaalsContact CG1-CE 3.48Å; V41-M376 HydrophobicContact CG1-SD 4.33Å
42	M	79.4	Confident	76.9	Confident	6 Å²	6	50.3 Å²	50.3	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-83.2	-34.8	-174.9	-67.3	176.3	75.8	0	0	113.7	T38 V111 T112 L180 Q252 R356	T38-M42 WeakPolarHBondContact O-CB 3.47Å; T38-M42 WeakPolarHBondContact O-CG 3.42Å; T38-M42 PolarHBondContact O-N 2.92Å; M42-V111 HydrophobicContact CE-CG1 4.04Å; M42-V111 HydrophobicContact SD-CG1 4.29Å; M42-T112 HydrophobicContact CE-CG2 3.57Å; M42-L180 WeakPolarHBondContact O-CD2 3.13Å; M42-Q252 WeakPolarHBondContact O-CG 3.16Å; M42-Q252 PolarHBondContact O-NE2 2.63Å; M42-R356 HydrophobicContact CE-CB 4.17Å
43	L	81	Confident	78.9	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-127.7	7.7	-172.4	-64.5	-171.8	0	0	0	114.3	E39 G45 R46 V111 L255 S256	E39-L43 HydrophobicContact CG-CB 4.2Å; E39-L43 HydrophobicContact CG-CD1 4.13Å; E39-L43 HydrophobicContact CG-CG 4.49Å; E39-L43 CarbonylContact O-C 3.6Å; E39-L43 WeakPolarHBondContact O-CA 3.24Å; E39-L43 WeakPolarHBondContact O-CB 3.49Å; E39-L43 PolarHBondContact O-N 3.24Å; L43-G45 PolarHBondContact O-N 3.4Å; L43-G45 VanDerWaalsContact O-N 3.15Å; L43-R46 HydrophobicContact CB-CG 4.2Å; L43-R46 HydrophobicContact CD1-CG 3.9Å; L43-R46 PolarHBondContact O-N 3.36Å; L43-V111 HydrophobicContact CD1-CB 4.22Å; L43-V111 HydrophobicContact CD1-CG1 3.91Å; L43-V111 HydrophobicContact CD1-CG2 4.19Å; L43-V111 HydrophobicContact CD2-CG1 4.5Å; L43-V111 WeakPolarHBondContact CD2-O 3.36Å; L43-V111 HydrophobicContact CG-CG1 3.98Å; L43-L255 HydrophobicContact CD1-CB 4.5Å; L43-L255 HydrophobicContact CD2-CB 3.8Å; L43-S256 VanDerWaalsContact O-CB 3.24Å; L43-S256 WeakPolarHBondContact O-CB 3.34Å
44	A	80.6	Confident	80.9	Confident	7 Å²	7	41.7 Å²	41.7	6%	0.058	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	55.1	34.6	-178	0	0	0	0	0	112.1	E39 E40 R46 N47 I48 L180 Y181	E39-A44 PolarHBondContact O-N 3.41Å; E40-A44 WeakPolarHBondContact O-CA 3.41Å; E40-A44 PolarHBondContact O-N 2.51Å; A44-R46 PolarHBondContact O-N 3.3Å; A44-R46 VanDerWaalsContact O-N 3.08Å; A44-N47 PolarHBondContact O-N 3.22Å; A44-I48 HydrophobicContact CB-CD1 3.81Å; A44-I48 HydrophobicContact CB-CG1 3.83Å; A44-L180 HydrophobicContact CB-CB 4.19Å; A44-L180 HydrophobicContact CB-CD2 4.05Å; A44-L180 HydrophobicContact CB-CG 4.13Å; A44-Y181 HydrophobicContact CB-CD2 3.95Å; A44-Y181 HydrophobicContact CB-CG 4.48Å
45	G	77.9	Confident	82.7	Confident	20 Å²	20	36.6 Å²	36.6	21%	0.206	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	60.4	19.2	-178.4	0	0	0	0	0	114.2	E39 L43 N47	E39-G45 PolarHBondContact O-N 2.99Å; L43-G45 PolarHBondContact O-N 3.4Å; L43-G45 VanDerWaalsContact O-N 3.15Å; G45-N47 PolarHBondContact O-N 2.94Å
46	R	83.1	Confident	84.2	Confident	49 Å²	49	35.3 Å²	35.3	19%	0.185	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	56.3	29.4	-175.3	-57.5	-178.2	161.7	168.6	2.7	114.3	E39 L43 A44 G109 Y110 L255 S256 K258	E39-R46 WeakPolarHBondContact OE1-CD 3.31Å; E39-R46 IonicContact OE1-CZ 3.22Å; E39-R46 IonicContact OE1-NE 2.97Å; E39-R46 PolarHBondContact OE1-NE 2.86Å; L43-R46 HydrophobicContact CB-CG 4.2Å; L43-R46 HydrophobicContact CD1-CG 3.9Å; L43-R46 PolarHBondContact O-N 3.36Å; A44-R46 PolarHBondContact O-N 3.3Å; A44-R46 VanDerWaalsContact O-N 3.08Å; R46-G109 PolarHBondContact NH2-O 2.83Å; R46-Y110 PolarHBondContact NH2-O 2.89Å; R46-L255 WeakPolarHBondContact CG-O 3.19Å; R46-S256 CarbonylContact C-O 3.56Å; R46-S256 VanDerWaalsContact CA-O 3.25Å; R46-S256 WeakPolarHBondContact CA-O 3.49Å; R46-K258 WeakPolarHBondContact O-CA 2.93Å
47	N	83.9	Confident	85.3	Confident	70 Å²	70	32.2 Å²	32.2	37%	0.374	18%	0.176	S	C	.	.			trans	-112.2	17.8	-173.8	-158.9	14	0	0	0	113	A44 G45 G49 K258	A44-N47 PolarHBondContact O-N 3.22Å; G45-N47 PolarHBondContact O-N 2.94Å; N47-G49 PolarHBondContact O-N 3.23Å; N47-K258 WeakPolarHBondContact O-CE 3.34Å; N47-K258 WeakPolarHBondContact OD1-CE 3.4Å; N47-K258 PolarHBondContact OD1-NZ 3.22Å
48	I	84.8	Confident	86.4	Confident	6 Å²	6	28.2 Å²	28.2	3%	0.031	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-73.5	119	175.4	-63.8	-171.2	0	0	0	109.1	A44 V52 L180 A184 S256 K258	A44-I48 HydrophobicContact CB-CD1 3.81Å; A44-I48 HydrophobicContact CB-CG1 3.83Å; I48-V52 HydrophobicContact CG2-CB 4.06Å; I48-V52 HydrophobicContact CG2-CG1 3.98Å; I48-L180 HydrophobicContact CD1-CD2 4.43Å; I48-A184 HydrophobicContact CD1-CB 3.74Å; I48-S256 PolarHBondContact N-O 2.94Å; I48-K258 WeakPolarHBondContact O-CG 3.09Å; I48-K258 PolarHBondContact O-N 3.48Å
49	G	87.5	Confident	87.3	Confident	25 Å²	25	28.2 Å²	28.2	26%	0.258	16%	0.156	S	C	.	.			trans	-72.2	159.3	175.7	0	0	0	0	0	112.2	N47 L51 V52 G53	N47-G49 PolarHBondContact O-N 3.23Å; G49-L51 PolarHBondContact O-N 3.39Å; G49-V52 PolarHBondContact O-N 3.26Å; G49-G53 PolarHBondContact O-N 2.98Å
50	L	91.6	Very high	87.9	Confident	54 Å²	54	26.2 Å²	26.2	28%	0.283	15%	0.146	S	C	.	.	H	α-helix	trans	-52.3	-48.3	-173	-179.7	60.9	0	0	0	113.8	G53 I54 Q262 I265 L266	L50-G53 PolarHBondContact O-N 2.92Å; L50-I54 HydrophobicContact CD1-CD1 3.94Å; L50-I54 HydrophobicContact CD1-CG1 4.16Å; L50-I54 HydrophobicContact CG-CD1 3.85Å; L50-I54 HydrophobicContact CG-CG1 4.49Å; L50-I54 VanDerWaalsContact O-CG1 3.3Å; L50-I54 WeakPolarHBondContact O-CG1 3.34Å; L50-I54 PolarHBondContact O-N 3.39Å; L50-Q262 HydrophobicContact CB-CG 4.15Å; L50-Q262 HydrophobicContact CD1-CB 4.12Å; L50-Q262 HydrophobicContact CD1-CG 4.21Å; L50-I265 HydrophobicContact CD1-CB 4.03Å; L50-I265 HydrophobicContact CD1-CG2 3.89Å; L50-I265 HydrophobicContact CD2-CG2 4.2Å; L50-L266 HydrophobicContact CD1-CB 4.24Å
51	L	93.3	Very high	88.6	Confident	115 Å²	115	23.9 Å²	23.9	60%	0.602	14%	0.136	S	C	*	.	H	α-helix	trans	-63.1	-48.5	-176.6	-172.2	70.1	0	0	0	112	G49 G53 I54 F55	G49-L51 PolarHBondContact O-N 3.39Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 2.92Å; L51-I54 PolarHBondContact O-N 3.47Å; L51-F55 HydrophobicContact CD1-CD2 4.18Å; L51-F55 HydrophobicContact CD1-CE2 3.46Å; L51-F55 VanDerWaalsContact CD1-CE2 3.46Å; L51-F55 HydrophobicContact CD1-CZ 4.01Å; L51-F55 HydrophobicContact CD2-CE2 4.19Å; L51-F55 HydrophobicContact CG-CD2 3.96Å; L51-F55 HydrophobicContact CG-CE2 3.56Å; L51-F55 WeakPolarHBondContact O-CD2 3.44Å; L51-F55 PolarHBondContact O-N 3.06Å; L51-F55 VanDerWaalsContact O-N 3.14Å
52	V	92.2	Very high	89.4	Confident	25 Å²	25	22.2 Å²	22.2	15%	0.152	13%	0.125	C	C	.	.	H	α-helix	trans	-60.8	-44.9	175.2	178.4	0	0	0	0	109.4	I48 G49 I54 F55 T56 A184 Y185 V188	I48-V52 HydrophobicContact CG2-CB 4.06Å; I48-V52 HydrophobicContact CG2-CG1 3.98Å; G49-V52 PolarHBondContact O-N 3.26Å; V52-I54 PolarHBondContact O-N 3.16Å; V52-F55 PolarHBondContact O-N 2.79Å; V52-T56 WeakPolarHBondContact O-CG2 3.5Å; V52-T56 PolarHBondContact O-N 3.37Å; V52-A184 HydrophobicContact CG1-CB 4.25Å; V52-Y185 HydrophobicContact CG1-CE2 4.48Å; V52-Y185 HydrophobicContact CG2-CE1 4.26Å; V52-V188 HydrophobicContact CG1-CG2 4.1Å
53	G	93.3	Very high	90	Very high	2 Å²	2	22 Å²	22	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-56.3	-42.7	177.6	0	0	0	0	0	114.1	G49 L50 L51 T56 M57	G49-G53 PolarHBondContact O-N 2.98Å; L50-G53 PolarHBondContact O-N 2.92Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 2.92Å; G53-T56 WeakPolarHBondContact O-CG2 3.42Å; G53-M57 WeakPolarHBondContact O-CB 3.42Å; G53-M57 PolarHBondContact O-N 3.31Å
54	I	95.5	Very high	90.5	Very high	22 Å²	22	21.9 Å²	21.9	11%	0.113	12%	0.124	C	C	.	.	H	α-helix	trans	-62.1	-54.6	175.1	-71	162.3	0	0	0	109.7	L50 L51 V52 T56 M57 T58 L266 V269	L50-I54 HydrophobicContact CD1-CD1 3.94Å; L50-I54 HydrophobicContact CD1-CG1 4.16Å; L50-I54 HydrophobicContact CG-CD1 3.85Å; L50-I54 HydrophobicContact CG-CG1 4.49Å; L50-I54 VanDerWaalsContact O-CG1 3.3Å; L50-I54 WeakPolarHBondContact O-CG1 3.34Å; L50-I54 PolarHBondContact O-N 3.39Å; L51-I54 PolarHBondContact O-N 3.47Å; V52-I54 PolarHBondContact O-N 3.16Å; I54-T56 PolarHBondContact O-N 3.42Å; I54-M57 PolarHBondContact O-N 3.29Å; I54-T58 PolarHBondContact O-N 3.18Å; I54-T58 PolarHBondContact O-OG1 3.36Å; I54-T58 VanDerWaalsContact O-OG1 3.05Å; I54-L266 HydrophobicContact CG1-CB 3.84Å; I54-V269 HydrophobicContact CD1-CB 4.09Å; I54-V269 HydrophobicContact CD1-CG1 4.08Å; I54-V269 HydrophobicContact CD1-CG2 4.26Å; I54-V269 HydrophobicContact CG1-CB 4.08Å; I54-V269 HydrophobicContact CG1-CG1 4.28Å; I54-V269 HydrophobicContact CG2-CB 4.04Å; I54-V269 HydrophobicContact CG2-CG1 3.54Å
55	F	95.1	Very high	91.1	Very high	49 Å²	49	21.6 Å²	21.6	22%	0.215	12%	0.121	C	C	.	.	H	α-helix	trans	-66	-41.2	-176	-68.2	-50.5	0	0	0	112.4	L51 V52 T58 A59 V188 L191 F192	L51-F55 HydrophobicContact CD1-CD2 4.18Å; L51-F55 HydrophobicContact CD1-CE2 3.46Å; L51-F55 VanDerWaalsContact CD1-CE2 3.46Å; L51-F55 HydrophobicContact CD1-CZ 4.01Å; L51-F55 HydrophobicContact CD2-CE2 4.19Å; L51-F55 HydrophobicContact CG-CD2 3.96Å; L51-F55 HydrophobicContact CG-CE2 3.56Å; L51-F55 WeakPolarHBondContact O-CD2 3.44Å; L51-F55 PolarHBondContact O-N 3.06Å; L51-F55 VanDerWaalsContact O-N 3.14Å; V52-F55 PolarHBondContact O-N 2.79Å; F55-T58 PolarHBondContact O-N 2.9Å; F55-A59 VanDerWaalsContact O-CB 3.23Å; F55-A59 WeakPolarHBondContact O-CB 3.37Å; F55-A59 PolarHBondContact O-N 3.05Å; F55-V188 HydrophobicContact CB-CB 4.21Å; F55-V188 HydrophobicContact CB-CG1 4.12Å; F55-V188 HydrophobicContact CB-CG2 3.68Å; F55-V188 HydrophobicContact CD2-CG1 3.92Å; F55-V188 HydrophobicContact CG-CG1 4.24Å; F55-L191 HydrophobicContact CB-CD2 4.15Å; F55-L191 HydrophobicContact CD1-CD2 3.74Å; F55-L191 HydrophobicContact CG-CD2 4.4Å; F55-F192 HydrophobicContact CD2-CE2 4.4Å; F55-F192 HydrophobicContact CD2-CZ 4.47Å; F55-F192 HydrophobicContact CE1-CE1 4.45Å; F55-F192 AromaticContact CE1-CZ 3.92Å; F55-F192 HydrophobicContact CE1-CZ 3.92Å; F55-F192 HydrophobicContact CE2-CE2 4.16Å; F55-F192 AromaticContact CE2-CZ 3.84Å; F55-F192 HydrophobicContact CE2-CZ 3.84Å; F55-F192 HydrophobicContact CZ-CE1 4.34Å; F55-F192 HydrophobicContact CZ-CE2 4.25Å; F55-F192 AromaticContact CZ-CZ 3.55Å; F55-F192 HydrophobicContact CZ-CZ 3.55Å
56	T	92.9	Very high	91.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.4	-38.8	175.6	-178.5	0	0	0	0	112	V52 G53 I54 T60 A184 D187 R253	V52-T56 WeakPolarHBondContact O-CG2 3.5Å; V52-T56 PolarHBondContact O-N 3.37Å; G53-T56 WeakPolarHBondContact O-CG2 3.42Å; I54-T56 PolarHBondContact O-N 3.42Å; T56-T60 VanDerWaalsContact O-CB 3.24Å; T56-T60 WeakPolarHBondContact O-CB 3.35Å; T56-T60 PolarHBondContact O-N 2.83Å; T56-T60 PolarHBondContact O-OG1 2.78Å; T56-A184 HydrophobicContact CG2-CB 4.14Å; T56-D187 PolarHBondContact OG1-OD2 3.06Å; T56-R253 PolarHBondContact OG1-NE 2.92Å; T56-R253 PolarHBondContact OG1-NH2 3.41Å
57	M	95.2	Very high	92.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63	-50.1	174.9	-177.2	70	90.8	0	0	110.3	G53 I54 A59 T60 W61 L94 Y250 R253 V254 L266 A270	G53-M57 WeakPolarHBondContact O-CB 3.42Å; G53-M57 PolarHBondContact O-N 3.31Å; I54-M57 PolarHBondContact O-N 3.29Å; M57-A59 PolarHBondContact O-N 3.45Å; M57-T60 WeakPolarHBondContact O-CB 2.95Å; M57-T60 PolarHBondContact O-N 2.95Å; M57-W61 VanDerWaalsContact O-CD1 3.26Å; M57-W61 PolarHBondContact O-N 2.79Å; M57-L94 HydrophobicContact CG-CD2 4.49Å; M57-L94 HydrophobicContact SD-CD2 4.2Å; M57-Y250 HydrophobicContact CE-CD2 3.31Å; M57-Y250 HydrophobicContact CE-CE2 3.52Å; M57-Y250 HydrophobicContact CE-CG 4.39Å; M57-Y250 HydrophobicContact SD-CD2 3.76Å; M57-Y250 HydrophobicContact SD-CE2 4.4Å; M57-R253 HydrophobicContact CE-CB 3.47Å; M57-R253 VanDerWaalsContact CE-CB 3.47Å; M57-R253 HydrophobicContact CE-CG 4.36Å; M57-R253 HydrophobicContact SD-CB 3.82Å; M57-R253 HydrophobicContact SD-CG 4.05Å; M57-V254 HydrophobicContact CE-CG2 4Å; M57-L266 HydrophobicContact CB-CD1 4.06Å; M57-L266 HydrophobicContact CE-CD1 3.22Å; M57-L266 HydrophobicContact CG-CD1 4.05Å; M57-L266 HydrophobicContact SD-CD1 4.49Å; M57-A270 HydrophobicContact CB-CB 3.76Å; M57-A270 HydrophobicContact CG-CB 3.38Å
58	T	96.1	Very high	93.1	Very high	6 Å²	6	15 Å²	15	4%	0.037	9%	0.085	C	C	.	.	H	α-helix	trans	-58.5	-50.3	177.4	-54	0	0	0	0	111.6	I54 F55 T60 W61 V62 L191 A270	I54-T58 PolarHBondContact O-N 3.18Å; I54-T58 PolarHBondContact O-OG1 3.36Å; I54-T58 VanDerWaalsContact O-OG1 3.05Å; F55-T58 PolarHBondContact O-N 2.9Å; T58-T60 VanDerWaalsContact C-N 3.3Å; T58-T60 PolarHBondContact O-N 3.01Å; T58-W61 PolarHBondContact O-N 3.39Å; T58-V62 HydrophobicContact CG2-CG2 4.05Å; T58-V62 WeakPolarHBondContact O-CB 3.43Å; T58-V62 VanDerWaalsContact O-CG2 3.22Å; T58-V62 WeakPolarHBondContact O-CG2 3.07Å; T58-V62 PolarHBondContact O-N 3.27Å; T58-L191 HydrophobicContact CG2-CD1 3.97Å; T58-L191 HydrophobicContact CG2-CD2 3.9Å; T58-A270 WeakPolarHBondContact OG1-CA 3.25Å
59	A	94.2	Very high	93.7	Very high	6 Å²	6	14.7 Å²	14.7	5%	0.05	8%	0.083	C	C	.	.	H	α-helix	trans	-59.6	-40.3	-178.8	0	0	0	0	0	112.6	F55 M57 W61 V62 D187 L191	F55-A59 VanDerWaalsContact O-CB 3.23Å; F55-A59 WeakPolarHBondContact O-CB 3.37Å; F55-A59 PolarHBondContact O-N 3.05Å; M57-A59 PolarHBondContact O-N 3.45Å; A59-W61 VanDerWaalsContact C-N 3.28Å; A59-W61 PolarHBondContact O-N 3.42Å; A59-V62 CarbonylContact O-C 3.5Å; A59-V62 PolarHBondContact O-N 3.08Å; A59-D187 HydrophobicContact CB-CB 3.65Å; A59-D187 WeakPolarHBondContact CB-O 3.39Å; A59-L191 HydrophobicContact CB-CB 4.02Å
60	T	92.8	Very high	94.2	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-55.7	-45.9	178.8	-67.4	0	0	0	0	111	T56 M57 T58 W140 V249 R253 S342	T56-T60 VanDerWaalsContact O-CB 3.24Å; T56-T60 WeakPolarHBondContact O-CB 3.35Å; T56-T60 PolarHBondContact O-N 2.83Å; T56-T60 PolarHBondContact O-OG1 2.78Å; M57-T60 WeakPolarHBondContact O-CB 2.95Å; M57-T60 PolarHBondContact O-N 2.95Å; T58-T60 VanDerWaalsContact C-N 3.3Å; T58-T60 PolarHBondContact O-N 3.01Å; T60-W140 HydrophobicContact CG2-CH2 3.92Å; T60-W140 WeakPolarHBondContact O-CH2 3.31Å; T60-W140 WeakPolarHBondContact O-CZ2 3.49Å; T60-V249 HydrophobicContact CG2-CB 4.21Å; T60-V249 HydrophobicContact CG2-CG1 3.88Å; T60-V249 HydrophobicContact CG2-CG2 3.32Å; T60-R253 PolarHBondContact OG1-NE 3.07Å; T60-R253 PolarHBondContact OG1-NH2 3.45Å; T60-R253 VanDerWaalsContact OG1-NH2 3.12Å; T60-S342 PolarHBondContact O-OG 2.83Å
61	W	93.2	Very high	94.5	Very high	3 Å²	3	10.9 Å²	10.9	1%	0.011	6%	0.057	C	C	.	.	H	α-helix	trans	-79	-32.4	-178.9	-75.9	83.7	0	0	0	113.1	M57 T58 A59 G63 Y66 Y90 L94 W247	M57-W61 VanDerWaalsContact O-CD1 3.26Å; M57-W61 PolarHBondContact O-N 2.79Å; T58-W61 PolarHBondContact O-N 3.39Å; A59-W61 VanDerWaalsContact C-N 3.28Å; A59-W61 PolarHBondContact O-N 3.42Å; W61-G63 PolarHBondContact O-N 2.82Å; W61-Y66 WeakPolarHBondContact O-CB 3.45Å; W61-Y66 VanDerWaalsContact O-CD2 3.3Å; W61-Y66 WeakPolarHBondContact O-CD2 3.31Å; W61-Y90 HydrophobicContact CE3-CD1 4.38Å; W61-Y90 AromaticContact CE3-CG 3.99Å; W61-Y90 HydrophobicContact CE3-CG 3.99Å; W61-Y90 AromaticContact CH2-CD1 3.94Å; W61-Y90 HydrophobicContact CH2-CD1 3.94Å; W61-Y90 HydrophobicContact CH2-CG 4.34Å; W61-Y90 VanDerWaalsContact CZ3-CB 3.45Å; W61-Y90 AromaticContact CZ3-CD1 3.36Å; W61-Y90 HydrophobicContact CZ3-CD1 3.36Å; W61-Y90 HydrophobicContact CZ3-CD2 4.16Å; W61-Y90 HydrophobicContact CZ3-CE1 4.06Å; W61-Y90 AromaticContact CZ3-CG 3.4Å; W61-Y90 HydrophobicContact CZ3-CG 3.4Å; W61-L94 HydrophobicContact CG-CD1 4.48Å; W61-L94 HydrophobicContact CZ2-CD2 3.88Å; W61-L94 HydrophobicContact CZ2-CG 4.44Å; W61-W247 HydrophobicContact CH2-CE3 4.4Å
62	V	93.9	Very high	94.6	Very high	1 Å²	1	6 Å²	6	1%	0.006	3%	0.031	C	C	.	.	S	Bend	trans	-79.3	64.5	178.5	179	0	0	0	0	109.9	T58 A59 Y66 I67 M277	T58-V62 HydrophobicContact CG2-CG2 4.05Å; T58-V62 WeakPolarHBondContact O-CB 3.43Å; T58-V62 VanDerWaalsContact O-CG2 3.22Å; T58-V62 WeakPolarHBondContact O-CG2 3.07Å; T58-V62 PolarHBondContact O-N 3.27Å; A59-V62 CarbonylContact O-C 3.5Å; A59-V62 PolarHBondContact O-N 3.08Å; V62-Y66 HydrophobicContact CG2-CD1 4.32Å; V62-Y66 HydrophobicContact CG2-CE1 4.39Å; V62-I67 HydrophobicContact CG1-CD1 3.57Å; V62-I67 HydrophobicContact CG1-CG1 4.02Å; V62-I67 WeakPolarHBondContact O-CD1 3.42Å; V62-M277 HydrophobicContact CB-CB 4.45Å; V62-M277 HydrophobicContact CG1-CB 3.83Å; V62-M277 HydrophobicContact CG1-CE 3.93Å; V62-M277 HydrophobicContact CG1-CG 4.13Å; V62-M277 HydrophobicContact CG2-CB 3.64Å; V62-M277 HydrophobicContact CG2-CG 3.98Å
63	G	91.4	Very high	94.8	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	2%	0.024	C	C	.	.	S	Bend	trans	-104.7	-165.4	179.8	0	0	0	0	0	114.3	W61 G65 Y66 I67 S342	W61-G63 PolarHBondContact O-N 2.82Å; G63-G65 PolarHBondContact O-N 3.42Å; G63-Y66 WeakPolarHBondContact O-CA 3.28Å; G63-Y66 WeakPolarHBondContact O-CB 3.42Å; G63-Y66 PolarHBondContact O-N 3.23Å; G63-I67 WeakPolarHBondContact O-CD1 3.43Å; G63-I67 PolarHBondContact O-N 3.15Å; G63-S342 WeakPolarHBondContact CA-OG 3.35Å
64	G	91.8	Very high	95	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-60.6	-42.2	-176.8	0	0	0	0	0	114.1	Y66 I67 N68 G69 A147	G64-Y66 VanDerWaalsContact C-N 3.31Å; G64-Y66 PolarHBondContact O-N 3.19Å; G64-I67 PolarHBondContact O-N 3.24Å; G64-N68 WeakPolarHBondContact O-CA 3.48Å; G64-N68 VanDerWaalsContact O-CB 3.25Å; G64-N68 WeakPolarHBondContact O-CB 3.46Å; G64-N68 PolarHBondContact O-N 3.41Å; G64-G69 PolarHBondContact O-N 3.34Å; G64-G69 VanDerWaalsContact O-N 3.17Å; G64-A147 VanDerWaalsContact CA-CB 3.48Å
65	G	93.4	Very high	95.1	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.018	C	C	.	.	I	π-helix	trans	-57.4	-45.8	170.7	0	0	0	0	0	112.2	G63 I67 G69 T70 W401	G63-G65 PolarHBondContact O-N 3.42Å; G65-I67 PolarHBondContact O-N 2.99Å; G65-G69 CarbonylContact O-C 3.57Å; G65-G69 WeakPolarHBondContact O-CA 3.18Å; G65-G69 PolarHBondContact O-N 3.29Å; G65-G69 VanDerWaalsContact O-N 3.08Å; G65-T70 PolarHBondContact O-N 2.86Å; G65-W401 VanDerWaalsContact C-CD2 3.44Å; G65-W401 VanDerWaalsContact O-CZ3 3.27Å; G65-W401 WeakPolarHBondContact O-CZ3 3.37Å
66	Y	94.9	Very high	95	Very high	0 Å²	0	2.5 Å²	2.5	0%	0	1%	0.014	C	C	.	.	I	π-helix	trans	-65.5	-39.5	-178.1	-153.7	-78.2	0	0	0	113.2	W61 V62 G63 G64 T70 P87 C274 A278 W401	W61-Y66 WeakPolarHBondContact O-CB 3.45Å; W61-Y66 VanDerWaalsContact O-CD2 3.3Å; W61-Y66 WeakPolarHBondContact O-CD2 3.31Å; V62-Y66 HydrophobicContact CG2-CD1 4.32Å; V62-Y66 HydrophobicContact CG2-CE1 4.39Å; G63-Y66 WeakPolarHBondContact O-CA 3.28Å; G63-Y66 WeakPolarHBondContact O-CB 3.42Å; G63-Y66 PolarHBondContact O-N 3.23Å; G64-Y66 VanDerWaalsContact C-N 3.31Å; G64-Y66 PolarHBondContact O-N 3.19Å; Y66-T70 WeakPolarHBondContact O-CB 3.48Å; Y66-T70 PolarHBondContact O-OG1 3.5Å; Y66-P87 HydrophobicContact CE1-CB 4.18Å; Y66-P87 HydrophobicContact CE2-CB 4.16Å; Y66-P87 WeakPolarHBondContact OH-CB 3.35Å; Y66-P87 PolarHBondContact OH-O 3.48Å; Y66-C274 WeakPolarHBondContact CE1-O 3.26Å; Y66-C274 HydrophobicContact CE2-CB 4.29Å; Y66-C274 PolarHBondContact OH-O 3.15Å; Y66-A278 HydrophobicContact CE1-CB 3.66Å; Y66-W401 VanDerWaalsContact CA-CH2 3.44Å; Y66-W401 AromaticContact CD2-CH2 3.42Å; Y66-W401 HydrophobicContact CD2-CH2 3.42Å; Y66-W401 VanDerWaalsContact CD2-CH2 3.42Å; Y66-W401 AromaticContact CD2-CZ2 3.32Å; Y66-W401 HydrophobicContact CD2-CZ2 3.32Å; Y66-W401 AromaticContact CE2-CH2 3.97Å; Y66-W401 HydrophobicContact CE2-CH2 3.97Å; Y66-W401 HydrophobicContact CE2-CZ2 4.04Å; Y66-W401 AromaticContact CG-CH2 3.79Å; Y66-W401 HydrophobicContact CG-CH2 3.79Å; Y66-W401 AromaticContact CG-CZ2 3.97Å; Y66-W401 HydrophobicContact CG-CZ2 3.97Å
67	I	96.1	Very high	94.8	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.038	C	C	.	.	I	π-helix	trans	-95.6	-63.6	-172.7	-69.1	147.6	0	0	0	110.5	V62 G63 G64 G65 A71 I194 L198 S281 L315	V62-I67 HydrophobicContact CG1-CD1 3.57Å; V62-I67 HydrophobicContact CG1-CG1 4.02Å; V62-I67 WeakPolarHBondContact O-CD1 3.42Å; G63-I67 WeakPolarHBondContact O-CD1 3.43Å; G63-I67 PolarHBondContact O-N 3.15Å; G64-I67 PolarHBondContact O-N 3.24Å; G65-I67 PolarHBondContact O-N 2.99Å; I67-A71 PolarHBondContact O-N 3.43Å; I67-A71 VanDerWaalsContact O-N 3.15Å; I67-I194 HydrophobicContact CD1-CD1 3.21Å; I67-I194 HydrophobicContact CD1-CG1 4.36Å; I67-I194 HydrophobicContact CG1-CD1 4.24Å; I67-L198 HydrophobicContact CG1-CD1 4.42Å; I67-L198 HydrophobicContact CG2-CD1 4.02Å; I67-S281 WeakPolarHBondContact CA-OG 3.45Å; I67-S281 WeakPolarHBondContact O-CB 3.47Å; I67-L315 HydrophobicContact CG2-CD1 3.33Å; I67-L315 HydrophobicContact CG2-CD2 4.27Å; I67-L315 HydrophobicContact CG2-CG 4.45Å
68	N	96.5	Very high	94.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.07	C	C	.	.	I	π-helix	trans	-66.8	-43.8	-179.8	-57.4	60.1	0	0	0	111	G64 A71 E72 A147 T151 I397	G64-N68 WeakPolarHBondContact O-CA 3.48Å; G64-N68 VanDerWaalsContact O-CB 3.25Å; G64-N68 WeakPolarHBondContact O-CB 3.46Å; G64-N68 PolarHBondContact O-N 3.41Å; N68-A71 PolarHBondContact O-N 3.47Å; N68-E72 VanDerWaalsContact O-CB 3.31Å; N68-E72 WeakPolarHBondContact O-CB 3.2Å; N68-E72 PolarHBondContact O-N 2.78Å; N68-A147 HydrophobicContact CB-CB 3.83Å; N68-A147 PolarHBondContact ND2-O 2.92Å; N68-T151 PolarHBondContact ND2-OG1 2.57Å; N68-I397 HydrophobicContact CB-CD1 3.86Å; N68-I397 HydrophobicContact CB-CG2 4.44Å
69	G	96.6	Very high	94.3	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.08	C	C	.	.	I	π-helix	trans	-66.1	-38.4	179.8	0	0	0	0	0	113.2	G64 G65 E72 N73 Y398	G64-G69 PolarHBondContact O-N 3.34Å; G64-G69 VanDerWaalsContact O-N 3.17Å; G65-G69 CarbonylContact O-C 3.57Å; G65-G69 WeakPolarHBondContact O-CA 3.18Å; G65-G69 PolarHBondContact O-N 3.29Å; G65-G69 VanDerWaalsContact O-N 3.08Å; G69-E72 WeakPolarHBondContact O-CB 3.35Å; G69-E72 PolarHBondContact O-N 2.75Å; G69-N73 WeakPolarHBondContact O-CB 3.28Å; G69-N73 PolarHBondContact O-N 3.44Å; G69-Y398 WeakPolarHBondContact O-CD2 3.14Å
70	T	97.7	Very high	94.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.5	-41.1	174.8	-61.4	0	0	0	0	111.8	G65 Y66 T74 P87 V282	G65-T70 PolarHBondContact O-N 2.86Å; Y66-T70 WeakPolarHBondContact O-CB 3.48Å; Y66-T70 PolarHBondContact O-OG1 3.5Å; T70-T74 VanDerWaalsContact O-CB 3.3Å; T70-T74 WeakPolarHBondContact O-CB 3.4Å; T70-T74 PolarHBondContact O-N 3.02Å; T70-T74 PolarHBondContact O-OG1 3.18Å; T70-P87 HydrophobicContact CG2-CG 4Å; T70-P87 WeakPolarHBondContact OG1-CG 3.39Å; T70-V282 HydrophobicContact CG2-CG2 3.53Å
71	A	97.9	Very high	94.5	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.2	-43.8	175.3	0	0	0	0	0	111.5	I67 N68 T74 Y75 S281 I284 G285 I314 L315	I67-A71 PolarHBondContact O-N 3.43Å; I67-A71 VanDerWaalsContact O-N 3.15Å; N68-A71 PolarHBondContact O-N 3.47Å; A71-T74 PolarHBondContact O-N 2.85Å; A71-Y75 WeakPolarHBondContact O-CB 3.38Å; A71-Y75 PolarHBondContact O-N 3.09Å; A71-S281 WeakPolarHBondContact CA-O 3.32Å; A71-S281 WeakPolarHBondContact CB-O 3.49Å; A71-I284 HydrophobicContact CB-CG2 4.31Å; A71-G285 WeakPolarHBondContact O-CA 3.46Å; A71-I314 HydrophobicContact CB-CG2 3.94Å; A71-L315 HydrophobicContact CB-CB 3.86Å; A71-L315 HydrophobicContact CB-CD1 3.91Å; A71-L315 HydrophobicContact CB-CG 4.5Å
72	E	97.1	Very high	94.7	Very high	11 Å²	11	18.2 Å²	18.2	5%	0.051	11%	0.105	C	C	.	.	H	α-helix	trans	-54.1	-53.1	173.8	175.5	-167.2	172.9	0	0	111	N68 G69 Y75 N76 M311 K312 S396 I397 Y398	N68-E72 VanDerWaalsContact O-CB 3.31Å; N68-E72 WeakPolarHBondContact O-CB 3.2Å; N68-E72 PolarHBondContact O-N 2.78Å; G69-E72 WeakPolarHBondContact O-CB 3.35Å; G69-E72 PolarHBondContact O-N 2.75Å; E72-Y75 PolarHBondContact O-N 3.07Å; E72-N76 PolarHBondContact O-N 3.39Å; E72-M311 HydrophobicContact CG-CB 4.19Å; E72-K312 HydrophobicContact CG-CB 4.5Å; E72-S396 VanDerWaalsContact OE1-CA 3.29Å; E72-S396 WeakPolarHBondContact OE1-CA 3.4Å; E72-S396 WeakPolarHBondContact OE1-CB 3.49Å; E72-S396 PolarHBondContact OE1-OG 2.88Å; E72-I397 WeakPolarHBondContact OE2-CA 3.09Å; E72-I397 VanDerWaalsContact OE2-CB 3.25Å; E72-I397 WeakPolarHBondContact OE2-CB 3.25Å; E72-I397 PolarHBondContact OE2-N 2.81Å; E72-Y398 PolarHBondContact OE2-N 3.07Å
73	N	96.2	Very high	94.8	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-73.2	-32.4	-174.7	-162.7	94.2	0	0	0	112.4	G69 N76 Q79 G80 W83 C84 Y398	G69-N73 WeakPolarHBondContact O-CB 3.28Å; G69-N73 PolarHBondContact O-N 3.44Å; N73-N76 PolarHBondContact O-N 3.28Å; N73-Q79 PolarHBondContact OD1-OE1 3.41Å; N73-G80 PolarHBondContact ND2-O 3.4Å; N73-G80 CarbonylContact O-C 3.5Å; N73-G80 WeakPolarHBondContact O-CA 3.35Å; N73-G80 PolarHBondContact O-N 3.48Å; N73-G80 VanDerWaalsContact O-N 3.11Å; N73-W83 VanDerWaalsContact ND2-C 3.26Å; N73-W83 PolarHBondContact ND2-O 3.07Å; N73-C84 VanDerWaalsContact C-SG 3.52Å; N73-C84 VanDerWaalsContact CB-SG 3.55Å; N73-C84 PolarHBondContact ND2-N 3.41Å; N73-C84 PolarHBondContact ND2-SG 3.37Å; N73-Y398 HydrophobicContact CB-CD1 3.98Å; N73-Y398 HydrophobicContact CB-CD2 3.82Å; N73-Y398 HydrophobicContact CB-CE1 4.28Å; N73-Y398 HydrophobicContact CB-CE2 4.13Å; N73-Y398 HydrophobicContact CB-CG 3.72Å; N73-Y398 WeakPolarHBondContact OD1-CD1 3.27Å; N73-Y398 VanDerWaalsContact OD1-CE1 3.29Å; N73-Y398 WeakPolarHBondContact OD1-CE1 3.35Å
74	T	97.6	Very high	95	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-69.1	-37	173.9	-57.4	0	0	0	0	111.2	T70 A71 N76 L81 C84 W221 V282 A286	T70-T74 VanDerWaalsContact O-CB 3.3Å; T70-T74 WeakPolarHBondContact O-CB 3.4Å; T70-T74 PolarHBondContact O-N 3.02Å; T70-T74 PolarHBondContact O-OG1 3.18Å; A71-T74 PolarHBondContact O-N 2.85Å; T74-N76 VanDerWaalsContact C-N 3.35Å; T74-L81 HydrophobicContact CG2-CB 4.44Å; T74-C84 PolarHBondContact N-SG 2.96Å; T74-C84 PolarHBondContact OG1-SG 2.89Å; T74-W221 HydrophobicContact CG2-CB 4.4Å; T74-W221 HydrophobicContact CG2-CE3 4.08Å; T74-W221 WeakPolarHBondContact O-CB 3.5Å; T74-V282 HydrophobicContact CG2-CG1 4.14Å; T74-A286 HydrophobicContact CG2-CB 4.49Å
75	Y	96.1	Very high	95.3	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-70	-32.1	177.1	172.4	-102.6	0	0	0	112.6	A71 E72 P77 G288 A289 L304 P305 M311 I314	A71-Y75 WeakPolarHBondContact O-CB 3.38Å; A71-Y75 PolarHBondContact O-N 3.09Å; E72-Y75 PolarHBondContact O-N 3.07Å; Y75-P77 WeakPolarHBondContact O-CD 3.44Å; Y75-G288 VanDerWaalsContact CD2-C 3.48Å; Y75-G288 WeakPolarHBondContact CE2-O 3.27Å; Y75-A289 HydrophobicContact CD2-CB 3.87Å; Y75-A289 VanDerWaalsContact CD2-N 3.33Å; Y75-A289 HydrophobicContact CE2-CB 4.29Å; Y75-L304 WeakPolarHBondContact OH-CB 3.29Å; Y75-P305 HydrophobicContact CE1-CG 4.45Å; Y75-P305 WeakPolarHBondContact CE1-O 3.47Å; Y75-P305 VanDerWaalsContact CZ-O 3.27Å; Y75-P305 WeakPolarHBondContact OH-CD 3.3Å; Y75-P305 VanDerWaalsContact OH-CG 3.31Å; Y75-P305 WeakPolarHBondContact OH-CG 3.37Å; Y75-P305 PolarHBondContact OH-O 3.38Å; Y75-M311 HydrophobicContact CD1-CB 4.16Å; Y75-M311 HydrophobicContact CD1-CG 3.83Å; Y75-M311 HydrophobicContact CE1-CB 4.4Å; Y75-M311 HydrophobicContact CE1-CG 3.75Å; Y75-I314 HydrophobicContact CD1-CB 4.28Å; Y75-I314 HydrophobicContact CD1-CD1 4.19Å; Y75-I314 HydrophobicContact CD1-CG1 4.16Å; Y75-I314 HydrophobicContact CD2-CD1 3.53Å; Y75-I314 HydrophobicContact CD2-CG1 3.65Å; Y75-I314 HydrophobicContact CE1-CD1 4.2Å; Y75-I314 HydrophobicContact CE2-CD1 3.55Å; Y75-I314 HydrophobicContact CE2-CG1 4.21Å; Y75-I314 HydrophobicContact CG-CB 4.15Å; Y75-I314 HydrophobicContact CG-CD1 3.88Å; Y75-I314 HydrophobicContact CG-CG1 3.63Å; Y75-I314 HydrophobicContact CG-CG2 4.38Å
76	N	93.4	Very high	95.4	Very high	22 Å²	22	20.6 Å²	20.6	12%	0.118	12%	0.115	C	C	.	.			trans	-64.2	116.8	-176.7	-177	-4.2	0	0	0	111.6	E72 N73 T74 T78 Q79 G80 M311	E72-N76 PolarHBondContact O-N 3.39Å; N73-N76 PolarHBondContact O-N 3.28Å; T74-N76 VanDerWaalsContact C-N 3.35Å; N76-T78 PolarHBondContact ND2-OG1 3.29Å; N76-T78 PolarHBondContact O-N 2.9Å; N76-T78 PolarHBondContact OD1-N 2.71Å; N76-T78 VanDerWaalsContact OD1-N 3.08Å; N76-T78 PolarHBondContact OD1-OG1 2.96Å; N76-Q79 HydrophobicContact CB-CB 4.27Å; N76-Q79 PolarHBondContact ND2-OE1 3.05Å; N76-Q79 CarbonylContact O-C 3.6Å; N76-Q79 PolarHBondContact O-N 2.96Å; N76-Q79 VanDerWaalsContact O-N 3.08Å; N76-G80 PolarHBondContact O-N 2.85Å; N76-M311 HydrophobicContact CB-SD 4.09Å
77	P	88.6	Confident	95.4	Very high	78 Å²	78	20.8 Å²	20.8	51%	0.506	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-19.6	-176.6	27.5	-35.9	0	0	0	114.2	Y75 Q79	Y75-P77 WeakPolarHBondContact O-CD 3.44Å; P77-Q79 VanDerWaalsContact C-N 3.33Å
78	T	88.8	Confident	95.5	Very high	110 Å²	110	23.6 Å²	23.6	68%	0.675	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-15.8	176.1	67.4	0	0	0	0	112.9	N76	N76-T78 PolarHBondContact ND2-OG1 3.29Å; N76-T78 PolarHBondContact O-N 2.9Å; N76-T78 PolarHBondContact OD1-N 2.71Å; N76-T78 VanDerWaalsContact OD1-N 3.08Å; N76-T78 PolarHBondContact OD1-OG1 2.96Å
79	Q	91.8	Very high	95.5	Very high	54 Å²	54	23.6 Å²	23.6	25%	0.252	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-63.9	-172.7	-73.7	176.9	-40.7	0	0	111.4	N73 N76 P77 W83 G223	N73-Q79 PolarHBondContact OD1-OE1 3.41Å; N76-Q79 HydrophobicContact CB-CB 4.27Å; N76-Q79 PolarHBondContact ND2-OE1 3.05Å; N76-Q79 CarbonylContact O-C 3.6Å; N76-Q79 PolarHBondContact O-N 2.96Å; N76-Q79 VanDerWaalsContact O-N 3.08Å; P77-Q79 VanDerWaalsContact C-N 3.33Å; Q79-W83 HydrophobicContact CB-CB 3.85Å; Q79-W83 HydrophobicContact CB-CG 4.32Å; Q79-W83 HydrophobicContact CG-CB 4.25Å; Q79-W83 HydrophobicContact CG-CG 4.49Å; Q79-G223 WeakPolarHBondContact O-CA 3.46Å
80	G	95.4	Very high	95.5	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	64.8	-165.4	-177.8	0	0	0	0	0	114.3	N73 N76 V82 W83 C84 W221	N73-G80 PolarHBondContact ND2-O 3.4Å; N73-G80 CarbonylContact O-C 3.5Å; N73-G80 WeakPolarHBondContact O-CA 3.35Å; N73-G80 PolarHBondContact O-N 3.48Å; N73-G80 VanDerWaalsContact O-N 3.11Å; N76-G80 PolarHBondContact O-N 2.85Å; G80-V82 VanDerWaalsContact C-N 3.34Å; G80-V82 PolarHBondContact O-N 2.93Å; G80-W83 PolarHBondContact O-N 3.45Å; G80-C84 PolarHBondContact O-N 3.1Å; G80-C84 PolarHBondContact O-SG 3.13Å; G80-W221 CarbonylContact C-O 3.2Å; G80-W221 VanDerWaalsContact CA-O 3.27Å; G80-W221 WeakPolarHBondContact CA-O 3.26Å
81	L	97.3	Very high	95.5	Very high	54 Å²	54	23.9 Å²	23.9	28%	0.283	14%	0.136	S	C	.	.	H	α-helix	trans	-59.1	-41.7	-177	175.1	58.1	0	0	0	112.5	T74 W83 C84 W218 W221 K222 V282	T74-L81 HydrophobicContact CG2-CB 4.44Å; L81-W83 PolarHBondContact O-N 3.32Å; L81-C84 HydrophobicContact CD1-CB 4.5Å; L81-C84 VanDerWaalsContact O-CB 3.26Å; L81-C84 WeakPolarHBondContact O-CB 3.19Å; L81-C84 PolarHBondContact O-N 3.46Å; L81-W218 HydrophobicContact CD2-CH2 4.28Å; L81-W218 HydrophobicContact CD2-CZ3 4.38Å; L81-W221 HydrophobicContact CB-CE3 4.33Å; L81-W221 HydrophobicContact CD2-CZ3 4Å; L81-W221 PolarHBondContact N-O 2.97Å; L81-K222 PolarHBondContact N-O 3.02Å; L81-V282 HydrophobicContact CD1-CB 4.4Å; L81-V282 HydrophobicContact CD1-CG1 3.63Å; L81-V282 HydrophobicContact CD1-CG2 3.81Å; L81-V282 HydrophobicContact CD2-CG1 4.35Å
82	V	97.2	Very high	95.5	Very high	49 Å²	49	27.4 Å²	27.4	30%	0.297	15%	0.154	S	C	.	.	H	α-helix	trans	-60.3	-35.1	-176.1	168.7	0	0	0	0	111.5	G80 K222 V225 Y233	G80-V82 VanDerWaalsContact C-N 3.34Å; G80-V82 PolarHBondContact O-N 2.93Å; V82-K222 WeakPolarHBondContact CB-O 3.38Å; V82-K222 WeakPolarHBondContact CG2-O 3.47Å; V82-K222 PolarHBondContact N-O 3.49Å; V82-V225 HydrophobicContact CG1-CG2 3.42Å; V82-V225 VanDerWaalsContact CG1-CG2 3.42Å; V82-Y233 HydrophobicContact CG1-CE2 3.85Å; V82-Y233 VanDerWaalsContact O-CE2 3.28Å; V82-Y233 WeakPolarHBondContact O-CE2 3.31Å; V82-Y233 PolarHBondContact O-OH 3.49Å
83	W	95.9	Very high	95.5	Very high	33 Å²	33	27 Å²	27	13%	0.125	15%	0.152	C	C	.	.	H	α-helix	trans	-86.6	-4.2	176.8	-70.9	90.5	0	0	0	113.9	N73 Q79 G80 L81 Q85 S224 V225 D229 F232 Y233 Y398	N73-W83 VanDerWaalsContact ND2-C 3.26Å; N73-W83 PolarHBondContact ND2-O 3.07Å; Q79-W83 HydrophobicContact CB-CB 3.85Å; Q79-W83 HydrophobicContact CB-CG 4.32Å; Q79-W83 HydrophobicContact CG-CB 4.25Å; Q79-W83 HydrophobicContact CG-CG 4.49Å; G80-W83 PolarHBondContact O-N 3.45Å; L81-W83 PolarHBondContact O-N 3.32Å; W83-Q85 PolarHBondContact O-N 3.15Å; W83-S224 PolarHBondContact NE1-O 3.14Å; W83-V225 HydrophobicContact CZ2-CG1 4.23Å; W83-V225 HydrophobicContact CZ2-CG2 4.23Å; W83-D229 HydrophobicContact CH2-CB 4.33Å; W83-F232 AromaticContact CH2-CD1 3.74Å; W83-F232 HydrophobicContact CH2-CD1 3.74Å; W83-F232 AromaticContact CH2-CE1 3.99Å; W83-F232 HydrophobicContact CH2-CE1 3.99Å; W83-F232 AromaticContact CZ3-CD1 3.77Å; W83-F232 HydrophobicContact CZ3-CD1 3.77Å; W83-F232 AromaticContact CZ3-CE1 3.7Å; W83-F232 HydrophobicContact CZ3-CE1 3.7Å; W83-Y233 HydrophobicContact CD2-CD2 4.19Å; W83-Y233 HydrophobicContact CD2-CE2 4.46Å; W83-Y233 AromaticContact CE3-CD2 3.95Å; W83-Y233 HydrophobicContact CE3-CD2 3.95Å; W83-Y233 HydrophobicContact CE3-CE2 4.45Å; W83-Y233 HydrophobicContact CH2-CD2 4Å; W83-Y233 HydrophobicContact CZ2-CD2 4.25Å; W83-Y233 AromaticContact CZ3-CD2 3.84Å; W83-Y233 HydrophobicContact CZ3-CD2 3.84Å; W83-Y398 PolarHBondContact O-OH 3.48Å
84	C	95.8	Very high	95.6	Very high	7 Å²	7	26.9 Å²	26.9	5%	0.047	15%	0.152	C	C	.	.			trans	-75.1	56.2	171.5	-65.5	0	0	0	0	111.7	N73 T74 G80 L81 P87 Y398	N73-C84 VanDerWaalsContact C-SG 3.52Å; N73-C84 VanDerWaalsContact CB-SG 3.55Å; N73-C84 PolarHBondContact ND2-N 3.41Å; N73-C84 PolarHBondContact ND2-SG 3.37Å; T74-C84 PolarHBondContact N-SG 2.96Å; T74-C84 PolarHBondContact OG1-SG 2.89Å; G80-C84 PolarHBondContact O-N 3.1Å; G80-C84 PolarHBondContact O-SG 3.13Å; L81-C84 HydrophobicContact CD1-CB 4.5Å; L81-C84 VanDerWaalsContact O-CB 3.26Å; L81-C84 WeakPolarHBondContact O-CB 3.19Å; L81-C84 PolarHBondContact O-N 3.46Å; C84-P87 WeakPolarHBondContact O-CD 3.37Å; C84-Y398 WeakPolarHBondContact CA-OH 3.22Å
85	Q	96.6	Very high	95.7	Very high	10 Å²	10	28.9 Å²	28.9	5%	0.047	16%	0.164	C	C	.	.	H	α-helix	trans	-72.1	-31.1	-177.7	-61.8	-178.8	-1	0	0	113.3	W83 V88 G89 Y233 L237 L240 Y398	W83-Q85 PolarHBondContact O-N 3.15Å; Q85-V88 PolarHBondContact O-N 2.65Å; Q85-V88 VanDerWaalsContact O-N 3.07Å; Q85-G89 PolarHBondContact O-N 2.84Å; Q85-Y233 HydrophobicContact CG-CE2 4.11Å; Q85-Y233 VanDerWaalsContact NE2-CD1 3.35Å; Q85-Y233 VanDerWaalsContact NE2-CE1 3.33Å; Q85-Y233 PolarHBondContact NE2-O 3.31Å; Q85-Y233 PolarHBondContact OE1-O 3.33Å; Q85-L237 HydrophobicContact CB-CD1 4.43Å; Q85-L240 HydrophobicContact CB-CD1 3.61Å; Q85-Y398 PolarHBondContact N-OH 3.42Å
86	A	95.9	Very high	95.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-55.9	-44.6	-169.9	0	0	0	0	0	114.1	V88 G89 Y90 L240 Y398 W401	A86-V88 VanDerWaalsContact C-N 3.32Å; A86-V88 PolarHBondContact O-N 3.18Å; A86-G89 PolarHBondContact O-N 3.49Å; A86-Y90 HydrophobicContact CB-CD2 4.11Å; A86-Y90 HydrophobicContact CB-CE2 3.99Å; A86-Y90 WeakPolarHBondContact O-CB 3.2Å; A86-Y90 WeakPolarHBondContact O-CD2 3.33Å; A86-Y90 PolarHBondContact O-N 2.81Å; A86-L240 HydrophobicContact CB-CD1 4.2Å; A86-L240 HydrophobicContact CB-CD2 3.9Å; A86-Y398 HydrophobicContact CB-CE2 3.78Å; A86-Y398 PolarHBondContact N-OH 3.28Å; A86-Y398 VanDerWaalsContact N-OH 3.11Å; A86-W401 HydrophobicContact CB-CD2 4.27Å; A86-W401 HydrophobicContact CB-CE3 3.75Å; A86-W401 HydrophobicContact CB-CH2 3.62Å; A86-W401 HydrophobicContact CB-CZ2 4.13Å; A86-W401 HydrophobicContact CB-CZ3 3.42Å; A86-W401 VanDerWaalsContact CB-CZ3 3.42Å
87	P	96	Very high	96	Very high	5 Å²	5	29.2 Å²	29.2	3%	0.032	17%	0.167	C	C	.	.	H	α-helix	trans	-54.9	-44.5	174.5	-28.9	36.8	0	0	0	114.1	Y66 T70 C84 A91 A278 W401	Y66-P87 HydrophobicContact CE1-CB 4.18Å; Y66-P87 HydrophobicContact CE2-CB 4.16Å; Y66-P87 WeakPolarHBondContact OH-CB 3.35Å; Y66-P87 PolarHBondContact OH-O 3.48Å; T70-P87 HydrophobicContact CG2-CG 4Å; T70-P87 WeakPolarHBondContact OG1-CG 3.39Å; C84-P87 WeakPolarHBondContact O-CD 3.37Å; P87-A91 VanDerWaalsContact O-CB 3.26Å; P87-A91 WeakPolarHBondContact O-CB 3.41Å; P87-A91 PolarHBondContact O-N 3.38Å; P87-A91 VanDerWaalsContact O-N 3.09Å; P87-A278 HydrophobicContact CB-CB 3.66Å; P87-A278 HydrophobicContact CG-CB 4.37Å; P87-W401 HydrophobicContact CG-CH2 3.93Å; P87-W401 HydrophobicContact CG-CZ3 4.13Å
88	V	96.2	Very high	96.4	Very high	59 Å²	59	25.5 Å²	25.5	36%	0.358	14%	0.143	S	C	.	.	H	α-helix	trans	-74.8	-46.5	-179.1	-178	0	0	0	0	110.8	Q85 A86 Y90 A91 L92 F275	Q85-V88 PolarHBondContact O-N 2.65Å; Q85-V88 VanDerWaalsContact O-N 3.07Å; A86-V88 VanDerWaalsContact C-N 3.32Å; A86-V88 PolarHBondContact O-N 3.18Å; V88-Y90 VanDerWaalsContact C-N 3.35Å; V88-Y90 PolarHBondContact O-N 3.48Å; V88-A91 PolarHBondContact O-N 3.39Å; V88-L92 HydrophobicContact CG1-CD1 4.11Å; V88-L92 HydrophobicContact CG1-CG 4.46Å; V88-L92 WeakPolarHBondContact O-CB 3.2Å; V88-L92 WeakPolarHBondContact O-CG 3.5Å; V88-L92 PolarHBondContact O-N 2.87Å; V88-F275 HydrophobicContact CG2-CD2 4.43Å; V88-F275 HydrophobicContact CG2-CE2 4.01Å
89	G	97.2	Very high	96.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.9	-47.4	179.3	0	0	0	0	0	111.6	Q85 A86 L92 S93 I241	Q85-G89 PolarHBondContact O-N 2.84Å; A86-G89 PolarHBondContact O-N 3.49Å; G89-L92 PolarHBondContact O-N 3.33Å; G89-S93 PolarHBondContact O-N 3.42Å; G89-I241 WeakPolarHBondContact O-CA 3.49Å
90	Y	96.9	Very high	97	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-72.3	-33.9	177.9	-68.7	-46.7	0	0	0	113.5	W61 A86 V88 L92 S93 L94 L240 W247 W401 C404 S405	W61-Y90 HydrophobicContact CE3-CD1 4.38Å; W61-Y90 AromaticContact CE3-CG 3.99Å; W61-Y90 HydrophobicContact CE3-CG 3.99Å; W61-Y90 AromaticContact CH2-CD1 3.94Å; W61-Y90 HydrophobicContact CH2-CD1 3.94Å; W61-Y90 HydrophobicContact CH2-CG 4.34Å; W61-Y90 VanDerWaalsContact CZ3-CB 3.45Å; W61-Y90 AromaticContact CZ3-CD1 3.36Å; W61-Y90 HydrophobicContact CZ3-CD1 3.36Å; W61-Y90 HydrophobicContact CZ3-CD2 4.16Å; W61-Y90 HydrophobicContact CZ3-CE1 4.06Å; W61-Y90 AromaticContact CZ3-CG 3.4Å; W61-Y90 HydrophobicContact CZ3-CG 3.4Å; A86-Y90 HydrophobicContact CB-CD2 4.11Å; A86-Y90 HydrophobicContact CB-CE2 3.99Å; A86-Y90 WeakPolarHBondContact O-CB 3.2Å; A86-Y90 WeakPolarHBondContact O-CD2 3.33Å; A86-Y90 PolarHBondContact O-N 2.81Å; V88-Y90 VanDerWaalsContact C-N 3.35Å; V88-Y90 PolarHBondContact O-N 3.48Å; Y90-L92 VanDerWaalsContact C-N 3.32Å; Y90-L92 PolarHBondContact O-N 3.11Å; Y90-S93 WeakPolarHBondContact O-CB 3.5Å; Y90-S93 PolarHBondContact O-N 3.34Å; Y90-S93 PolarHBondContact O-OG 3.39Å; Y90-L94 PolarHBondContact O-N 2.8Å; Y90-L240 VanDerWaalsContact CD1-O 3.22Å; Y90-L240 WeakPolarHBondContact CD1-O 3.47Å; Y90-L240 HydrophobicContact CE1-CD2 4.16Å; Y90-L240 WeakPolarHBondContact CE1-O 3.5Å; Y90-L240 HydrophobicContact CE2-CD2 3.82Å; Y90-W247 AromaticContact CE1-CZ3 3.76Å; Y90-W247 HydrophobicContact CE1-CZ3 3.76Å; Y90-W247 AromaticContact CZ-CZ3 3.98Å; Y90-W401 AromaticContact CD2-CE2 3.68Å; Y90-W401 HydrophobicContact CD2-CH2 4.14Å; Y90-W401 AromaticContact CD2-CZ2 3.34Å; Y90-W401 HydrophobicContact CD2-CZ2 3.34Å; Y90-W401 AromaticContact CD2-NE1 3.82Å; Y90-W401 HydrophobicContact CE2-CD2 4.2Å; Y90-W401 AromaticContact CE2-CE2 3.45Å; Y90-W401 VanDerWaalsContact CE2-CE2 3.45Å; Y90-W401 AromaticContact CE2-CZ2 3.63Å; Y90-W401 HydrophobicContact CE2-CZ2 3.63Å; Y90-W401 AromaticContact CE2-NE1 3.32Å; Y90-W401 VanDerWaalsContact CE2-NE1 3.32Å; Y90-W401 PolarHBondContact OH-O 2.62Å; Y90-C404 PolarHBondContact OH-SG 3.03Å; Y90-S405 WeakPolarHBondContact OH-CB 3.39Å; Y90-S405 PolarHBondContact OH-OG 3.24Å
91	A	97.2	Very high	97.1	Very high	4 Å²	4	28 Å²	28	3%	0.033	15%	0.147	C	C	.	.	H	α-helix	trans	-60.1	-43.8	170.1	0	0	0	0	0	111.3	P87 V88 S93 L94 V95 S271 F275	P87-A91 VanDerWaalsContact O-CB 3.26Å; P87-A91 WeakPolarHBondContact O-CB 3.41Å; P87-A91 PolarHBondContact O-N 3.38Å; P87-A91 VanDerWaalsContact O-N 3.09Å; V88-A91 PolarHBondContact O-N 3.39Å; A91-S93 VanDerWaalsContact C-N 3.34Å; A91-L94 WeakPolarHBondContact O-CB 3.17Å; A91-L94 PolarHBondContact O-N 3.02Å; A91-V95 PolarHBondContact O-N 3.45Å; A91-S271 VanDerWaalsContact C-OG 3.31Å; A91-S271 WeakPolarHBondContact O-CB 3.29Å; A91-S271 PolarHBondContact O-OG 3.35Å; A91-F275 HydrophobicContact CB-CB 4.46Å
92	L	98.1	Very high	97.1	Very high	74 Å²	74	25.4 Å²	25.4	39%	0.387	13%	0.134	S	C	.	.	H	α-helix	trans	-66.3	-34.1	174.3	-70	175.3	0	0	0	112.5	V88 G89 Y90 L94 V95 V96 I241	V88-L92 HydrophobicContact CG1-CD1 4.11Å; V88-L92 HydrophobicContact CG1-CG 4.46Å; V88-L92 WeakPolarHBondContact O-CB 3.2Å; V88-L92 WeakPolarHBondContact O-CG 3.5Å; V88-L92 PolarHBondContact O-N 2.87Å; G89-L92 PolarHBondContact O-N 3.33Å; Y90-L92 VanDerWaalsContact C-N 3.32Å; Y90-L92 PolarHBondContact O-N 3.11Å; L92-L94 PolarHBondContact O-N 3.49Å; L92-V95 WeakPolarHBondContact O-CB 3.41Å; L92-V95 PolarHBondContact O-N 2.91Å; L92-V96 WeakPolarHBondContact O-CG2 3.48Å; L92-V96 PolarHBondContact O-N 3.2Å; L92-I241 HydrophobicContact CB-CD1 4.41Å; L92-I241 HydrophobicContact CB-CG1 4.03Å; L92-I241 HydrophobicContact CB-CG2 4.38Å; L92-I241 HydrophobicContact CD1-CD1 3.89Å; L92-I241 HydrophobicContact CD1-CG1 4.27Å
93	S	98.1	Very high	96.9	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-56.7	-37.8	173.8	85.1	0	0	0	0	112	G89 Y90 A91 V96 G97 I241	G89-S93 PolarHBondContact O-N 3.42Å; Y90-S93 WeakPolarHBondContact O-CB 3.5Å; Y90-S93 PolarHBondContact O-N 3.34Å; Y90-S93 PolarHBondContact O-OG 3.39Å; A91-S93 VanDerWaalsContact C-N 3.34Å; S93-V96 PolarHBondContact O-N 3.39Å; S93-G97 WeakPolarHBondContact O-CA 3.43Å; S93-G97 PolarHBondContact O-N 2.71Å; S93-I241 WeakPolarHBondContact CA-O 3.48Å; S93-I241 WeakPolarHBondContact CB-O 3.22Å
94	L	98.1	Very high	96.8	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.7	-35.5	175.8	-67.6	177.9	0	0	0	112.3	M57 W61 Y90 A91 L92 G98 Y250 S267 A270	M57-L94 HydrophobicContact CG-CD2 4.49Å; M57-L94 HydrophobicContact SD-CD2 4.2Å; W61-L94 HydrophobicContact CG-CD1 4.48Å; W61-L94 HydrophobicContact CZ2-CD2 3.88Å; W61-L94 HydrophobicContact CZ2-CG 4.44Å; Y90-L94 PolarHBondContact O-N 2.8Å; A91-L94 WeakPolarHBondContact O-CB 3.17Å; A91-L94 PolarHBondContact O-N 3.02Å; L92-L94 PolarHBondContact O-N 3.49Å; L94-G98 PolarHBondContact O-N 3.39Å; L94-Y250 HydrophobicContact CD2-CD2 3.4Å; L94-Y250 HydrophobicContact CD2-CE2 3.57Å; L94-Y250 HydrophobicContact CD2-CG 4.41Å; L94-S267 WeakPolarHBondContact O-CB 3.28Å; L94-A270 HydrophobicContact CD1-CB 4.09Å
95	V	98.3	Very high	96.7	Very high	42 Å²	42	25.7 Å²	25.7	26%	0.255	13%	0.132	S	C	.	.	H	α-helix	trans	-66	-52.1	175.1	-179.7	0	0	0	0	110.2	A91 L92 G98 L99 F268 S271	A91-V95 PolarHBondContact O-N 3.45Å; L92-V95 WeakPolarHBondContact O-CB 3.41Å; L92-V95 PolarHBondContact O-N 2.91Å; V95-G98 PolarHBondContact O-N 3.08Å; V95-L99 HydrophobicContact CG1-CD1 4.05Å; V95-L99 WeakPolarHBondContact O-CG 3.22Å; V95-L99 PolarHBondContact O-N 3.33Å; V95-F268 HydrophobicContact CG1-CD1 4.22Å; V95-F268 HydrophobicContact CG1-CE1 3.99Å; V95-F268 WeakPolarHBondContact O-CE1 3.5Å; V95-S271 VanDerWaalsContact CG2-OG 3.25Å; V95-S271 WeakPolarHBondContact CG2-OG 3.4Å
96	V	98.2	Very high	96.6	Very high	31 Å²	31	27 Å²	27	19%	0.188	14%	0.136	C	C	.	.	H	α-helix	trans	-65.1	-43.6	-179	-179	0	0	0	0	110.6	L92 S93 G98 L99 F100 I241 F242 I245	L92-V96 WeakPolarHBondContact O-CG2 3.48Å; L92-V96 PolarHBondContact O-N 3.2Å; S93-V96 PolarHBondContact O-N 3.39Å; V96-G98 VanDerWaalsContact C-N 3.3Å; V96-G98 PolarHBondContact O-N 3.24Å; V96-L99 PolarHBondContact O-N 3.36Å; V96-F100 HydrophobicContact CG1-CD2 3.87Å; V96-F100 HydrophobicContact CG1-CE2 4.27Å; V96-F100 WeakPolarHBondContact O-CD2 3.43Å; V96-F100 PolarHBondContact O-N 3.18Å; V96-F100 VanDerWaalsContact O-N 3.08Å; V96-I241 HydrophobicContact CG2-CG2 4.28Å; V96-F242 HydrophobicContact CG1-CE1 4.31Å; V96-I245 HydrophobicContact CB-CD1 3.9Å; V96-I245 HydrophobicContact CG1-CD1 3.53Å
97	G	97.9	Very high	96.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.164	C	C	.	.	I	π-helix	trans	-55.5	-44.6	172.3	0	0	0	0	0	112	S93 F101 A102 Y250	S93-G97 WeakPolarHBondContact O-CA 3.43Å; S93-G97 PolarHBondContact O-N 2.71Å; G97-F101 CarbonylContact O-C 3.54Å; G97-F101 WeakPolarHBondContact O-CA 3.38Å; G97-F101 WeakPolarHBondContact O-CB 3.28Å; G97-F101 PolarHBondContact O-N 2.89Å; G97-A102 PolarHBondContact O-N 2.9Å; G97-Y250 WeakPolarHBondContact CA-OH 3.43Å; G97-Y250 PolarHBondContact O-OH 3.07Å; G97-Y250 VanDerWaalsContact O-OH 3.12Å
98	G	97.5	Very high	96.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	I	π-helix	trans	-66.6	-42.5	178.5	0	0	0	0	0	113.3	L94 V95 V96 Y250 R264	L94-G98 PolarHBondContact O-N 3.39Å; V95-G98 PolarHBondContact O-N 3.08Å; V96-G98 VanDerWaalsContact C-N 3.3Å; V96-G98 PolarHBondContact O-N 3.24Å; G98-Y250 PolarHBondContact N-OH 2.81Å; G98-R264 WeakPolarHBondContact O-CG 3.3Å
99	L	97	Very high	95.7	Very high	96 Å²	96	31.7 Å²	31.7	50%	0.503	17%	0.17	S	C	.	.	I	π-helix	trans	-65.1	-53.3	-179.8	-75.2	167.6	0	0	0	112	V95 V96 F268	V95-L99 HydrophobicContact CG1-CD1 4.05Å; V95-L99 WeakPolarHBondContact O-CG 3.22Å; V95-L99 PolarHBondContact O-N 3.33Å; V96-L99 PolarHBondContact O-N 3.36Å; L99-F268 HydrophobicContact CB-CZ 4.45Å; L99-F268 HydrophobicContact CD2-CE1 4.03Å; L99-F268 HydrophobicContact CD2-CZ 3.62Å; L99-F268 HydrophobicContact CG-CE1 3.76Å; L99-F268 HydrophobicContact CG-CZ 3.71Å
100	F	96.7	Very high	95.4	Very high	111 Å²	111	33.1 Å²	33.1	49%	0.487	18%	0.175	S	C	.	.	I	π-helix	trans	-100.3	-41.5	-166.5	-60.4	-71.3	0	0	0	112.5	V96 Y421	V96-F100 HydrophobicContact CG1-CD2 3.87Å; V96-F100 HydrophobicContact CG1-CE2 4.27Å; V96-F100 WeakPolarHBondContact O-CD2 3.43Å; V96-F100 PolarHBondContact O-N 3.18Å; V96-F100 VanDerWaalsContact O-N 3.08Å; F100-Y421 VanDerWaalsContact C-OH 3.27Å; F100-Y421 PolarHBondContact O-OH 3.23Å
101	F	97.3	Very high	94.9	Very high	9 Å²	9	33.6 Å²	33.6	4%	0.039	18%	0.178	C	C	.	.	I	π-helix	trans	-102.7	-38.1	-163	-59.4	-92.1	0	0	0	114.1	G97 N103 R104 M105 I245 F251 F413 L416 I417 L420 Y421	G97-F101 CarbonylContact O-C 3.54Å; G97-F101 WeakPolarHBondContact O-CA 3.38Å; G97-F101 WeakPolarHBondContact O-CB 3.28Å; G97-F101 PolarHBondContact O-N 2.89Å; F101-N103 PolarHBondContact O-N 3.23Å; F101-R104 PolarHBondContact O-N 3.36Å; F101-M105 WeakPolarHBondContact O-CB 3.44Å; F101-M105 VanDerWaalsContact O-CG 3.27Å; F101-M105 WeakPolarHBondContact O-CG 3.42Å; F101-M105 PolarHBondContact O-N 2.93Å; F101-I245 HydrophobicContact CB-CG2 4.5Å; F101-I245 HydrophobicContact CD1-CG2 4.34Å; F101-I245 HydrophobicContact CD2-CG2 3.62Å; F101-I245 HydrophobicContact CE2-CD1 4.16Å; F101-I245 HydrophobicContact CE2-CG2 3.83Å; F101-I245 HydrophobicContact CG-CG2 3.9Å; F101-I245 HydrophobicContact CZ-CG2 4.29Å; F101-F251 HydrophobicContact CB-CE1 4.12Å; F101-F251 HydrophobicContact CB-CZ 3.84Å; F101-F413 HydrophobicContact CZ-CE2 4.2Å; F101-L416 HydrophobicContact CD1-CD2 3.66Å; F101-L416 HydrophobicContact CD1-CG 3.96Å; F101-L416 HydrophobicContact CE1-CD2 3.74Å; F101-L416 HydrophobicContact CE1-CG 3.84Å; F101-L416 HydrophobicContact CG-CD2 4.46Å; F101-I417 HydrophobicContact CZ-CG1 4.29Å; F101-L420 HydrophobicContact CD1-CD1 3.63Å; F101-L420 HydrophobicContact CE1-CD1 4.18Å; F101-Y421 HydrophobicContact CD1-CE2 4.22Å; F101-Y421 AromaticContact CE1-CE2 3.8Å; F101-Y421 HydrophobicContact CE1-CE2 3.8Å; F101-Y421 HydrophobicContact CZ-CE2 4.35Å
102	A	96	Very high	94.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.177	C	C	.	.	I	π-helix	trans	-58.7	-50.5	-171	0	0	0	0	0	112.8	G97 R104 R106 V254 R264	G97-A102 PolarHBondContact O-N 2.9Å; A102-R104 PolarHBondContact O-N 2.88Å; A102-R106 WeakPolarHBondContact O-CB 3.19Å; A102-R106 PolarHBondContact O-N 2.95Å; A102-V254 HydrophobicContact CB-CG1 3.98Å; A102-V254 HydrophobicContact CB-CG2 4.17Å; A102-R264 HydrophobicContact CB-CG 4.27Å
103	N	94.3	Very high	94.5	Very high	44 Å²	44	29.9 Å²	29.9	24%	0.235	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-46.5	179.5	-179.3	40.2	0	0	0	111.5	F101 R106 T107 A260 R264	F101-N103 PolarHBondContact O-N 3.23Å; N103-R106 PolarHBondContact O-N 2.82Å; N103-T107 WeakPolarHBondContact O-CB 3.36Å; N103-T107 PolarHBondContact O-N 3.04Å; N103-T107 PolarHBondContact O-OG1 2.93Å; N103-T107 PolarHBondContact OD1-OG1 3.25Å; N103-A260 WeakPolarHBondContact OD1-CB 3.4Å; N103-R264 HydrophobicContact CB-CG 3.97Å
104	R	93.5	Very high	94.4	Very high	52 Å²	52	29.9 Å²	29.9	20%	0.196	16%	0.158	C	C	.	.	H	α-helix	trans	-64.2	-49.4	-176.7	-164.1	70.6	173.5	-178.8	0.6	110.9	F101 A102 R106 T107 L108 E554	F101-R104 PolarHBondContact O-N 3.36Å; A102-R104 PolarHBondContact O-N 2.88Å; R104-R106 PolarHBondContact O-N 3Å; R104-T107 PolarHBondContact O-N 2.98Å; R104-L108 HydrophobicContact CG-CD1 3.99Å; R104-L108 WeakPolarHBondContact O-CB 3.36Å; R104-L108 WeakPolarHBondContact O-CG 3.31Å; R104-L108 PolarHBondContact O-N 3.35Å; R104-E554 IonicContact NH1-OE1 3.76Å; R104-E554 PolarHBondContact NH1-OE1 3.31Å; R104-E554 IonicContact NH1-OE2 2.77Å; R104-E554 PolarHBondContact NH1-OE2 2.98Å; R104-E554 VanDerWaalsContact NH1-OE2 3.14Å
105	M	94.2	Very high	94.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-42.6	-179	-70.5	-72.6	-72.6	0	0	111.7	F101 Y110 P116 F251 L255 L420	F101-M105 WeakPolarHBondContact O-CB 3.44Å; F101-M105 VanDerWaalsContact O-CG 3.27Å; F101-M105 WeakPolarHBondContact O-CG 3.42Å; F101-M105 PolarHBondContact O-N 2.93Å; M105-Y110 HydrophobicContact CB-CD2 4.5Å; M105-Y110 HydrophobicContact CE-CD2 3.95Å; M105-Y110 HydrophobicContact SD-CD2 3.53Å; M105-Y110 VanDerWaalsContact SD-CD2 3.53Å; M105-Y110 HydrophobicContact SD-CE2 3.75Å; M105-P116 HydrophobicContact CE-CG 3.88Å; M105-P116 HydrophobicContact SD-CG 3.87Å; M105-F251 HydrophobicContact CB-CD1 3.96Å; M105-F251 HydrophobicContact CB-CE1 3.79Å; M105-F251 HydrophobicContact CE-CD1 3.98Å; M105-F251 HydrophobicContact CE-CD2 4.46Å; M105-F251 HydrophobicContact CE-CE1 4.12Å; M105-F251 HydrophobicContact CE-CE2 4.5Å; M105-F251 HydrophobicContact CE-CG 4.18Å; M105-F251 HydrophobicContact CE-CZ 4.35Å; M105-F251 HydrophobicContact CG-CD1 3.97Å; M105-F251 HydrophobicContact CG-CE1 3.42Å; M105-F251 VanDerWaalsContact CG-CE1 3.42Å; M105-F251 HydrophobicContact CG-CZ 3.97Å; M105-L255 HydrophobicContact CB-CD2 4.18Å; M105-L255 WeakPolarHBondContact O-CD2 3.49Å; M105-L420 HydrophobicContact CG-CD1 4.3Å; M105-L420 HydrophobicContact SD-CD1 4.05Å; M105-L420 HydrophobicContact SD-CD2 3.89Å
106	R	93.8	Very high	94	Very high	36 Å²	36	28.4 Å²	28.4	14%	0.136	15%	0.149	C	C	.	.	H	α-helix	trans	-72.4	-38.7	179	-177.6	57.5	-174.2	78.7	-0.2	113.4	A102 N103 R104 L108 G109 V254 L255 S257 K258 A260 A263	A102-R106 WeakPolarHBondContact O-CB 3.19Å; A102-R106 PolarHBondContact O-N 2.95Å; N103-R106 PolarHBondContact O-N 2.82Å; R104-R106 PolarHBondContact O-N 3Å; R106-L108 VanDerWaalsContact C-N 3.34Å; R106-G109 PolarHBondContact O-N 2.67Å; R106-V254 HydrophobicContact CB-CG1 4.33Å; R106-L255 PolarHBondContact NE-O 3.18Å; R106-S257 VanDerWaalsContact CZ-O 3.28Å; R106-S257 PolarHBondContact NE-O 3.41Å; R106-S257 PolarHBondContact NH2-O 2.93Å; R106-K258 PolarHBondContact NH2-O 2.72Å; R106-A260 HydrophobicContact CB-CB 4.11Å; R106-A260 HydrophobicContact CG-CB 4.03Å; R106-A263 HydrophobicContact CB-CB 4.2Å; R106-A263 HydrophobicContact CG-CB 4.27Å
107	T	92.4	Very high	93.8	Very high	93 Å²	93	27 Å²	27	57%	0.571	14%	0.14	S	C	*	.	H	α-helix	trans	-66.8	-37.2	178.9	-63.1	0	0	0	0	111.5	N103 R104 G109 A260	N103-T107 WeakPolarHBondContact O-CB 3.36Å; N103-T107 PolarHBondContact O-N 3.04Å; N103-T107 PolarHBondContact O-OG1 2.93Å; N103-T107 PolarHBondContact OD1-OG1 3.25Å; R104-T107 PolarHBondContact O-N 2.98Å; T107-G109 PolarHBondContact O-N 3.45Å; T107-A260 WeakPolarHBondContact OG1-CB 3.42Å
108	L	89.7	Confident	93.7	Very high	40 Å²	40	28.8 Å²	28.8	21%	0.209	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-4.6	176.6	-67.7	174.1	0	0	0	113.7	R104 R106 Y110 S531	R104-L108 HydrophobicContact CG-CD1 3.99Å; R104-L108 WeakPolarHBondContact O-CB 3.36Å; R104-L108 WeakPolarHBondContact O-CG 3.31Å; R104-L108 PolarHBondContact O-N 3.35Å; R106-L108 VanDerWaalsContact C-N 3.34Å; L108-Y110 VanDerWaalsContact C-N 3.32Å; L108-Y110 HydrophobicContact CB-CD2 4Å; L108-Y110 HydrophobicContact CB-CE1 4.23Å; L108-Y110 HydrophobicContact CB-CE2 3.62Å; L108-Y110 HydrophobicContact CB-CG 4.49Å; L108-Y110 HydrophobicContact CD1-CE2 3.65Å; L108-Y110 HydrophobicContact CG-CE2 4.28Å; L108-Y110 PolarHBondContact O-N 3.12Å; L108-S531 WeakPolarHBondContact CD2-OG 3.16Å
109	G	87.3	Confident	93.4	Very high	30 Å²	30	31.7 Å²	31.7	31%	0.309	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	29.5	171.8	0	0	0	0	0	113.9	R46 R106 T107	R46-G109 PolarHBondContact NH2-O 2.83Å; R106-G109 PolarHBondContact O-N 2.67Å; T107-G109 PolarHBondContact O-N 3.45Å
110	Y	90.3	Very high	93.2	Very high	30 Å²	30	28.1 Å²	28.1	12%	0.118	15%	0.145	C	C	.	.			trans	-66.9	155.7	173.9	-61.6	-44.5	0	0	0	112.5	R46 M105 L108 D115 P116 N119 L255 L420	R46-Y110 PolarHBondContact NH2-O 2.89Å; M105-Y110 HydrophobicContact CB-CD2 4.5Å; M105-Y110 HydrophobicContact CE-CD2 3.95Å; M105-Y110 HydrophobicContact SD-CD2 3.53Å; M105-Y110 VanDerWaalsContact SD-CD2 3.53Å; M105-Y110 HydrophobicContact SD-CE2 3.75Å; L108-Y110 VanDerWaalsContact C-N 3.32Å; L108-Y110 HydrophobicContact CB-CD2 4Å; L108-Y110 HydrophobicContact CB-CE1 4.23Å; L108-Y110 HydrophobicContact CB-CE2 3.62Å; L108-Y110 HydrophobicContact CB-CG 4.49Å; L108-Y110 HydrophobicContact CD1-CE2 3.65Å; L108-Y110 HydrophobicContact CG-CE2 4.28Å; L108-Y110 PolarHBondContact O-N 3.12Å; Y110-D115 HydrophobicContact CD1-CB 3.75Å; Y110-D115 HydrophobicContact CG-CB 4.06Å; Y110-P116 HydrophobicContact CD2-CB 4.41Å; Y110-P116 HydrophobicContact CD2-CG 4.24Å; Y110-P116 HydrophobicContact CE1-CB 4.44Å; Y110-P116 HydrophobicContact CE2-CB 3.73Å; Y110-P116 HydrophobicContact CE2-CG 4.02Å; Y110-N119 WeakPolarHBondContact CE1-ND2 3.22Å; Y110-L255 WeakPolarHBondContact O-CD2 3.28Å; Y110-L420 HydrophobicContact CE2-CD2 4.31Å
111	V	86.4	Confident	93.1	Very high	12 Å²	12	23 Å²	23	7%	0.073	12%	0.122	C	C	.	.	S	Bend	trans	-107.6	-33	178	179.5	0	0	0	0	112	M42 L43 D115 R356	M42-V111 HydrophobicContact CE-CG1 4.04Å; M42-V111 HydrophobicContact SD-CG1 4.29Å; L43-V111 HydrophobicContact CD1-CB 4.22Å; L43-V111 HydrophobicContact CD1-CG1 3.91Å; L43-V111 HydrophobicContact CD1-CG2 4.19Å; L43-V111 HydrophobicContact CD2-CG1 4.5Å; L43-V111 WeakPolarHBondContact CD2-O 3.36Å; L43-V111 HydrophobicContact CG-CG1 3.98Å; V111-D115 WeakPolarHBondContact CA-OD2 3.47Å; V111-D115 WeakPolarHBondContact CB-OD2 3.48Å; V111-D115 PolarHBondContact N-OD2 2.7Å; V111-R356 VanDerWaalsContact CB-NH2 3.32Å; V111-R356 VanDerWaalsContact CG1-NH1 3.34Å
112	T	92.4	Very high	92.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	-122.9	160.3	170.1	68.8	0	0	0	0	110.5	M42 L114 D115 N357	M42-T112 HydrophobicContact CE-CG2 3.57Å; T112-L114 PolarHBondContact O-N 3.39Å; T112-L114 PolarHBondContact OG1-N 2.77Å; T112-D115 PolarHBondContact N-OD2 3.14Å; T112-D115 WeakPolarHBondContact O-CB 3Å; T112-D115 PolarHBondContact O-N 2.72Å; T112-D115 PolarHBondContact OG1-N 3.19Å; T112-D115 PolarHBondContact OG1-OD1 3.35Å; T112-D115 VanDerWaalsContact OG1-OD1 3.08Å; T112-N357 WeakPolarHBondContact CB-OD1 3.08Å; T112-N357 WeakPolarHBondContact CG2-OD1 3.19Å; T112-N357 PolarHBondContact OG1-ND2 3.35Å; T112-N357 PolarHBondContact OG1-OD1 2.72Å
113	M	94.2	Very high	92.7	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.1	168.8	177.6	-90.7	-61	0	0	111.5	P116 F117 A133 P246 Q248 F251 M353	M113-P116 VanDerWaalsContact O-CD 3.22Å; M113-P116 WeakPolarHBondContact O-CD 3.46Å; M113-P116 VanDerWaalsContact O-CG 3.26Å; M113-P116 WeakPolarHBondContact O-CG 3.37Å; M113-F117 WeakPolarHBondContact O-CD2 3.44Å; M113-F117 WeakPolarHBondContact O-CE2 3.3Å; M113-F117 HydrophobicContact SD-CE2 3.83Å; M113-F117 HydrophobicContact SD-CZ 4.34Å; M113-A133 HydrophobicContact CE-CB 4.01Å; M113-P246 VanDerWaalsContact CE-O 3.26Å; M113-P246 WeakPolarHBondContact CE-O 3.32Å; M113-P246 HydrophobicContact SD-CB 4.4Å; M113-Q248 HydrophobicContact CB-CB 4.33Å; M113-Q248 HydrophobicContact CE-CB 4.1Å; M113-F251 HydrophobicContact CB-CB 3.92Å; M113-F251 HydrophobicContact CB-CD2 3.71Å; M113-F251 HydrophobicContact CB-CG 4.12Å; M113-F251 HydrophobicContact CG-CD2 3.35Å; M113-F251 HydrophobicContact CG-CE2 3.86Å; M113-F251 HydrophobicContact CG-CG 4.24Å; M113-M353 HydrophobicContact CE-SD 3.84Å
114	L	95.9	Very high	92.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-16.4	-179.1	-67	-177.1	0	0	0	114.7	T112 F117 Q118 F130 M353 N357	T112-L114 PolarHBondContact O-N 3.39Å; T112-L114 PolarHBondContact OG1-N 2.77Å; L114-F117 HydrophobicContact CD2-CD2 4.1Å; L114-F117 HydrophobicContact CD2-CE2 4.27Å; L114-F117 WeakPolarHBondContact O-CA 3.49Å; L114-F117 WeakPolarHBondContact O-CB 3.35Å; L114-F117 PolarHBondContact O-N 3.22Å; L114-Q118 PolarHBondContact O-N 3.35Å; L114-F130 HydrophobicContact CD1-CB 3.82Å; L114-F130 HydrophobicContact CD1-CD2 4.02Å; L114-F130 HydrophobicContact CD1-CG 4.43Å; L114-M353 HydrophobicContact CD1-CB 4.21Å; L114-M353 HydrophobicContact CD1-CG 4.16Å; L114-M353 HydrophobicContact CD1-SD 3.66Å; L114-M353 HydrophobicContact CG-CG 4.49Å; L114-M353 HydrophobicContact CG-SD 3.85Å; L114-N357 HydrophobicContact CB-CB 4.36Å; L114-N357 HydrophobicContact CD1-CB 4.37Å
115	D	93.6	Very high	92.8	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.053	16%	0.162	C	C	.	.	H	α-helix	trans	-53.5	-44.1	178.7	-78.1	-7.2	0	0	0	114.5	Y110 V111 T112 F117 Q118 N119 R356 N357	Y110-D115 HydrophobicContact CD1-CB 3.75Å; Y110-D115 HydrophobicContact CG-CB 4.06Å; V111-D115 WeakPolarHBondContact CA-OD2 3.47Å; V111-D115 WeakPolarHBondContact CB-OD2 3.48Å; V111-D115 PolarHBondContact N-OD2 2.7Å; T112-D115 PolarHBondContact N-OD2 3.14Å; T112-D115 WeakPolarHBondContact O-CB 3Å; T112-D115 PolarHBondContact O-N 2.72Å; T112-D115 PolarHBondContact OG1-N 3.19Å; T112-D115 PolarHBondContact OG1-OD1 3.35Å; T112-D115 VanDerWaalsContact OG1-OD1 3.08Å; D115-F117 VanDerWaalsContact C-N 3.26Å; D115-F117 PolarHBondContact O-N 3.23Å; D115-Q118 PolarHBondContact O-N 3.36Å; D115-N119 VanDerWaalsContact O-CB 3.25Å; D115-N119 WeakPolarHBondContact O-CB 3.27Å; D115-N119 PolarHBondContact O-N 2.93Å; D115-N119 PolarHBondContact O-ND2 2.96Å; D115-R356 IonicContact OD1-NE 3.48Å; D115-R356 PolarHBondContact OD1-NE 2.82Å; D115-R356 IonicContact OD1-NH2 3.07Å; D115-R356 IonicContact OD2-CZ 2.75Å; D115-R356 IonicContact OD2-NE 3.76Å; D115-R356 IonicContact OD2-NH2 3.83Å; D115-R356 PolarHBondContact OD2-NH2 3.43Å; D115-R356 VanDerWaalsContact OD2-NH2 3.11Å; D115-N357 PolarHBondContact OD1-ND2 2.73Å
116	P	94.3	Very high	92.9	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.013	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-34.2	173.8	21.1	-34.2	0	0	0	113.4	M105 Y110 M113 K120 V419 L420	M105-P116 HydrophobicContact CE-CG 3.88Å; M105-P116 HydrophobicContact SD-CG 3.87Å; Y110-P116 HydrophobicContact CD2-CB 4.41Å; Y110-P116 HydrophobicContact CD2-CG 4.24Å; Y110-P116 HydrophobicContact CE1-CB 4.44Å; Y110-P116 HydrophobicContact CE2-CB 3.73Å; Y110-P116 HydrophobicContact CE2-CG 4.02Å; M113-P116 VanDerWaalsContact O-CD 3.22Å; M113-P116 WeakPolarHBondContact O-CD 3.46Å; M113-P116 VanDerWaalsContact O-CG 3.26Å; M113-P116 WeakPolarHBondContact O-CG 3.37Å; P116-K120 WeakPolarHBondContact O-CB 3.31Å; P116-K120 PolarHBondContact O-N 2.9Å; P116-K120 VanDerWaalsContact O-N 3.08Å; P116-V419 HydrophobicContact CB-CB 4.39Å; P116-V419 HydrophobicContact CB-CG2 3.92Å; P116-V419 HydrophobicContact CG-CG2 4.37Å; P116-L420 HydrophobicContact CB-CD2 4.11Å
117	F	95.6	Very high	93	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.4	-46.8	177.7	-54	-102.4	0	0	0	110.7	M113 L114 D115 N119 K120 Y121 L129 Q415 L416 V419	M113-F117 WeakPolarHBondContact O-CD2 3.44Å; M113-F117 WeakPolarHBondContact O-CE2 3.3Å; M113-F117 HydrophobicContact SD-CE2 3.83Å; M113-F117 HydrophobicContact SD-CZ 4.34Å; L114-F117 HydrophobicContact CD2-CD2 4.1Å; L114-F117 HydrophobicContact CD2-CE2 4.27Å; L114-F117 WeakPolarHBondContact O-CA 3.49Å; L114-F117 WeakPolarHBondContact O-CB 3.35Å; L114-F117 PolarHBondContact O-N 3.22Å; D115-F117 VanDerWaalsContact C-N 3.26Å; D115-F117 PolarHBondContact O-N 3.23Å; F117-N119 VanDerWaalsContact C-N 3.31Å; F117-N119 PolarHBondContact O-N 2.7Å; F117-K120 PolarHBondContact O-N 2.84Å; F117-Y121 HydrophobicContact CB-CD2 4.47Å; F117-Y121 HydrophobicContact CD1-CE2 4.34Å; F117-Y121 WeakPolarHBondContact O-CB 3.41Å; F117-Y121 PolarHBondContact O-N 3.38Å; F117-L129 HydrophobicContact CB-CD1 4.04Å; F117-L129 HydrophobicContact CD1-CD1 3.67Å; F117-L129 HydrophobicContact CE1-CD1 4.5Å; F117-L129 HydrophobicContact CG-CD1 4.22Å; F117-Q415 HydrophobicContact CD1-CB 4.14Å; F117-Q415 HydrophobicContact CE1-CB 3.56Å; F117-L416 HydrophobicContact CE1-CB 4.43Å; F117-L416 HydrophobicContact CE2-CD1 3.87Å; F117-L416 HydrophobicContact CZ-CB 3.83Å; F117-L416 HydrophobicContact CZ-CD1 3.82Å; F117-L416 HydrophobicContact CZ-CG 4.42Å; F117-V419 HydrophobicContact CD1-CG1 3.84Å; F117-V419 HydrophobicContact CD1-CG2 4.19Å; F117-V419 HydrophobicContact CD2-CG2 4.43Å; F117-V419 HydrophobicContact CE1-CG1 4.44Å; F117-V419 HydrophobicContact CE1-CG2 4.19Å; F117-V419 HydrophobicContact CE2-CG2 4.43Å; F117-V419 HydrophobicContact CG-CG1 4.21Å; F117-V419 HydrophobicContact CG-CG2 4.36Å; F117-V419 HydrophobicContact CZ-CG2 4.34Å
118	Q	94.2	Very high	93.3	Very high	38 Å²	38	30.4 Å²	30.4	18%	0.178	15%	0.151	C	C	.	.	H	α-helix	trans	-58.6	-44.7	174.1	-174.9	168.8	-37.8	0	0	111.7	L114 D115 K120 G122 E123 C126 N357	L114-Q118 PolarHBondContact O-N 3.35Å; D115-Q118 PolarHBondContact O-N 3.36Å; Q118-K120 VanDerWaalsContact C-N 3.3Å; Q118-K120 PolarHBondContact O-N 3.01Å; Q118-G122 CarbonylContact O-C 3.38Å; Q118-G122 WeakPolarHBondContact O-CA 3.36Å; Q118-G122 PolarHBondContact O-N 3.27Å; Q118-E123 HydrophobicContact CG-CG 4.08Å; Q118-C126 HydrophobicContact CB-CB 3.84Å; Q118-C126 HydrophobicContact CG-CB 4.34Å; Q118-N357 PolarHBondContact OE1-ND2 2.56Å
119	N	91.6	Very high	93.7	Very high	62 Å²	62	28.5 Å²	28.5	33%	0.332	14%	0.141	S	C	.	.	H	α-helix	trans	-64.6	-34.6	-179.1	-76.7	-27.7	0	0	0	112.3	Y110 D115 F117 F527	Y110-N119 WeakPolarHBondContact CE1-ND2 3.22Å; D115-N119 VanDerWaalsContact O-CB 3.25Å; D115-N119 WeakPolarHBondContact O-CB 3.27Å; D115-N119 PolarHBondContact O-N 2.93Å; D115-N119 PolarHBondContact O-ND2 2.96Å; F117-N119 VanDerWaalsContact C-N 3.31Å; F117-N119 PolarHBondContact O-N 2.7Å; N119-F527 WeakPolarHBondContact O-CB 3.44Å; N119-F527 WeakPolarHBondContact O-CD1 3.32Å; N119-F527 VanDerWaalsContact O-O 3.09Å
120	K	92.6	Very high	94.2	Very high	20 Å²	20	27.5 Å²	27.5	9%	0.087	13%	0.128	C	C	.	.	H	α-helix	trans	-94.7	-42.1	-175.1	-161	174.1	-161.9	169.1	0	114.4	P116 F117 Q118 C418 V419 V422 S425 F527	P116-K120 WeakPolarHBondContact O-CB 3.31Å; P116-K120 PolarHBondContact O-N 2.9Å; P116-K120 VanDerWaalsContact O-N 3.08Å; F117-K120 PolarHBondContact O-N 2.84Å; Q118-K120 VanDerWaalsContact C-N 3.3Å; Q118-K120 PolarHBondContact O-N 3.01Å; K120-C418 PolarHBondContact NZ-O 2.97Å; K120-V419 HydrophobicContact CB-CG1 4.28Å; K120-V419 HydrophobicContact CD-CB 4.02Å; K120-V419 HydrophobicContact CD-CG1 4.07Å; K120-V419 PolarHBondContact NZ-O 2.67Å; K120-V422 PolarHBondContact NZ-O 3.08Å; K120-S425 WeakPolarHBondContact CD-OG 3.39Å; K120-S425 WeakPolarHBondContact CE-O 3.35Å; K120-S425 WeakPolarHBondContact CE-OG 3.36Å; K120-S425 PolarHBondContact NZ-OG 3.49Å; K120-F527 VanDerWaalsContact O-CB 3.28Å; K120-F527 WeakPolarHBondContact O-CB 3.49Å; K120-F527 WeakPolarHBondContact O-CD2 3.22Å
121	Y	94.6	Very high	94.5	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-105.3	-8.2	-173.3	-54.1	-32.3	0	0	0	113.6	F117 M125 L129 Q415 C418 V419 S425 T427 S430	F117-Y121 HydrophobicContact CB-CD2 4.47Å; F117-Y121 HydrophobicContact CD1-CE2 4.34Å; F117-Y121 WeakPolarHBondContact O-CB 3.41Å; F117-Y121 PolarHBondContact O-N 3.38Å; Y121-M125 HydrophobicContact CD2-CG 4.47Å; Y121-L129 HydrophobicContact CD2-CD1 4.1Å; Y121-Q415 VanDerWaalsContact CE2-OE1 3.23Å; Y121-C418 VanDerWaalsContact OH-CB 3.31Å; Y121-C418 WeakPolarHBondContact OH-CB 3.47Å; Y121-V419 HydrophobicContact CD2-CG1 3.86Å; Y121-V419 HydrophobicContact CE1-CG1 4.01Å; Y121-V419 HydrophobicContact CE2-CG1 3.15Å; Y121-V419 WeakPolarHBondContact OH-CG1 3.47Å; Y121-S425 PolarHBondContact OH-OG 2.86Å; Y121-T427 WeakPolarHBondContact CA-OG1 3.32Å; Y121-T427 PolarHBondContact O-OG1 2.82Å; Y121-S430 VanDerWaalsContact CD2-OG 3.22Å; Y121-S430 WeakPolarHBondContact CD2-OG 3.31Å; Y121-S430 WeakPolarHBondContact CE2-OG 3.5Å
122	G	92.3	Very high	95.1	Very high	7 Å²	7	29 Å²	29	7%	0.072	14%	0.137	C	C	.	.			trans	88.6	166.5	-179.1	0	0	0	0	0	113.8	Q118 R124 M125 C126	Q118-G122 CarbonylContact O-C 3.38Å; Q118-G122 WeakPolarHBondContact O-CA 3.36Å; Q118-G122 PolarHBondContact O-N 3.27Å; G122-R124 PolarHBondContact O-N 2.97Å; G122-M125 PolarHBondContact O-N 3.4Å; G122-C126 WeakPolarHBondContact O-CB 3.07Å; G122-C126 PolarHBondContact O-N 2.98Å
123	E	93	Very high	95.3	Very high	87 Å²	87	29.3 Å²	29.3	41%	0.407	14%	0.14	S	C	.	.	H	α-helix	trans	-62.6	-41.9	-170.7	-60.1	154.9	167.1	0	0	112.4	Q118 C126 G127 A361 I362	Q118-E123 HydrophobicContact CG-CG 4.08Å; E123-C126 WeakPolarHBondContact O-CB 3.49Å; E123-C126 PolarHBondContact O-N 2.86Å; E123-G127 PolarHBondContact O-N 2.98Å; E123-A361 HydrophobicContact CB-CB 4.21Å; E123-A361 HydrophobicContact CG-CB 4.11Å; E123-I362 HydrophobicContact CB-CG1 4.12Å; E123-I362 WeakPolarHBondContact O-CD1 3.46Å
124	R	94.6	Very high	95.5	Very high	209 Å²	209	31.2 Å²	31.2	79%	0.789	15%	0.149	S	C	*	.	H	α-helix	trans	-65.8	-45.2	-178.7	-63.7	-178.4	-176.8	176	-1.8	112.6	G122 C126 G127 L128	G122-R124 PolarHBondContact O-N 2.97Å; R124-C126 VanDerWaalsContact C-N 3.32Å; R124-G127 PolarHBondContact O-N 3.27Å; R124-L128 PolarHBondContact O-N 2.99Å
125	M	96	Very high	95.5	Very high	8 Å²	8	33.4 Å²	33.4	4%	0.039	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-38.1	177.7	-170.7	65.3	-140	0	0	110.9	Y121 G122 G127 L128 L129 T427 L431 Y434	Y121-M125 HydrophobicContact CD2-CG 4.47Å; G122-M125 PolarHBondContact O-N 3.4Å; M125-G127 VanDerWaalsContact C-N 3.28Å; M125-G127 PolarHBondContact O-N 2.97Å; M125-L128 HydrophobicContact CE-CB 4.23Å; M125-L128 HydrophobicContact CE-CD1 4.4Å; M125-L128 PolarHBondContact O-N 3.15Å; M125-L128 VanDerWaalsContact O-N 3.15Å; M125-L128 HydrophobicContact SD-CD1 4.17Å; M125-L129 HydrophobicContact CE-CD1 4.29Å; M125-L129 HydrophobicContact CE-CD2 4.19Å; M125-L129 HydrophobicContact CE-CG 3.92Å; M125-L129 HydrophobicContact CG-CD1 4.24Å; M125-L129 WeakPolarHBondContact O-CG 3.31Å; M125-L129 PolarHBondContact O-N 3.39Å; M125-T427 HydrophobicContact CB-CG2 3.92Å; M125-T427 HydrophobicContact CG-CG2 4.14Å; M125-T427 HydrophobicContact SD-CG2 4.46Å; M125-L431 HydrophobicContact CE-CD1 4.49Å; M125-L431 HydrophobicContact SD-CB 3.94Å; M125-L431 HydrophobicContact SD-CD1 4.13Å; M125-Y434 HydrophobicContact CE-CD2 4.3Å; M125-Y434 HydrophobicContact CE-CG 4.22Å
126	C	96.4	Very high	95.7	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.1	-39.3	171.5	-172.3	0	0	0	0	112.3	Q118 G122 E123 R124 L128 L129 F130	Q118-C126 HydrophobicContact CB-CB 3.84Å; Q118-C126 HydrophobicContact CG-CB 4.34Å; G122-C126 WeakPolarHBondContact O-CB 3.07Å; G122-C126 PolarHBondContact O-N 2.98Å; E123-C126 WeakPolarHBondContact O-CB 3.49Å; E123-C126 PolarHBondContact O-N 2.86Å; R124-C126 VanDerWaalsContact C-N 3.32Å; C126-L128 VanDerWaalsContact C-N 3.3Å; C126-L128 PolarHBondContact O-N 3.46Å; C126-L129 CarbonylContact O-C 3.58Å; C126-L129 PolarHBondContact O-N 2.98Å; C126-F130 PolarHBondContact O-N 2.82Å
127	G	96.7	Very high	95.8	Very high	12 Å²	12	33 Å²	33	12%	0.124	16%	0.16	C	C	.	.	H	α-helix	trans	-60.7	-35.7	174	0	0	0	0	0	113.7	E123 R124 M125 F130	E123-G127 PolarHBondContact O-N 2.98Å; R124-G127 PolarHBondContact O-N 3.27Å; M125-G127 VanDerWaalsContact C-N 3.28Å; M125-G127 PolarHBondContact O-N 2.97Å; G127-F130 WeakPolarHBondContact O-CB 3.45Å
128	L	97.3	Very high	95.9	Very high	66 Å²	66	33.1 Å²	33.1	35%	0.346	16%	0.16	S	C	.	.	H	α-helix	trans	-70.9	-41.9	173	-67.4	176.2	0	0	0	112	R124 M125 C126 F130 I131 P132 L431 Y434	R124-L128 PolarHBondContact O-N 2.99Å; M125-L128 HydrophobicContact CE-CB 4.23Å; M125-L128 HydrophobicContact CE-CD1 4.4Å; M125-L128 PolarHBondContact O-N 3.15Å; M125-L128 VanDerWaalsContact O-N 3.15Å; M125-L128 HydrophobicContact SD-CD1 4.17Å; C126-L128 VanDerWaalsContact C-N 3.3Å; C126-L128 PolarHBondContact O-N 3.46Å; L128-F130 PolarHBondContact O-N 3.29Å; L128-I131 HydrophobicContact CD2-CD1 4.45Å; L128-I131 WeakPolarHBondContact O-CB 3.26Å; L128-I131 PolarHBondContact O-N 3.24Å; L128-I131 VanDerWaalsContact O-N 3.12Å; L128-P132 WeakPolarHBondContact O-CD 3.42Å; L128-L431 HydrophobicContact CD1-CD1 3.98Å; L128-Y434 HydrophobicContact CB-CE2 4.42Å; L128-Y434 WeakPolarHBondContact O-CE2 3.26Å
129	L	97.9	Very high	96	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.9	-20.1	176.9	-67.8	166.5	0	0	0	112.7	F117 Y121 M125 C126 I131 P132 I411 L412 Q415 Y434	F117-L129 HydrophobicContact CB-CD1 4.04Å; F117-L129 HydrophobicContact CD1-CD1 3.67Å; F117-L129 HydrophobicContact CE1-CD1 4.5Å; F117-L129 HydrophobicContact CG-CD1 4.22Å; Y121-L129 HydrophobicContact CD2-CD1 4.1Å; M125-L129 HydrophobicContact CE-CD1 4.29Å; M125-L129 HydrophobicContact CE-CD2 4.19Å; M125-L129 HydrophobicContact CE-CG 3.92Å; M125-L129 HydrophobicContact CG-CD1 4.24Å; M125-L129 WeakPolarHBondContact O-CG 3.31Å; M125-L129 PolarHBondContact O-N 3.39Å; C126-L129 CarbonylContact O-C 3.58Å; C126-L129 PolarHBondContact O-N 2.98Å; L129-I131 PolarHBondContact O-N 3.37Å; L129-P132 VanDerWaalsContact O-CD 3.27Å; L129-P132 WeakPolarHBondContact O-CD 3.3Å; L129-P132 VanDerWaalsContact O-CG 3.3Å; L129-P132 WeakPolarHBondContact O-CG 3.26Å; L129-I411 HydrophobicContact CD2-CG2 4.04Å; L129-L412 HydrophobicContact CB-CD2 3.99Å; L129-L412 HydrophobicContact CD2-CD2 3.95Å; L129-L412 WeakPolarHBondContact O-CD2 3.18Å; L129-Q415 HydrophobicContact CD2-CG 4Å; L129-Y434 HydrophobicContact CD2-CD2 3.97Å
130	F	97.8	Very high	96.3	Very high	10 Å²	10	29.4 Å²	29.4	4%	0.044	14%	0.141	C	C	.	.	H	α-helix	trans	-63.7	-29.8	169.9	166.5	-101.5	0	0	0	112.5	L114 C126 G127 L128 A133 L134 M353 F354 V358	L114-F130 HydrophobicContact CD1-CB 3.82Å; L114-F130 HydrophobicContact CD1-CD2 4.02Å; L114-F130 HydrophobicContact CD1-CG 4.43Å; C126-F130 PolarHBondContact O-N 2.82Å; G127-F130 WeakPolarHBondContact O-CB 3.45Å; L128-F130 PolarHBondContact O-N 3.29Å; F130-A133 WeakPolarHBondContact O-CB 3.48Å; F130-A133 PolarHBondContact O-N 3.41Å; F130-L134 HydrophobicContact CD1-CB 4.41Å; F130-L134 HydrophobicContact CE1-CB 3.9Å; F130-L134 HydrophobicContact CE1-CD2 3.7Å; F130-L134 HydrophobicContact CE1-CG 4.26Å; F130-L134 HydrophobicContact CE2-CB 4.03Å; F130-L134 HydrophobicContact CZ-CB 3.69Å; F130-L134 HydrophobicContact CZ-CD1 3.95Å; F130-L134 HydrophobicContact CZ-CD2 3.89Å; F130-L134 HydrophobicContact CZ-CG 4.04Å; F130-L134 WeakPolarHBondContact O-CB 3.45Å; F130-L134 PolarHBondContact O-N 3.24Å; F130-M353 HydrophobicContact CD2-CB 3.74Å; F130-M353 HydrophobicContact CE2-CB 3.7Å; F130-M353 HydrophobicContact CE2-CE 4.39Å; F130-F354 HydrophobicContact CD1-CD2 4.49Å; F130-F354 HydrophobicContact CE1-CB 4.34Å; F130-F354 AromaticContact CE1-CD2 3.61Å; F130-F354 HydrophobicContact CE1-CD2 3.61Å; F130-F354 HydrophobicContact CE1-CE2 4.47Å; F130-F354 HydrophobicContact CE1-CG 4.45Å; F130-F354 HydrophobicContact CE2-CB 4.01Å; F130-F354 HydrophobicContact CZ-CB 3.62Å; F130-F354 AromaticContact CZ-CD2 3.75Å; F130-F354 HydrophobicContact CZ-CD2 3.75Å; F130-F354 HydrophobicContact CZ-CG 4.15Å; F130-V358 HydrophobicContact CB-CG2 3.8Å; F130-V358 HydrophobicContact CD1-CG2 3.5Å; F130-V358 VanDerWaalsContact CD1-CG2 3.5Å; F130-V358 HydrophobicContact CD2-CG2 4.18Å; F130-V358 HydrophobicContact CE1-CG2 4.09Å; F130-V358 HydrophobicContact CG-CG2 3.53Å
131	I	97.5	Very high	96.5	Very high	72 Å²	72	28.5 Å²	28.5	37%	0.369	14%	0.137	S	C	.	.	H	α-helix	trans	-59.5	-54.4	-177.9	-60.7	172.3	0	0	0	112.5	L128 L129 A133 L134 L135	L128-I131 HydrophobicContact CD2-CD1 4.45Å; L128-I131 WeakPolarHBondContact O-CB 3.26Å; L128-I131 PolarHBondContact O-N 3.24Å; L128-I131 VanDerWaalsContact O-N 3.12Å; L129-I131 PolarHBondContact O-N 3.37Å; I131-A133 VanDerWaalsContact C-N 3.26Å; I131-A133 PolarHBondContact O-N 3.25Å; I131-L134 PolarHBondContact O-N 2.63Å; I131-L135 HydrophobicContact CG2-CD1 4.19Å; I131-L135 WeakPolarHBondContact O-CG 3.01Å; I131-L135 PolarHBondContact O-N 2.69Å
132	P	97.6	Very high	96.6	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.013	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-32.3	175.8	23.7	-34.2	0	0	0	112.6	L128 L129 L135 G136 L407 V408 I411 L412 Y434	L128-P132 WeakPolarHBondContact O-CD 3.42Å; L129-P132 VanDerWaalsContact O-CD 3.27Å; L129-P132 WeakPolarHBondContact O-CD 3.3Å; L129-P132 VanDerWaalsContact O-CG 3.3Å; L129-P132 WeakPolarHBondContact O-CG 3.26Å; P132-L135 PolarHBondContact O-N 3.38Å; P132-G136 PolarHBondContact O-N 3.22Å; P132-L407 HydrophobicContact CB-CB 3.85Å; P132-V408 WeakPolarHBondContact O-CG2 3.34Å; P132-I411 HydrophobicContact CB-CB 4.5Å; P132-I411 HydrophobicContact CB-CD1 4.45Å; P132-I411 HydrophobicContact CG-CB 4.37Å; P132-I411 HydrophobicContact CG-CG2 4.15Å; P132-L412 HydrophobicContact CB-CD1 4.28Å; P132-L412 HydrophobicContact CB-CG 4.18Å; P132-L412 HydrophobicContact CG-CD1 4.17Å; P132-L412 HydrophobicContact CG-CD2 3.94Å; P132-L412 HydrophobicContact CG-CG 3.84Å; P132-Y434 HydrophobicContact CG-CE2 4.27Å
133	A	97.9	Very high	96.8	Very high	6 Å²	6	28 Å²	28	5%	0.05	13%	0.133	C	C	.	.	H	α-helix	trans	-65.5	-44.4	175.5	0	0	0	0	0	111.2	M113 F130 I131 G136 E137 M353 L412	M113-A133 HydrophobicContact CE-CB 4.01Å; F130-A133 WeakPolarHBondContact O-CB 3.48Å; F130-A133 PolarHBondContact O-N 3.41Å; I131-A133 VanDerWaalsContact C-N 3.26Å; I131-A133 PolarHBondContact O-N 3.25Å; A133-G136 PolarHBondContact O-N 3.08Å; A133-E137 WeakPolarHBondContact O-CG 3.12Å; A133-E137 PolarHBondContact O-N 3.38Å; A133-E137 VanDerWaalsContact O-N 3.12Å; A133-M353 HydrophobicContact CB-CE 3.92Å; A133-M353 HydrophobicContact CB-SD 4.01Å; A133-L412 HydrophobicContact CB-CD1 3.67Å
134	L	97.8	Very high	97	Very high	40 Å²	40	23.9 Å²	23.9	21%	0.209	11%	0.113	C	C	.	.	H	α-helix	trans	-61.7	-47.4	176.2	174	62.9	0	0	0	111	F130 I131 G136 E137 V138 A350 I383	F130-L134 HydrophobicContact CD1-CB 4.41Å; F130-L134 HydrophobicContact CE1-CB 3.9Å; F130-L134 HydrophobicContact CE1-CD2 3.7Å; F130-L134 HydrophobicContact CE1-CG 4.26Å; F130-L134 HydrophobicContact CE2-CB 4.03Å; F130-L134 HydrophobicContact CZ-CB 3.69Å; F130-L134 HydrophobicContact CZ-CD1 3.95Å; F130-L134 HydrophobicContact CZ-CD2 3.89Å; F130-L134 HydrophobicContact CZ-CG 4.04Å; F130-L134 WeakPolarHBondContact O-CB 3.45Å; F130-L134 PolarHBondContact O-N 3.24Å; I131-L134 PolarHBondContact O-N 2.63Å; L134-G136 VanDerWaalsContact C-N 3.27Å; L134-G136 PolarHBondContact O-N 3.15Å; L134-E137 PolarHBondContact O-N 3.41Å; L134-V138 HydrophobicContact CD1-CG2 3.79Å; L134-V138 HydrophobicContact CG-CG2 4.09Å; L134-V138 VanDerWaalsContact O-CG2 3.22Å; L134-V138 WeakPolarHBondContact O-CG2 3.33Å; L134-V138 PolarHBondContact O-N 2.99Å; L134-A350 HydrophobicContact CD1-CB 4.1Å; L134-I383 HydrophobicContact CD1-CD1 4.05Å; L134-I383 HydrophobicContact CD1-CG1 4.04Å
135	L	96.7	Very high	97.1	Very high	46 Å²	46	14 Å²	14	24%	0.241	8%	0.076	C	C	.	.	H	α-helix	trans	-60.2	-39.9	179.1	-71	174.5	0	0	0	111.5	I131 P132 V138 F139 L407	I131-L135 HydrophobicContact CG2-CD1 4.19Å; I131-L135 WeakPolarHBondContact O-CG 3.01Å; I131-L135 PolarHBondContact O-N 2.69Å; P132-L135 PolarHBondContact O-N 3.38Å; L135-V138 PolarHBondContact O-N 3.21Å; L135-F139 HydrophobicContact CB-CD2 4.44Å; L135-F139 HydrophobicContact CB-CE2 4.24Å; L135-F139 WeakPolarHBondContact O-CB 3.33Å; L135-F139 WeakPolarHBondContact O-CD2 3.26Å; L135-F139 WeakPolarHBondContact O-CG 3.3Å; L135-F139 PolarHBondContact O-N 3.15Å; L135-L407 HydrophobicContact CD1-CD1 3.56Å
136	G	97.1	Very high	97.1	Very high	3 Å²	3	13.7 Å²	13.7	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-56.7	-52.2	172.2	0	0	0	0	0	112.4	P132 A133 L134 V138 F139 W140 C404	P132-G136 PolarHBondContact O-N 3.22Å; A133-G136 PolarHBondContact O-N 3.08Å; L134-G136 VanDerWaalsContact C-N 3.27Å; L134-G136 PolarHBondContact O-N 3.15Å; G136-V138 VanDerWaalsContact C-N 3.34Å; G136-V138 PolarHBondContact O-N 2.98Å; G136-F139 PolarHBondContact O-N 2.97Å; G136-W140 WeakPolarHBondContact O-CB 3.38Å; G136-W140 PolarHBondContact O-N 2.84Å; G136-C404 WeakPolarHBondContact CA-O 3.34Å; G136-C404 WeakPolarHBondContact O-CB 3.41Å
137	E	96.7	Very high	97.1	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.009	8%	0.075	C	C	.	.	H	α-helix	trans	-63.8	-37.3	178.7	-62.2	-68.5	-177.1	0	0	112.9	A133 L134 W140 T141 W247 S346 S349 A350 M353	A133-E137 WeakPolarHBondContact O-CG 3.12Å; A133-E137 PolarHBondContact O-N 3.38Å; A133-E137 VanDerWaalsContact O-N 3.12Å; L134-E137 PolarHBondContact O-N 3.41Å; E137-W140 PolarHBondContact O-N 2.71Å; E137-T141 VanDerWaalsContact O-CB 3.28Å; E137-T141 WeakPolarHBondContact O-CB 3.18Å; E137-T141 PolarHBondContact O-N 3.25Å; E137-T141 PolarHBondContact O-OG1 3.26Å; E137-W247 VanDerWaalsContact CD-NE1 3.28Å; E137-W247 PolarHBondContact OE1-NE1 2.93Å; E137-W247 PolarHBondContact OE2-NE1 2.93Å; E137-S346 PolarHBondContact O-OG 3.49Å; E137-S346 WeakPolarHBondContact OE2-CA 3.25Å; E137-S346 WeakPolarHBondContact OE2-CB 3.41Å; E137-S346 PolarHBondContact OE2-OG 2.75Å; E137-S349 VanDerWaalsContact CD-OG 3.31Å; E137-S349 WeakPolarHBondContact OE1-CB 3.37Å; E137-S349 PolarHBondContact OE1-OG 3.1Å; E137-A350 HydrophobicContact CB-CB 3.7Å; E137-A350 HydrophobicContact CG-CB 3.95Å; E137-M353 HydrophobicContact CG-CE 4.16Å
138	V	97	Very high	97	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.012	7%	0.069	C	C	.	.	H	α-helix	trans	-67.2	-47.5	178.3	174.5	0	0	0	0	110.7	L134 L135 G136 W140 T141 A142 I383 F386 A387 L390	L134-V138 HydrophobicContact CD1-CG2 3.79Å; L134-V138 HydrophobicContact CG-CG2 4.09Å; L134-V138 VanDerWaalsContact O-CG2 3.22Å; L134-V138 WeakPolarHBondContact O-CG2 3.33Å; L134-V138 PolarHBondContact O-N 2.99Å; L135-V138 PolarHBondContact O-N 3.21Å; G136-V138 VanDerWaalsContact C-N 3.34Å; G136-V138 PolarHBondContact O-N 2.98Å; V138-W140 VanDerWaalsContact C-N 3.28Å; V138-W140 PolarHBondContact O-N 2.77Å; V138-T141 PolarHBondContact O-N 3.22Å; V138-A142 VanDerWaalsContact O-CB 3.28Å; V138-A142 WeakPolarHBondContact O-CB 3.35Å; V138-A142 PolarHBondContact O-N 2.95Å; V138-I383 HydrophobicContact CG2-CG2 4.07Å; V138-F386 HydrophobicContact CB-CD1 4.23Å; V138-F386 HydrophobicContact CG1-CD1 3.35Å; V138-F386 HydrophobicContact CG1-CE1 3.72Å; V138-F386 HydrophobicContact CG1-CG 4.2Å; V138-F386 HydrophobicContact CG2-CD1 3.9Å; V138-F386 HydrophobicContact CG2-CE1 4.43Å; V138-A387 HydrophobicContact CG1-CB 4.18Å; V138-L390 HydrophobicContact CG1-CD1 3.6Å
139	F	97.2	Very high	96.9	Very high	21 Å²	21	10.1 Å²	10.1	9%	0.092	5%	0.053	C	C	.	.	H	α-helix	trans	-61.8	-39.8	178.1	-75.4	-51.8	0	0	0	111.3	L135 G136 A142 A143 L390 L400 L403 C404 L449	L135-F139 HydrophobicContact CB-CD2 4.44Å; L135-F139 HydrophobicContact CB-CE2 4.24Å; L135-F139 WeakPolarHBondContact O-CB 3.33Å; L135-F139 WeakPolarHBondContact O-CD2 3.26Å; L135-F139 WeakPolarHBondContact O-CG 3.3Å; L135-F139 PolarHBondContact O-N 3.15Å; G136-F139 PolarHBondContact O-N 2.97Å; F139-A142 WeakPolarHBondContact O-CB 3.38Å; F139-A142 PolarHBondContact O-N 3.4Å; F139-A143 PolarHBondContact O-N 3.35Å; F139-L390 HydrophobicContact CD1-CD1 3.9Å; F139-L390 HydrophobicContact CE1-CD1 3.8Å; F139-L400 HydrophobicContact CD1-CD2 3.97Å; F139-L403 HydrophobicContact CD1-CD2 3.74Å; F139-L403 HydrophobicContact CD1-CG 4.32Å; F139-L403 HydrophobicContact CD2-CD2 4.14Å; F139-L403 HydrophobicContact CD2-CG 3.94Å; F139-L403 HydrophobicContact CE1-CD2 3.45Å; F139-L403 VanDerWaalsContact CE1-CD2 3.45Å; F139-L403 HydrophobicContact CE1-CG 4.3Å; F139-L403 HydrophobicContact CE2-CD2 3.87Å; F139-L403 HydrophobicContact CE2-CG 3.9Å; F139-L403 HydrophobicContact CG-CB 4.47Å; F139-L403 HydrophobicContact CG-CD2 4.1Å; F139-L403 HydrophobicContact CG-CG 4.17Å; F139-L403 HydrophobicContact CZ-CD2 3.52Å; F139-L403 HydrophobicContact CZ-CG 4.1Å; F139-C404 HydrophobicContact CB-CB 3.72Å; F139-L449 HydrophobicContact CE1-CD2 4Å; F139-L449 HydrophobicContact CZ-CD1 4.22Å; F139-L449 HydrophobicContact CZ-CD2 4.26Å
140	W	97.1	Very high	96.7	Very high	1 Å²	1	10.2 Å²	10.2	0%	0.004	5%	0.054	C	C	.	.	H	α-helix	trans	-68	-45.3	177	-172.4	33.7	0	0	0	112.2	T60 G136 E137 V138 A142 A143 I144 W247 V249 S346 W401 C404	T60-W140 HydrophobicContact CG2-CH2 3.92Å; T60-W140 WeakPolarHBondContact O-CH2 3.31Å; T60-W140 WeakPolarHBondContact O-CZ2 3.49Å; G136-W140 WeakPolarHBondContact O-CB 3.38Å; G136-W140 PolarHBondContact O-N 2.84Å; E137-W140 PolarHBondContact O-N 2.71Å; V138-W140 VanDerWaalsContact C-N 3.28Å; V138-W140 PolarHBondContact O-N 2.77Å; W140-A142 VanDerWaalsContact C-N 3.27Å; W140-A142 PolarHBondContact O-N 3.39Å; W140-A143 WeakPolarHBondContact O-CB 3.5Å; W140-A143 PolarHBondContact O-N 3.11Å; W140-A143 VanDerWaalsContact O-N 3.17Å; W140-I144 HydrophobicContact CD2-CD1 3.99Å; W140-I144 HydrophobicContact CG-CD1 4.09Å; W140-I144 HydrophobicContact CZ2-CD1 4.33Å; W140-I144 WeakPolarHBondContact O-CD1 3.49Å; W140-I144 VanDerWaalsContact O-CG1 3.28Å; W140-I144 WeakPolarHBondContact O-CG1 3.09Å; W140-I144 PolarHBondContact O-N 3.21Å; W140-W247 HydrophobicContact CB-CH2 4.44Å; W140-W247 HydrophobicContact CB-CZ2 3.86Å; W140-W247 HydrophobicContact CD2-CH2 4.43Å; W140-W247 AromaticContact CD2-CZ2 3.66Å; W140-W247 HydrophobicContact CD2-CZ2 3.66Å; W140-W247 AromaticContact CE3-CE2 3.94Å; W140-W247 AromaticContact CE3-CZ2 3.55Å; W140-W247 HydrophobicContact CE3-CZ2 3.55Å; W140-W247 AromaticContact CE3-NE1 3.77Å; W140-W247 HydrophobicContact CG-CH2 4.36Å; W140-W247 AromaticContact CG-CZ2 3.83Å; W140-W247 HydrophobicContact CG-CZ2 3.83Å; W140-W247 HydrophobicContact CZ3-CZ2 4.35Å; W140-V249 HydrophobicContact CH2-CB 4.42Å; W140-V249 HydrophobicContact CH2-CG1 3.83Å; W140-V249 HydrophobicContact CH2-CG2 4.21Å; W140-V249 HydrophobicContact CZ3-CB 3.88Å; W140-V249 HydrophobicContact CZ3-CG1 3.57Å; W140-V249 HydrophobicContact CZ3-CG2 3.91Å; W140-S346 VanDerWaalsContact CE3-CB 3.46Å; W140-W401 AromaticContact CD1-CD1 3.44Å; W140-W401 VanDerWaalsContact CD1-CD1 3.44Å; W140-W401 AromaticContact NE1-CD1 3.69Å; W140-W401 AromaticContact NE1-NE1 3.8Å; W140-C404 HydrophobicContact CB-CB 3.89Å
141	T	96.6	Very high	96.5	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-58.2	-41.4	173.3	-60.6	0	0	0	0	110.9	E137 V138 A143 I144 L145 S346 V347 A387	E137-T141 VanDerWaalsContact O-CB 3.28Å; E137-T141 WeakPolarHBondContact O-CB 3.18Å; E137-T141 PolarHBondContact O-N 3.25Å; E137-T141 PolarHBondContact O-OG1 3.26Å; V138-T141 PolarHBondContact O-N 3.22Å; T141-A143 VanDerWaalsContact C-N 3.35Å; T141-A143 PolarHBondContact O-N 3.34Å; T141-I144 PolarHBondContact O-N 3.44Å; T141-L145 HydrophobicContact CG2-CD1 4.01Å; T141-L145 HydrophobicContact CG2-CG 4.16Å; T141-L145 WeakPolarHBondContact O-CG 3.41Å; T141-L145 PolarHBondContact O-N 3.21Å; T141-S346 WeakPolarHBondContact OG1-CB 3.31Å; T141-S346 PolarHBondContact OG1-OG 2.9Å; T141-V347 HydrophobicContact CG2-CG2 3.47Å; T141-V347 VanDerWaalsContact CG2-CG2 3.47Å; T141-A387 HydrophobicContact CG2-CB 3.41Å; T141-A387 VanDerWaalsContact CG2-CB 3.41Å
142	A	97.3	Very high	96.3	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-61.6	-43	177.4	0	0	0	0	0	111.6	V138 F139 W140 I144 L145 S146 A387 L390 L400	V138-A142 VanDerWaalsContact O-CB 3.28Å; V138-A142 WeakPolarHBondContact O-CB 3.35Å; V138-A142 PolarHBondContact O-N 2.95Å; F139-A142 WeakPolarHBondContact O-CB 3.38Å; F139-A142 PolarHBondContact O-N 3.4Å; W140-A142 VanDerWaalsContact C-N 3.27Å; W140-A142 PolarHBondContact O-N 3.39Å; A142-I144 VanDerWaalsContact C-N 3.32Å; A142-I144 PolarHBondContact O-N 3.38Å; A142-L145 PolarHBondContact O-N 3.43Å; A142-S146 VanDerWaalsContact O-CB 3.29Å; A142-S146 WeakPolarHBondContact O-CB 3.4Å; A142-S146 PolarHBondContact O-N 3.46Å; A142-A387 WeakPolarHBondContact CA-O 3.42Å; A142-A387 HydrophobicContact CB-CB 4.33Å; A142-A387 VanDerWaalsContact CB-O 3.22Å; A142-A387 WeakPolarHBondContact CB-O 3.37Å; A142-L390 HydrophobicContact CB-CB 3.78Å; A142-L400 HydrophobicContact CB-CD1 3.99Å; A142-L400 HydrophobicContact CB-CD2 3.98Å
143	A	97.5	Very high	96	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-58.9	-45.2	173.8	0	0	0	0	0	111.2	F139 W140 T141 S146 A147 I397 L400 W401	F139-A143 PolarHBondContact O-N 3.35Å; W140-A143 WeakPolarHBondContact O-CB 3.5Å; W140-A143 PolarHBondContact O-N 3.11Å; W140-A143 VanDerWaalsContact O-N 3.17Å; T141-A143 VanDerWaalsContact C-N 3.35Å; T141-A143 PolarHBondContact O-N 3.34Å; A143-S146 PolarHBondContact O-N 3.09Å; A143-A147 WeakPolarHBondContact O-CB 3.24Å; A143-A147 PolarHBondContact O-N 3.49Å; A143-I397 HydrophobicContact CB-CG2 4.28Å; A143-I397 WeakPolarHBondContact CB-O 3.25Å; A143-L400 HydrophobicContact CB-CB 3.61Å; A143-W401 HydrophobicContact CB-CB 3.92Å
144	I	96.2	Very high	95.6	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-64.6	-45.9	-179.5	-65.6	159	0	0	0	111.4	W140 T141 A142 S146 A147 L148 V339 A343	W140-I144 HydrophobicContact CD2-CD1 3.99Å; W140-I144 HydrophobicContact CG-CD1 4.09Å; W140-I144 HydrophobicContact CZ2-CD1 4.33Å; W140-I144 WeakPolarHBondContact O-CD1 3.49Å; W140-I144 VanDerWaalsContact O-CG1 3.28Å; W140-I144 WeakPolarHBondContact O-CG1 3.09Å; W140-I144 PolarHBondContact O-N 3.21Å; T141-I144 PolarHBondContact O-N 3.44Å; A142-I144 VanDerWaalsContact C-N 3.32Å; A142-I144 PolarHBondContact O-N 3.38Å; I144-S146 VanDerWaalsContact C-N 3.33Å; I144-S146 PolarHBondContact O-N 2.95Å; I144-A147 WeakPolarHBondContact O-CB 3.5Å; I144-A147 PolarHBondContact O-N 3.03Å; I144-L148 HydrophobicContact CG2-CD1 4.4Å; I144-L148 WeakPolarHBondContact O-CG 3.49Å; I144-L148 PolarHBondContact O-N 2.6Å; I144-V339 HydrophobicContact CG2-CG1 3.69Å; I144-V339 WeakPolarHBondContact CG2-O 3.46Å; I144-A343 HydrophobicContact CG2-CB 3.67Å
145	L	96.3	Very high	95.2	Very high	3 Å²	3	5.7 Å²	5.7	2%	0.016	3%	0.033	C	C	.	.	H	α-helix	trans	-66.4	-36.4	178.1	-66.7	-179.4	0	0	0	112	T141 A142 L148 G149 I164 A168 A171 A387 C388	T141-L145 HydrophobicContact CG2-CD1 4.01Å; T141-L145 HydrophobicContact CG2-CG 4.16Å; T141-L145 WeakPolarHBondContact O-CG 3.41Å; T141-L145 PolarHBondContact O-N 3.21Å; A142-L145 PolarHBondContact O-N 3.43Å; L145-L148 HydrophobicContact CD2-CD1 4.27Å; L145-L148 PolarHBondContact O-N 2.92Å; L145-G149 PolarHBondContact O-N 2.91Å; L145-I164 HydrophobicContact CB-CG2 4.33Å; L145-A168 HydrophobicContact CD1-CB 3.88Å; L145-A168 HydrophobicContact CD2-CB 4.15Å; L145-A171 HydrophobicContact CD2-CB 3.99Å; L145-A387 HydrophobicContact CD1-CB 4.21Å; L145-C388 HydrophobicContact CD1-CB 4.12Å
146	S	96.2	Very high	94.8	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-64.2	-40.9	173	-172.4	0	0	0	0	111.5	A142 A143 I144 G149 A150	A142-S146 VanDerWaalsContact O-CB 3.29Å; A142-S146 WeakPolarHBondContact O-CB 3.4Å; A142-S146 PolarHBondContact O-N 3.46Å; A143-S146 PolarHBondContact O-N 3.09Å; I144-S146 VanDerWaalsContact C-N 3.33Å; I144-S146 PolarHBondContact O-N 2.95Å; S146-G149 PolarHBondContact O-N 3.45Å; S146-A150 WeakPolarHBondContact O-CB 3.14Å; S146-A150 PolarHBondContact O-N 3.41Å
147	A	96.8	Very high	94.2	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-63.7	-44.7	173.8	0	0	0	0	0	113.5	G64 N68 A143 I144 G149 A150 T151 V339 I397	G64-A147 VanDerWaalsContact CA-CB 3.48Å; N68-A147 HydrophobicContact CB-CB 3.83Å; N68-A147 PolarHBondContact ND2-O 2.92Å; A143-A147 WeakPolarHBondContact O-CB 3.24Å; A143-A147 PolarHBondContact O-N 3.49Å; I144-A147 WeakPolarHBondContact O-CB 3.5Å; I144-A147 PolarHBondContact O-N 3.03Å; A147-G149 VanDerWaalsContact C-N 3.32Å; A147-A150 WeakPolarHBondContact O-CB 3.4Å; A147-A150 PolarHBondContact O-N 2.73Å; A147-T151 PolarHBondContact O-N 3.29Å; A147-T151 PolarHBondContact O-OG1 3.28Å; A147-V339 HydrophobicContact CB-CG1 4.16Å; A147-I397 HydrophobicContact CB-CD1 3.93Å; A147-I397 HydrophobicContact CB-CG1 4.47Å; A147-I397 HydrophobicContact CB-CG2 4.13Å
148	L	94.5	Very high	93.8	Very high	3 Å²	3	12.4 Å²	12.4	2%	0.016	7%	0.069	C	C	.	.	H	α-helix	trans	-61.5	-43.4	173.5	-70.6	169.9	0	0	0	111.3	I144 L145 A150 T151 L152 S336 V339 M340	I144-L148 HydrophobicContact CG2-CD1 4.4Å; I144-L148 WeakPolarHBondContact O-CG 3.49Å; I144-L148 PolarHBondContact O-N 2.6Å; L145-L148 HydrophobicContact CD2-CD1 4.27Å; L145-L148 PolarHBondContact O-N 2.92Å; L148-A150 VanDerWaalsContact C-N 3.33Å; L148-A150 PolarHBondContact O-N 2.93Å; L148-T151 PolarHBondContact O-N 3.28Å; L148-L152 VanDerWaalsContact O-CB 3.29Å; L148-L152 WeakPolarHBondContact O-CB 3.37Å; L148-L152 PolarHBondContact O-N 3.29Å; L148-S336 WeakPolarHBondContact CD2-O 3.18Å; L148-V339 HydrophobicContact CD1-CG1 4.35Å; L148-V339 HydrophobicContact CD2-CB 3.77Å; L148-V339 HydrophobicContact CD2-CG1 3.58Å; L148-V339 HydrophobicContact CG-CB 4.31Å; L148-V339 HydrophobicContact CG-CG1 3.55Å; L148-M340 HydrophobicContact CD1-CE 3.65Å; L148-M340 HydrophobicContact CD1-SD 3.64Å; L148-M340 HydrophobicContact CD2-CE 4.28Å
149	G	95.1	Very high	93.5	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-61.8	-39.5	176.1	0	0	0	0	0	112.6	L145 S146 A147 L152 G153 S163 S167	L145-G149 PolarHBondContact O-N 2.91Å; S146-G149 PolarHBondContact O-N 3.45Å; A147-G149 VanDerWaalsContact C-N 3.32Å; G149-L152 PolarHBondContact O-N 3.35Å; G149-G153 PolarHBondContact O-N 3.41Å; G149-S163 WeakPolarHBondContact O-CB 2.86Å; G149-S167 PolarHBondContact N-OG 3.17Å
150	A	94.2	Very high	93	Very high	2 Å²	2	17.4 Å²	17.4	2%	0.017	10%	0.096	C	C	.	.	H	α-helix	trans	-60.8	-48.9	173.8	0	0	0	0	0	111.6	S146 A147 L148 G153 V154 K312 L313 I397	S146-A150 WeakPolarHBondContact O-CB 3.14Å; S146-A150 PolarHBondContact O-N 3.41Å; A147-A150 WeakPolarHBondContact O-CB 3.4Å; A147-A150 PolarHBondContact O-N 2.73Å; L148-A150 VanDerWaalsContact C-N 3.33Å; L148-A150 PolarHBondContact O-N 2.93Å; A150-G153 PolarHBondContact O-N 3.46Å; A150-V154 WeakPolarHBondContact O-CG2 3.37Å; A150-V154 PolarHBondContact O-N 3.19Å; A150-V154 VanDerWaalsContact O-N 3.07Å; A150-K312 HydrophobicContact CB-CG 4.48Å; A150-L313 HydrophobicContact CB-CD2 3.56Å; A150-I397 HydrophobicContact CB-CD1 4.27Å
151	T	93.5	Very high	92.9	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-63.9	-43.6	178.1	-60.1	0	0	0	0	111.9	N68 A147 L148 V154 I155 P316 L332 S336	N68-T151 PolarHBondContact ND2-OG1 2.57Å; A147-T151 PolarHBondContact O-N 3.29Å; A147-T151 PolarHBondContact O-OG1 3.28Å; L148-T151 PolarHBondContact O-N 3.28Å; T151-V154 PolarHBondContact O-N 3.22Å; T151-I155 HydrophobicContact CG2-CD1 4.24Å; T151-I155 WeakPolarHBondContact O-CG1 3.06Å; T151-I155 PolarHBondContact O-N 3.24Å; T151-I155 VanDerWaalsContact O-N 3.07Å; T151-P316 HydrophobicContact CG2-CB 4.37Å; T151-L332 HydrophobicContact CG2-CD2 4.03Å; T151-S336 VanDerWaalsContact CG2-OG 3.26Å; T151-S336 WeakPolarHBondContact CG2-OG 3.46Å
152	L	92.2	Very high	92.8	Very high	13 Å²	13	26.3 Å²	26.3	7%	0.068	14%	0.14	C	C	.	.	H	α-helix	trans	-67.8	-40.4	179.2	-172.4	64.1	0	0	0	112.2	I10 L148 G149 V154 I155 V156 L166	I10-L152 HydrophobicContact CD1-CD1 3.92Å; L148-L152 VanDerWaalsContact O-CB 3.29Å; L148-L152 WeakPolarHBondContact O-CB 3.37Å; L148-L152 PolarHBondContact O-N 3.29Å; G149-L152 PolarHBondContact O-N 3.35Å; L152-V154 VanDerWaalsContact C-N 3.33Å; L152-V154 PolarHBondContact O-N 2.96Å; L152-I155 PolarHBondContact O-N 2.89Å; L152-I155 VanDerWaalsContact O-N 3.09Å; L152-V156 HydrophobicContact CD1-CG2 3.62Å; L152-V156 HydrophobicContact CG-CG2 4.24Å; L152-V156 PolarHBondContact O-N 3.4Å; L152-L166 HydrophobicContact CD2-CB 4.03Å; L152-L166 HydrophobicContact CD2-CD2 3.79Å; L152-L166 HydrophobicContact CD2-CG 3.9Å
153	G	91.5	Very high	92.7	Very high	11 Å²	11	26.3 Å²	26.3	11%	0.113	14%	0.14	C	C	.	.	H	α-helix	trans	-60.6	-42.9	175.6	0	0	0	0	0	111.5	G149 A150 I155 D157 L158 S163	G149-G153 PolarHBondContact O-N 3.41Å; A150-G153 PolarHBondContact O-N 3.46Å; G153-I155 VanDerWaalsContact C-N 3.31Å; G153-I155 PolarHBondContact O-N 3.4Å; G153-D157 WeakPolarHBondContact O-CA 3.24Å; G153-D157 PolarHBondContact O-N 3.41Å; G153-L158 PolarHBondContact O-N 3.28Å; G153-S163 VanDerWaalsContact CA-OG 3.32Å; G153-S163 WeakPolarHBondContact CA-OG 3.08Å
154	V	90.6	Very high	92.6	Very high	10 Å²	10	26.3 Å²	26.3	6%	0.061	14%	0.14	C	C	.	.	H	α-helix	trans	-68.5	-26.6	174.2	173	0	0	0	0	112.4	A150 T151 L152 L313 P316 L317 R320	A150-V154 WeakPolarHBondContact O-CG2 3.37Å; A150-V154 PolarHBondContact O-N 3.19Å; A150-V154 VanDerWaalsContact O-N 3.07Å; T151-V154 PolarHBondContact O-N 3.22Å; L152-V154 VanDerWaalsContact C-N 3.33Å; L152-V154 PolarHBondContact O-N 2.96Å; V154-L313 HydrophobicContact CG2-CB 4.08Å; V154-L313 HydrophobicContact CG2-CD1 4.4Å; V154-L313 HydrophobicContact CG2-CD2 4.3Å; V154-L313 HydrophobicContact CG2-CG 4.49Å; V154-P316 HydrophobicContact CB-CB 3.88Å; V154-P316 HydrophobicContact CB-CG 4.29Å; V154-P316 HydrophobicContact CG1-CB 4.03Å; V154-P316 HydrophobicContact CG2-CB 4.03Å; V154-P316 HydrophobicContact CG2-CG 3.92Å; V154-L317 HydrophobicContact CG1-CD2 4.11Å; V154-L317 HydrophobicContact CG2-CD2 3.93Å; V154-L317 HydrophobicContact CG2-CG 4.23Å; V154-R320 HydrophobicContact CG1-CB 3.99Å; V154-R320 HydrophobicContact CG1-CG 4.43Å; V154-R320 WeakPolarHBondContact O-CD 3.47Å; V154-R320 PolarHBondContact O-NH1 3.21Å
155	I	89.2	Confident	92.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-82.3	-52.3	177.2	-74	172	0	0	0	111.7	Y3 L7 I10 T151 L152 G153 L332	Y3-I155 WeakPolarHBondContact CB-O 2.94Å; Y3-I155 PolarHBondContact N-O 3.28Å; L7-I155 HydrophobicContact CB-CG2 4Å; L7-I155 VanDerWaalsContact N-CG2 3.28Å; I10-I155 HydrophobicContact CD1-CD1 3.42Å; I10-I155 VanDerWaalsContact CD1-CD1 3.42Å; I10-I155 HydrophobicContact CG1-CD1 3.86Å; T151-I155 HydrophobicContact CG2-CD1 4.24Å; T151-I155 WeakPolarHBondContact O-CG1 3.06Å; T151-I155 PolarHBondContact O-N 3.24Å; T151-I155 VanDerWaalsContact O-N 3.07Å; L152-I155 PolarHBondContact O-N 2.89Å; L152-I155 VanDerWaalsContact O-N 3.09Å; G153-I155 VanDerWaalsContact C-N 3.31Å; G153-I155 PolarHBondContact O-N 3.4Å; I155-L332 HydrophobicContact CD1-CB 3.76Å; I155-L332 HydrophobicContact CD1-CD1 4Å; I155-L332 HydrophobicContact CD1-CD2 4.5Å; I155-L332 HydrophobicContact CD1-CG 4.31Å; I155-L332 HydrophobicContact CG1-CD1 3.86Å
156	V	87.5	Confident	92.4	Very high	26 Å²	26	33.1 Å²	33.1	16%	0.158	18%	0.175	C	C	.	.	H	α-helix	trans	-91.3	-7.9	-169.6	-168.1	0	0	0	0	111.6	I2 L7 L152 L158	I2-V156 HydrophobicContact CG1-CG1 4.27Å; I2-V156 WeakPolarHBondContact CG1-O 3.2Å; L7-V156 HydrophobicContact CD1-CG2 4.21Å; L152-V156 HydrophobicContact CD1-CG2 3.62Å; L152-V156 HydrophobicContact CG-CG2 4.24Å; L152-V156 PolarHBondContact O-N 3.4Å; V156-L158 VanDerWaalsContact C-N 3.28Å; V156-L158 HydrophobicContact CB-CD1 3.93Å; V156-L158 HydrophobicContact CB-CG 3.86Å; V156-L158 HydrophobicContact CG1-CD1 3.74Å; V156-L158 HydrophobicContact CG1-CD2 4.33Å; V156-L158 HydrophobicContact CG1-CG 3.68Å
157	D	85.7	Confident	92.2	Very high	105 Å²	105	33.2 Å²	33.2	56%	0.561	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	40.5	-176.3	-156.9	38	0	0	0	111.4	M1 G153	M1-D157 PolarHBondContact N-OD2 2.84Å; G153-D157 WeakPolarHBondContact O-CA 3.24Å; G153-D157 PolarHBondContact O-N 3.41Å
158	L	87.4	Confident	92	Very high	60 Å²	60	33.4 Å²	33.4	31%	0.314	18%	0.177	S	C	.	.			trans	-96.8	151.5	177.6	-70.4	175.7	0	0	0	110.3	G153 V156 T162 S163 L166	G153-L158 PolarHBondContact O-N 3.28Å; V156-L158 VanDerWaalsContact C-N 3.28Å; V156-L158 HydrophobicContact CB-CD1 3.93Å; V156-L158 HydrophobicContact CB-CG 3.86Å; V156-L158 HydrophobicContact CG1-CD1 3.74Å; V156-L158 HydrophobicContact CG1-CD2 4.33Å; V156-L158 HydrophobicContact CG1-CG 3.68Å; L158-T162 HydrophobicContact CD1-CG2 4.4Å; L158-S163 VanDerWaalsContact CB-OG 3.24Å; L158-S163 WeakPolarHBondContact CB-OG 3.43Å; L158-S163 PolarHBondContact O-OG 3.49Å; L158-L166 HydrophobicContact CD1-CD2 4.35Å
159	D	90.7	Very high	91.8	Very high	88 Å²	88	36.5 Å²	36.5	47%	0.471	20%	0.199	S	C	.	.			trans	-61.4	155.7	171.1	72.7	-84.1	0	0	0	111.2	K161 T162 S163	D159-K161 VanDerWaalsContact C-N 3.32Å; D159-K161 PolarHBondContact O-N 2.99Å; D159-K161 WeakPolarHBondContact OD2-CB 3.43Å; D159-K161 PolarHBondContact OD2-N 3.49Å; D159-K161 VanDerWaalsContact OD2-N 3.1Å; D159-T162 VanDerWaalsContact CG-OG1 3.28Å; D159-T162 PolarHBondContact O-N 3.35Å; D159-T162 WeakPolarHBondContact OD1-CB 3.04Å; D159-T162 PolarHBondContact OD1-OG1 3.18Å; D159-T162 PolarHBondContact OD2-N 2.84Å; D159-T162 PolarHBondContact OD2-OG1 3.38Å; D159-S163 WeakPolarHBondContact O-CB 3.41Å; D159-S163 PolarHBondContact O-N 3.37Å; D159-S163 PolarHBondContact O-OG 3.12Å
160	Q	87.5	Confident	91.4	Very high	40 Å²	40	39.2 Å²	39.2	19%	0.187	21%	0.212	C	C	.	.	H	α-helix	trans	-57.4	-44.5	-175.7	176.8	-177.4	-6.2	0	0	112.3	S163 I164	Q160-S163 PolarHBondContact O-N 3.07Å; Q160-I164 HydrophobicContact CG-CD1 3.67Å; Q160-I164 HydrophobicContact CG-CG1 4.34Å; Q160-I164 VanDerWaalsContact O-CG1 3.28Å; Q160-I164 WeakPolarHBondContact O-CG1 3Å; Q160-I164 PolarHBondContact O-N 2.77Å
161	K	94.4	Very high	91	Very high	126 Å²	126	39.3 Å²	39.3	55%	0.548	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-49.1	-174.8	-179.7	-178	176.9	-176.7	0	110.1	D159 S163 I164 I165 I392	D159-K161 VanDerWaalsContact C-N 3.32Å; D159-K161 PolarHBondContact O-N 2.99Å; D159-K161 WeakPolarHBondContact OD2-CB 3.43Å; D159-K161 PolarHBondContact OD2-N 3.49Å; D159-K161 VanDerWaalsContact OD2-N 3.1Å; K161-S163 VanDerWaalsContact C-N 3.32Å; K161-S163 PolarHBondContact O-N 3.46Å; K161-I164 PolarHBondContact O-N 2.86Å; K161-I165 HydrophobicContact CG-CD1 4.01Å; K161-I165 VanDerWaalsContact O-CG1 3.29Å; K161-I165 WeakPolarHBondContact O-CG1 3.26Å; K161-I165 PolarHBondContact O-N 3.32Å; K161-I392 HydrophobicContact CG-CD1 4.18Å; K161-I392 HydrophobicContact CG-CG1 4.46Å; K161-I392 HydrophobicContact CG-CG2 4.11Å
162	T	95.4	Very high	90.6	Very high	63 Å²	63	40.1 Å²	40.1	39%	0.387	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-41.7	177.1	-57	0	0	0	0	111.4	L158 D159 I164 I165 L166	L158-T162 HydrophobicContact CD1-CG2 4.4Å; D159-T162 VanDerWaalsContact CG-OG1 3.28Å; D159-T162 PolarHBondContact O-N 3.35Å; D159-T162 WeakPolarHBondContact OD1-CB 3.04Å; D159-T162 PolarHBondContact OD1-OG1 3.18Å; D159-T162 PolarHBondContact OD2-N 2.84Å; D159-T162 PolarHBondContact OD2-OG1 3.38Å; T162-I164 PolarHBondContact O-N 3.39Å; T162-I165 PolarHBondContact O-N 2.92Å; T162-L166 WeakPolarHBondContact O-CB 3.18Å; T162-L166 PolarHBondContact O-N 2.85Å
163	S	94.2	Very high	90.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.5	-40.9	-179.9	-58.1	0	0	0	0	112.9	G149 G153 L158 D159 Q160 K161 S167	G149-S163 WeakPolarHBondContact O-CB 2.86Å; G153-S163 VanDerWaalsContact CA-OG 3.32Å; G153-S163 WeakPolarHBondContact CA-OG 3.08Å; L158-S163 VanDerWaalsContact CB-OG 3.24Å; L158-S163 WeakPolarHBondContact CB-OG 3.43Å; L158-S163 PolarHBondContact O-OG 3.49Å; D159-S163 WeakPolarHBondContact O-CB 3.41Å; D159-S163 PolarHBondContact O-N 3.37Å; D159-S163 PolarHBondContact O-OG 3.12Å; Q160-S163 PolarHBondContact O-N 3.07Å; K161-S163 VanDerWaalsContact C-N 3.32Å; K161-S163 PolarHBondContact O-N 3.46Å; S163-S167 VanDerWaalsContact O-CB 3.3Å; S163-S167 WeakPolarHBondContact O-CB 3.44Å; S163-S167 PolarHBondContact O-N 3.5Å; S163-S167 PolarHBondContact O-OG 3.3Å
164	I	94.7	Very high	89.2	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.6	-42.7	177.5	-66	173.1	0	0	0	110.8	L145 Q160 K161 T162 L166 S167 A168 G391 I392	L145-I164 HydrophobicContact CB-CG2 4.33Å; Q160-I164 HydrophobicContact CG-CD1 3.67Å; Q160-I164 HydrophobicContact CG-CG1 4.34Å; Q160-I164 VanDerWaalsContact O-CG1 3.28Å; Q160-I164 WeakPolarHBondContact O-CG1 3Å; Q160-I164 PolarHBondContact O-N 2.77Å; K161-I164 PolarHBondContact O-N 2.86Å; T162-I164 PolarHBondContact O-N 3.39Å; I164-L166 PolarHBondContact O-N 3.43Å; I164-S167 PolarHBondContact O-N 3.08Å; I164-A168 WeakPolarHBondContact O-CB 3.44Å; I164-A168 PolarHBondContact O-N 3.15Å; I164-G391 VanDerWaalsContact CD1-O 3.29Å; I164-G391 WeakPolarHBondContact CD1-O 3.42Å; I164-I392 HydrophobicContact CB-CG1 4.11Å; I164-I392 HydrophobicContact CD1-CG1 4.27Å; I164-I392 HydrophobicContact CG2-CG1 3.91Å
165	I	96.5	Very high	88.7	Confident	72 Å²	72	44.3 Å²	44.3	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-60.6	-47.6	177.3	-68.6	169.1	0	0	0	110.2	K161 T162 S167 A168 C169 I392	K161-I165 HydrophobicContact CG-CD1 4.01Å; K161-I165 VanDerWaalsContact O-CG1 3.29Å; K161-I165 WeakPolarHBondContact O-CG1 3.26Å; K161-I165 PolarHBondContact O-N 3.32Å; T162-I165 PolarHBondContact O-N 2.92Å; I165-S167 VanDerWaalsContact C-N 3.34Å; I165-S167 PolarHBondContact O-N 3.11Å; I165-A168 WeakPolarHBondContact O-CB 3.3Å; I165-A168 PolarHBondContact O-N 3.01Å; I165-C169 PolarHBondContact O-N 3.44Å; I165-C169 PolarHBondContact O-SG 3.04Å; I165-C169 VanDerWaalsContact O-SG 3.35Å; I165-I392 HydrophobicContact CD1-CD1 4.26Å; I165-I392 HydrophobicContact CG1-CD1 3.85Å
166	L	92.6	Very high	88.2	Confident	74 Å²	74	45.8 Å²	45.8	39%	0.387	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-42.9	178.8	-177	54.8	0	0	0	111.4	L152 L158 T162 I164 A168 C169 I170	L152-L166 HydrophobicContact CD2-CB 4.03Å; L152-L166 HydrophobicContact CD2-CD2 3.79Å; L152-L166 HydrophobicContact CD2-CG 3.9Å; L158-L166 HydrophobicContact CD1-CD2 4.35Å; T162-L166 WeakPolarHBondContact O-CB 3.18Å; T162-L166 PolarHBondContact O-N 2.85Å; I164-L166 PolarHBondContact O-N 3.43Å; L166-A168 VanDerWaalsContact C-N 3.34Å; L166-A168 PolarHBondContact O-N 3.47Å; L166-C169 PolarHBondContact O-N 3.06Å; L166-I170 HydrophobicContact CD1-CD1 4.23Å; L166-I170 HydrophobicContact CD1-CG1 4.47Å; L166-I170 HydrophobicContact CG-CD1 4.11Å; L166-I170 VanDerWaalsContact O-CG1 3.28Å; L166-I170 WeakPolarHBondContact O-CG1 3.26Å; L166-I170 PolarHBondContact O-N 2.73Å
167	S	91.4	Very high	87.4	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.014	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-41.5	175.2	-61.7	0	0	0	0	112.3	G149 S163 I164 I165 I170 A171	G149-S167 PolarHBondContact N-OG 3.17Å; S163-S167 VanDerWaalsContact O-CB 3.3Å; S163-S167 WeakPolarHBondContact O-CB 3.44Å; S163-S167 PolarHBondContact O-N 3.5Å; S163-S167 PolarHBondContact O-OG 3.3Å; I164-S167 PolarHBondContact O-N 3.08Å; I165-S167 VanDerWaalsContact C-N 3.34Å; I165-S167 PolarHBondContact O-N 3.11Å; S167-I170 PolarHBondContact O-N 3.32Å; S167-A171 WeakPolarHBondContact O-CB 3.45Å; S167-A171 PolarHBondContact O-N 3.03Å
168	A	92.9	Very high	86.5	Confident	4 Å²	4	47.5 Å²	47.5	3%	0.033	25%	0.25	C	C	.	.	H	α-helix	trans	-63.8	-44.4	175.8	0	0	0	0	0	111.8	L145 I164 I165 L166 I170 A171 L172 C388	L145-A168 HydrophobicContact CD1-CB 3.88Å; L145-A168 HydrophobicContact CD2-CB 4.15Å; I164-A168 WeakPolarHBondContact O-CB 3.44Å; I164-A168 PolarHBondContact O-N 3.15Å; I165-A168 WeakPolarHBondContact O-CB 3.3Å; I165-A168 PolarHBondContact O-N 3.01Å; L166-A168 VanDerWaalsContact C-N 3.34Å; L166-A168 PolarHBondContact O-N 3.47Å; A168-I170 VanDerWaalsContact C-N 3.34Å; A168-I170 PolarHBondContact O-N 2.95Å; A168-A171 PolarHBondContact O-N 3.46Å; A168-L172 WeakPolarHBondContact O-CB 3.44Å; A168-L172 WeakPolarHBondContact O-CG 3.29Å; A168-L172 PolarHBondContact O-N 3.38Å; A168-C388 HydrophobicContact CB-CB 3.92Å
169	C	91	Very high	86	Confident	69 Å²	69	45.4 Å²	45.4	47%	0.466	24%	0.243	S	C	.	.	H	α-helix	trans	-59.2	-45.4	175.9	-69.8	0	0	0	0	111.7	I165 L166 V173	I165-C169 PolarHBondContact O-N 3.44Å; I165-C169 PolarHBondContact O-SG 3.04Å; I165-C169 VanDerWaalsContact O-SG 3.35Å; L166-C169 PolarHBondContact O-N 3.06Å; C169-V173 VanDerWaalsContact O-CG2 3.24Å; C169-V173 WeakPolarHBondContact O-CG2 3.22Å; C169-V173 PolarHBondContact O-N 3.43Å; C169-V173 VanDerWaalsContact O-N 3.09Å
170	I	85.8	Confident	85.6	Confident	58 Å²	58	41.2 Å²	41.2	30%	0.297	22%	0.221	S	C	.	.	H	α-helix	trans	-63.5	-46.8	178.8	-64	165.1	0	0	0	110.5	Y14 L166 S167 A168 L172 Y174 M340	Y14-I170 HydrophobicContact CD2-CG2 4.08Å; Y14-I170 HydrophobicContact CE2-CD1 4.35Å; Y14-I170 HydrophobicContact CE2-CG2 3.68Å; L166-I170 HydrophobicContact CD1-CD1 4.23Å; L166-I170 HydrophobicContact CD1-CG1 4.47Å; L166-I170 HydrophobicContact CG-CD1 4.11Å; L166-I170 VanDerWaalsContact O-CG1 3.28Å; L166-I170 WeakPolarHBondContact O-CG1 3.26Å; L166-I170 PolarHBondContact O-N 2.73Å; S167-I170 PolarHBondContact O-N 3.32Å; A168-I170 VanDerWaalsContact C-N 3.34Å; A168-I170 PolarHBondContact O-N 2.95Å; I170-L172 PolarHBondContact O-N 2.98Å; I170-Y174 PolarHBondContact O-N 3.46Å; I170-M340 HydrophobicContact CB-CE 4.1Å; I170-M340 HydrophobicContact CG2-CE 3.67Å
171	A	85.1	Confident	85.3	Confident	3 Å²	3	40.6 Å²	40.6	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-56.1	-52.7	177.3	0	0	0	0	0	112	L145 S167 A168 V173 Y174 T175 M340 A343	L145-A171 HydrophobicContact CD2-CB 3.99Å; S167-A171 WeakPolarHBondContact O-CB 3.45Å; S167-A171 PolarHBondContact O-N 3.03Å; A168-A171 PolarHBondContact O-N 3.46Å; A171-V173 PolarHBondContact O-N 3.27Å; A171-Y174 WeakPolarHBondContact O-CB 3.35Å; A171-Y174 PolarHBondContact O-N 3.48Å; A171-Y174 VanDerWaalsContact O-N 3.11Å; A171-T175 PolarHBondContact O-N 2.7Å; A171-T175 PolarHBondContact O-OG1 3.36Å; A171-M340 WeakPolarHBondContact CA-SD 3.18Å; A171-M340 HydrophobicContact CB-CE 4.26Å; A171-M340 HydrophobicContact CB-SD 3.23Å; A171-M340 WeakPolarHBondContact CB-SD 3.27Å; A171-A343 HydrophobicContact CB-CB 4.26Å
172	L	85.6	Confident	84.8	Confident	18 Å²	18	34.9 Å²	34.9	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-39.4	-174.6	-65.7	172.2	0	0	0	112.5	A168 I170 Y174 T175 L176 V347 I380 F381	A168-L172 WeakPolarHBondContact O-CB 3.44Å; A168-L172 WeakPolarHBondContact O-CG 3.29Å; A168-L172 PolarHBondContact O-N 3.38Å; I170-L172 PolarHBondContact O-N 2.98Å; L172-Y174 PolarHBondContact O-N 3.21Å; L172-T175 PolarHBondContact O-N 3.47Å; L172-L176 WeakPolarHBondContact O-CD1 3.41Å; L172-L176 WeakPolarHBondContact O-CG 3.3Å; L172-L176 PolarHBondContact O-N 2.88Å; L172-V347 HydrophobicContact CD2-CG1 4.38Å; L172-I380 HydrophobicContact CD2-CG2 3.71Å; L172-I380 WeakPolarHBondContact CD2-O 3.47Å; L172-F381 HydrophobicContact CD1-CD1 4.47Å
173	V	82.2	Confident	84.2	Confident	82 Å²	82	32.1 Å²	32.1	50%	0.497	18%	0.175	S	C	.	.	H	α-helix	trans	-58.4	-43	174.7	170.3	0	0	0	0	110.2	C169 A171 F177	C169-V173 VanDerWaalsContact O-CG2 3.24Å; C169-V173 WeakPolarHBondContact O-CG2 3.22Å; C169-V173 PolarHBondContact O-N 3.43Å; C169-V173 VanDerWaalsContact O-N 3.09Å; A171-V173 PolarHBondContact O-N 3.27Å; V173-F177 HydrophobicContact CG1-CE2 3.98Å; V173-F177 WeakPolarHBondContact O-CD2 3.43Å; V173-F177 WeakPolarHBondContact O-CE2 3.46Å
174	Y	72.6	Confident	83.9	Confident	35 Å²	35	32.1 Å²	32.1	14%	0.137	18%	0.175	C	C	.	.	H	α-helix	trans	-68.3	-43.9	-179.5	-170.7	-93.5	0	0	0	112.6	I17 L18 I170 A171 L172 L176 F177 T186 D344	I17-Y174 HydrophobicContact CG2-CE1 4.34Å; I17-Y174 HydrophobicContact CG2-CE2 3.92Å; I17-Y174 WeakPolarHBondContact CG2-OH 3.46Å; I17-Y174 PolarHBondContact O-OH 3.48Å; L18-Y174 HydrophobicContact CB-CE2 4.32Å; L18-Y174 HydrophobicContact CD1-CD2 4.23Å; L18-Y174 HydrophobicContact CD1-CE2 4.07Å; I170-Y174 PolarHBondContact O-N 3.46Å; A171-Y174 WeakPolarHBondContact O-CB 3.35Å; A171-Y174 PolarHBondContact O-N 3.48Å; A171-Y174 VanDerWaalsContact O-N 3.11Å; L172-Y174 PolarHBondContact O-N 3.21Å; Y174-L176 PolarHBondContact O-N 3.46Å; Y174-F177 PolarHBondContact O-N 3.19Å; Y174-T186 WeakPolarHBondContact OH-CG2 3.49Å; Y174-D344 WeakPolarHBondContact CD1-OD2 3.22Å; Y174-D344 VanDerWaalsContact CE1-OD2 3.26Å; Y174-D344 WeakPolarHBondContact CE1-OD2 3.07Å
175	T	80.4	Confident	83.6	Confident	6 Å²	6	34.7 Å²	34.7	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-60.5	-31.1	179.1	-39.2	0	0	0	0	112.8	A171 L172 F177 D344 L348 I380	A171-T175 PolarHBondContact O-N 2.7Å; A171-T175 PolarHBondContact O-OG1 3.36Å; L172-T175 PolarHBondContact O-N 3.47Å; T175-F177 PolarHBondContact O-N 2.93Å; T175-D344 WeakPolarHBondContact CA-OD1 3.48Å; T175-D344 WeakPolarHBondContact CB-OD1 3.36Å; T175-D344 HydrophobicContact CG2-CB 4.28Å; T175-D344 PolarHBondContact N-OD1 2.99Å; T175-D344 PolarHBondContact OG1-OD1 3.24Å; T175-L348 HydrophobicContact CG2-CB 4.37Å; T175-I380 HydrophobicContact CG2-CD1 3.96Å; T175-I380 HydrophobicContact CG2-CG1 4.42Å; T175-I380 HydrophobicContact CG2-CG2 4.26Å
176	L	79	Confident	83.2	Confident	30 Å²	30	31.3 Å²	31.3	16%	0.157	17%	0.168	C	C	.	.	H	α-helix	trans	-68.5	-31.5	-176.4	-71	162.7	0	0	0	114.2	L172 Y174 R377 I380 F381	L172-L176 WeakPolarHBondContact O-CD1 3.41Å; L172-L176 WeakPolarHBondContact O-CG 3.3Å; L172-L176 PolarHBondContact O-N 2.88Å; Y174-L176 PolarHBondContact O-N 3.46Å; L176-R377 HydrophobicContact CD2-CB 4.07Å; L176-R377 HydrophobicContact CD2-CG 4.22Å; L176-I380 HydrophobicContact CD2-CB 4.48Å; L176-I380 HydrophobicContact CD2-CD1 4.38Å; L176-I380 HydrophobicContact CD2-CG2 4.3Å; L176-F381 HydrophobicContact CD1-CD2 4.45Å; L176-F381 HydrophobicContact CD1-CE1 4.15Å; L176-F381 HydrophobicContact CD1-CE2 3.42Å; L176-F381 VanDerWaalsContact CD1-CE2 3.42Å; L176-F381 HydrophobicContact CD1-CZ 3.24Å; L176-F381 HydrophobicContact CD2-CD2 4.14Å; L176-F381 HydrophobicContact CD2-CE2 3.64Å; L176-F381 HydrophobicContact CD2-CZ 4.35Å; L176-F381 HydrophobicContact CG-CE2 4.12Å; L176-F381 HydrophobicContact CG-CZ 4.35Å
177	F	70.1	Confident	83.1	Confident	152 Å²	152	27.8 Å²	27.8	67%	0.667	15%	0.15	S	C	*	.	H	α-helix	trans	-89.9	-15.5	-176.9	-63.6	-68.5	0	0	0	112.9	V173 Y174 T175	V173-F177 HydrophobicContact CG1-CE2 3.98Å; V173-F177 WeakPolarHBondContact O-CD2 3.43Å; V173-F177 WeakPolarHBondContact O-CE2 3.46Å; Y174-F177 PolarHBondContact O-N 3.19Å; T175-F177 PolarHBondContact O-N 2.93Å
178	G	66.6	Low	83.2	Confident	15 Å²	15	28.8 Å²	28.8	16%	0.155	16%	0.156	C	C	.	.			trans	-98.2	146.4	-177.7	0	0	0	0	0	114.3
179	G	77.4	Confident	83.2	Confident	17 Å²	17	30.8 Å²	30.8	18%	0.175	17%	0.167	C	C	.	.			trans	-108.2	178.2	159	0	0	0	0	0	110.5	Y181 S182 V183	G179-Y181 PolarHBondContact O-N 3.3Å; G179-S182 WeakPolarHBondContact O-CB 3.3Å; G179-S182 PolarHBondContact O-N 3.39Å; G179-V183 PolarHBondContact O-N 3.41Å; G179-V183 VanDerWaalsContact O-N 3.14Å
180	L	81.4	Confident	83.2	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-52.8	-35.1	-177.3	-177.3	65.7	0	0	0	113.1	V41 M42 A44 I48 V183 A184 Q252	V41-L180 WeakPolarHBondContact O-CB 3.17Å; V41-L180 PolarHBondContact O-N 2.84Å; M42-L180 WeakPolarHBondContact O-CD2 3.13Å; A44-L180 HydrophobicContact CB-CB 4.19Å; A44-L180 HydrophobicContact CB-CD2 4.05Å; A44-L180 HydrophobicContact CB-CG 4.13Å; I48-L180 HydrophobicContact CD1-CD2 4.43Å; L180-V183 PolarHBondContact O-N 3.44Å; L180-A184 VanDerWaalsContact O-CB 3.32Å; L180-A184 WeakPolarHBondContact O-CB 3.47Å; L180-A184 PolarHBondContact O-N 3.3Å; L180-Q252 HydrophobicContact CD1-CG 4.1Å; L180-Q252 HydrophobicContact CD2-CG 3.9Å
181	Y	82.4	Confident	83.6	Confident	27 Å²	27	25.6 Å²	25.6	11%	0.106	14%	0.135	C	C	.	.	H	α-helix	trans	-64.8	-40.1	177.8	-160.1	-83.8	0	0	0	112.5	A24 K27 A44 G179 Y185	A24-Y181 HydrophobicContact CB-CD1 4.2Å; A24-Y181 HydrophobicContact CB-CE1 4.44Å; A24-Y181 VanDerWaalsContact O-CD1 3.23Å; A24-Y181 WeakPolarHBondContact O-CD1 3.47Å; A24-Y181 WeakPolarHBondContact O-CE1 3.49Å; K27-Y181 HydrophobicContact CB-CE1 4.39Å; A44-Y181 HydrophobicContact CB-CD2 3.95Å; A44-Y181 HydrophobicContact CB-CG 4.48Å; G179-Y181 PolarHBondContact O-N 3.3Å; Y181-Y185 AromaticContact CD1-CD2 3.91Å; Y181-Y185 HydrophobicContact CD1-CD2 3.91Å; Y181-Y185 AromaticContact CD1-CE2 3.98Å; Y181-Y185 HydrophobicContact CD1-CE2 3.98Å; Y181-Y185 AromaticContact CE1-CD2 3.65Å; Y181-Y185 HydrophobicContact CE1-CD2 3.65Å; Y181-Y185 AromaticContact CE1-CE2 3.32Å; Y181-Y185 HydrophobicContact CE1-CE2 3.32Å; Y181-Y185 HydrophobicContact CE2-CE2 4.06Å; Y181-Y185 AromaticContact CZ-CE2 3.36Å; Y181-Y185 WeakPolarHBondContact O-CD2 3.39Å; Y181-Y185 PolarHBondContact O-N 2.87Å; Y181-Y185 WeakPolarHBondContact OH-CE2 3.31Å; Y181-Y185 PolarHBondContact OH-OH 3.28Å
182	S	82.7	Confident	84.1	Confident	6 Å²	6	30.3 Å²	30.3	4%	0.042	16%	0.155	C	C	.	.	H	α-helix	trans	-63.4	-49.2	175.2	-178	0	0	0	0	110.4	G21 G179 A184 Y185 T186	G21-S182 WeakPolarHBondContact CA-OG 2.94Å; G21-S182 PolarHBondContact O-OG 2.71Å; G179-S182 WeakPolarHBondContact O-CB 3.3Å; G179-S182 PolarHBondContact O-N 3.39Å; S182-A184 VanDerWaalsContact C-N 3.33Å; S182-A184 PolarHBondContact O-N 3.4Å; S182-Y185 PolarHBondContact O-N 3.09Å; S182-T186 VanDerWaalsContact O-CG2 3.3Å; S182-T186 WeakPolarHBondContact O-CG2 3.47Å; S182-T186 PolarHBondContact O-N 3.43Å; S182-T186 VanDerWaalsContact O-N 3.13Å; S182-T186 PolarHBondContact O-OG1 2.89Å
183	V	84.1	Confident	84.5	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.024	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-44.5	180	180	0	0	0	0	110.9	G179 L180 Y185 T186 D187 D344 S345	G179-V183 PolarHBondContact O-N 3.41Å; G179-V183 VanDerWaalsContact O-N 3.14Å; L180-V183 PolarHBondContact O-N 3.44Å; V183-Y185 VanDerWaalsContact C-N 3.32Å; V183-Y185 PolarHBondContact O-N 3.3Å; V183-T186 WeakPolarHBondContact CA-OG1 3.18Å; V183-T186 PolarHBondContact O-N 2.9Å; V183-T186 PolarHBondContact O-OG1 3.31Å; V183-D187 VanDerWaalsContact O-CB 3.26Å; V183-D187 WeakPolarHBondContact O-CB 3.43Å; V183-D187 PolarHBondContact O-N 2.94Å; V183-D344 HydrophobicContact CG2-CB 4.39Å; V183-S345 WeakPolarHBondContact CG1-OG 3.46Å
184	A	87	Confident	85	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.5	-34.3	-177	0	0	0	0	0	113.9	I48 V52 T56 L180 S182 V188	I48-A184 HydrophobicContact CD1-CB 3.74Å; V52-A184 HydrophobicContact CG1-CB 4.25Å; T56-A184 HydrophobicContact CG2-CB 4.14Å; L180-A184 VanDerWaalsContact O-CB 3.32Å; L180-A184 WeakPolarHBondContact O-CB 3.47Å; L180-A184 PolarHBondContact O-N 3.3Å; S182-A184 VanDerWaalsContact C-N 3.33Å; S182-A184 PolarHBondContact O-N 3.4Å; A184-V188 VanDerWaalsContact O-CG2 3.26Å; A184-V188 WeakPolarHBondContact O-CG2 3.32Å
185	Y	87.9	Confident	86.1	Confident	55 Å²	55	29.4 Å²	29.4	22%	0.216	15%	0.148	C	C	.	.	H	α-helix	trans	-82.1	-34.4	178.2	-85.8	-88.3	0	0	0	112.7	W23 A24 V52 Y181 S182 V183 D187 V188 V189	W23-Y185 HydrophobicContact CZ3-CD1 4.04Å; W23-Y185 HydrophobicContact CZ3-CE1 4.4Å; A24-Y185 HydrophobicContact CB-CD2 4.12Å; A24-Y185 HydrophobicContact CB-CG 4.05Å; V52-Y185 HydrophobicContact CG1-CE2 4.48Å; V52-Y185 HydrophobicContact CG2-CE1 4.26Å; Y181-Y185 AromaticContact CD1-CD2 3.91Å; Y181-Y185 HydrophobicContact CD1-CD2 3.91Å; Y181-Y185 AromaticContact CD1-CE2 3.98Å; Y181-Y185 HydrophobicContact CD1-CE2 3.98Å; Y181-Y185 AromaticContact CE1-CD2 3.65Å; Y181-Y185 HydrophobicContact CE1-CD2 3.65Å; Y181-Y185 AromaticContact CE1-CE2 3.32Å; Y181-Y185 HydrophobicContact CE1-CE2 3.32Å; Y181-Y185 HydrophobicContact CE2-CE2 4.06Å; Y181-Y185 AromaticContact CZ-CE2 3.36Å; Y181-Y185 WeakPolarHBondContact O-CD2 3.39Å; Y181-Y185 PolarHBondContact O-N 2.87Å; Y181-Y185 WeakPolarHBondContact OH-CE2 3.31Å; Y181-Y185 PolarHBondContact OH-OH 3.28Å; S182-Y185 PolarHBondContact O-N 3.09Å; V183-Y185 VanDerWaalsContact C-N 3.32Å; V183-Y185 PolarHBondContact O-N 3.3Å; Y185-D187 VanDerWaalsContact C-N 3.32Å; Y185-V188 PolarHBondContact O-N 3.03Å; Y185-V189 PolarHBondContact O-N 2.76Å
186	T	89.6	Confident	86.7	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-65.5	-42.6	174.3	57.1	0	0	0	0	110	I17 V20 Y174 S182 V183 V188 V189 Q190	I17-T186 HydrophobicContact CG2-CG2 4.06Å; V20-T186 HydrophobicContact CB-CG2 4.26Å; V20-T186 HydrophobicContact CG1-CG2 4.06Å; Y174-T186 WeakPolarHBondContact OH-CG2 3.49Å; S182-T186 VanDerWaalsContact O-CG2 3.3Å; S182-T186 WeakPolarHBondContact O-CG2 3.47Å; S182-T186 PolarHBondContact O-N 3.43Å; S182-T186 VanDerWaalsContact O-N 3.13Å; S182-T186 PolarHBondContact O-OG1 2.89Å; V183-T186 WeakPolarHBondContact CA-OG1 3.18Å; V183-T186 PolarHBondContact O-N 2.9Å; V183-T186 PolarHBondContact O-OG1 3.31Å; T186-V188 VanDerWaalsContact C-N 3.25Å; T186-V188 PolarHBondContact O-N 3.46Å; T186-V189 PolarHBondContact O-N 2.87Å; T186-V189 VanDerWaalsContact O-N 3.09Å; T186-Q190 WeakPolarHBondContact O-CB 3.35Å; T186-Q190 WeakPolarHBondContact O-CG 3Å; T186-Q190 PolarHBondContact O-N 2.84Å; T186-Q190 PolarHBondContact O-OE1 3.21Å
187	D	90.8	Very high	87.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-50.2	-45.4	175	-83.3	-18.9	0	0	0	112	T56 A59 V183 Y185 Q190 L191 R253 S341	T56-D187 PolarHBondContact OG1-OD2 3.06Å; A59-D187 HydrophobicContact CB-CB 3.65Å; A59-D187 WeakPolarHBondContact CB-O 3.39Å; V183-D187 VanDerWaalsContact O-CB 3.26Å; V183-D187 WeakPolarHBondContact O-CB 3.43Å; V183-D187 PolarHBondContact O-N 2.94Å; Y185-D187 VanDerWaalsContact C-N 3.32Å; D187-Q190 VanDerWaalsContact N-OE1 3.12Å; D187-Q190 PolarHBondContact O-N 3.46Å; D187-L191 VanDerWaalsContact O-CB 3.3Å; D187-L191 WeakPolarHBondContact O-CB 3.35Å; D187-L191 PolarHBondContact O-N 2.92Å; D187-R253 IonicContact OD2-CZ 3.11Å; D187-R253 IonicContact OD2-NH2 3.84Å; D187-R253 PolarHBondContact OD2-NH2 2.84Å; D187-S341 WeakPolarHBondContact OD1-CB 3.46Å; D187-S341 PolarHBondContact OD1-OG 2.96Å
188	V	91.9	Very high	88.7	Confident	23 Å²	23	24.9 Å²	24.9	14%	0.139	13%	0.131	C	C	.	.	H	α-helix	trans	-60.9	-50.3	-179.6	179	0	0	0	0	110.6	V52 F55 A184 Y185 T186 L191 F192	V52-V188 HydrophobicContact CG1-CG2 4.1Å; F55-V188 HydrophobicContact CB-CB 4.21Å; F55-V188 HydrophobicContact CB-CG1 4.12Å; F55-V188 HydrophobicContact CB-CG2 3.68Å; F55-V188 HydrophobicContact CD2-CG1 3.92Å; F55-V188 HydrophobicContact CG-CG1 4.24Å; A184-V188 VanDerWaalsContact O-CG2 3.26Å; A184-V188 WeakPolarHBondContact O-CG2 3.32Å; Y185-V188 PolarHBondContact O-N 3.03Å; T186-V188 VanDerWaalsContact C-N 3.25Å; T186-V188 PolarHBondContact O-N 3.46Å; V188-L191 PolarHBondContact O-N 3.18Å; V188-F192 HydrophobicContact CG1-CD2 4.02Å; V188-F192 HydrophobicContact CG1-CE2 3.64Å; V188-F192 WeakPolarHBondContact O-CD2 3.47Å; V188-F192 PolarHBondContact O-N 3.32Å
189	V	92.4	Very high	90.1	Very high	45 Å²	45	28.3 Å²	28.3	27%	0.273	14%	0.139	S	C	.	.	H	α-helix	trans	-64.1	-45.7	-179.6	178.5	0	0	0	0	110.4	L16 V20 Y185 T186 L191 F192 C193	L16-V189 HydrophobicContact CD2-CG1 4.38Å; V20-V189 HydrophobicContact CG1-CG2 4.16Å; V20-V189 HydrophobicContact CG2-CG2 4.28Å; Y185-V189 PolarHBondContact O-N 2.76Å; T186-V189 PolarHBondContact O-N 2.87Å; T186-V189 VanDerWaalsContact O-N 3.09Å; V189-L191 VanDerWaalsContact C-N 3.34Å; V189-L191 PolarHBondContact O-N 2.86Å; V189-F192 PolarHBondContact O-N 2.94Å; V189-C193 PolarHBondContact O-N 3.39Å; V189-C193 PolarHBondContact O-SG 3.43Å
190	Q	92.5	Very high	90.9	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.019	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-42.5	178.4	-79	157.1	-40.5	0	0	112.3	I17 T186 D187 F192 C193 I194 A337 A338 S341	I17-Q190 HydrophobicContact CD1-CG 3.77Å; I17-Q190 HydrophobicContact CG1-CG 3.86Å; T186-Q190 WeakPolarHBondContact O-CB 3.35Å; T186-Q190 WeakPolarHBondContact O-CG 3Å; T186-Q190 PolarHBondContact O-N 2.84Å; T186-Q190 PolarHBondContact O-OE1 3.21Å; D187-Q190 VanDerWaalsContact N-OE1 3.12Å; D187-Q190 PolarHBondContact O-N 3.46Å; Q190-F192 PolarHBondContact O-N 2.83Å; Q190-C193 PolarHBondContact O-N 2.84Å; Q190-I194 WeakPolarHBondContact O-CG2 3.28Å; Q190-I194 PolarHBondContact O-N 3.35Å; Q190-A337 HydrophobicContact CG-CB 4.29Å; Q190-A337 PolarHBondContact NE2-O 3.48Å; Q190-A338 HydrophobicContact CB-CB 4.05Å; Q190-S341 PolarHBondContact OE1-OG 3.33Å
191	L	94.7	Very high	91.7	Very high	14 Å²	14	30.9 Å²	30.9	7%	0.073	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-43.1	178.1	-177.4	62.8	0	0	0	112.2	F55 T58 A59 D187 V188 V189 I194 F195 M277	F55-L191 HydrophobicContact CB-CD2 4.15Å; F55-L191 HydrophobicContact CD1-CD2 3.74Å; F55-L191 HydrophobicContact CG-CD2 4.4Å; T58-L191 HydrophobicContact CG2-CD1 3.97Å; T58-L191 HydrophobicContact CG2-CD2 3.9Å; A59-L191 HydrophobicContact CB-CB 4.02Å; D187-L191 VanDerWaalsContact O-CB 3.3Å; D187-L191 WeakPolarHBondContact O-CB 3.35Å; D187-L191 PolarHBondContact O-N 2.92Å; V188-L191 PolarHBondContact O-N 3.18Å; V189-L191 VanDerWaalsContact C-N 3.34Å; V189-L191 PolarHBondContact O-N 2.86Å; L191-I194 HydrophobicContact CD1-CG2 4.39Å; L191-I194 WeakPolarHBondContact O-CG2 3.33Å; L191-F195 VanDerWaalsContact O-CB 3.23Å; L191-F195 WeakPolarHBondContact O-CB 3.27Å; L191-F195 PolarHBondContact O-N 3.42Å; L191-M277 HydrophobicContact CD1-CG 4.19Å; L191-M277 HydrophobicContact CD1-SD 4.38Å
192	F	93.8	Very high	92.4	Very high	102 Å²	102	30 Å²	30	45%	0.447	15%	0.146	S	C	.	.	H	α-helix	trans	-64.2	-44.2	174.8	-75.8	-66.6	0	0	0	111.6	F55 V188 V189 Q190 I194 F195 L196	F55-F192 HydrophobicContact CD2-CE2 4.4Å; F55-F192 HydrophobicContact CD2-CZ 4.47Å; F55-F192 HydrophobicContact CE1-CE1 4.45Å; F55-F192 AromaticContact CE1-CZ 3.92Å; F55-F192 HydrophobicContact CE1-CZ 3.92Å; F55-F192 HydrophobicContact CE2-CE2 4.16Å; F55-F192 AromaticContact CE2-CZ 3.84Å; F55-F192 HydrophobicContact CE2-CZ 3.84Å; F55-F192 HydrophobicContact CZ-CE1 4.34Å; F55-F192 HydrophobicContact CZ-CE2 4.25Å; F55-F192 AromaticContact CZ-CZ 3.55Å; F55-F192 HydrophobicContact CZ-CZ 3.55Å; V188-F192 HydrophobicContact CG1-CD2 4.02Å; V188-F192 HydrophobicContact CG1-CE2 3.64Å; V188-F192 WeakPolarHBondContact O-CD2 3.47Å; V188-F192 PolarHBondContact O-N 3.32Å; V189-F192 PolarHBondContact O-N 2.94Å; Q190-F192 PolarHBondContact O-N 2.83Å; F192-I194 PolarHBondContact O-N 3.33Å; F192-F195 PolarHBondContact O-N 3.01Å; F192-L196 WeakPolarHBondContact O-CG 3.42Å; F192-L196 PolarHBondContact O-N 3.28Å
193	C	93.9	Very high	93.1	Very high	27 Å²	27	33.2 Å²	33.2	18%	0.182	17%	0.166	C	C	.	.	H	α-helix	trans	-60.4	-45.8	178.3	-69	0	0	0	0	111.9	F13 V189 Q190 G197 A334	F13-C193 HydrophobicContact CD1-CB 4.47Å; F13-C193 HydrophobicContact CE1-CB 3.79Å; V189-C193 PolarHBondContact O-N 3.39Å; V189-C193 PolarHBondContact O-SG 3.43Å; Q190-C193 PolarHBondContact O-N 2.84Å; C193-G197 WeakPolarHBondContact O-CA 3.31Å; C193-G197 PolarHBondContact O-N 3.15Å; C193-A334 HydrophobicContact CB-CB 3.95Å; C193-A334 WeakPolarHBondContact O-CB 3.29Å
194	I	94.2	Very high	93.7	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-73.8	-34.6	-179.2	-167.8	160.3	0	0	0	112.6	I67 Q190 L191 F192 G197 L198 M277 V335 A338	I67-I194 HydrophobicContact CD1-CD1 3.21Å; I67-I194 HydrophobicContact CD1-CG1 4.36Å; I67-I194 HydrophobicContact CG1-CD1 4.24Å; Q190-I194 WeakPolarHBondContact O-CG2 3.28Å; Q190-I194 PolarHBondContact O-N 3.35Å; L191-I194 HydrophobicContact CD1-CG2 4.39Å; L191-I194 WeakPolarHBondContact O-CG2 3.33Å; F192-I194 PolarHBondContact O-N 3.33Å; I194-G197 PolarHBondContact O-N 3.24Å; I194-L198 HydrophobicContact CD1-CD1 4.18Å; I194-L198 HydrophobicContact CG1-CD1 3.69Å; I194-L198 HydrophobicContact CG1-CG 3.81Å; I194-L198 WeakPolarHBondContact O-CB 3.38Å; I194-L198 WeakPolarHBondContact O-CG 3.44Å; I194-L198 PolarHBondContact O-N 3.35Å; I194-M277 HydrophobicContact CG1-CE 4.45Å; I194-M277 HydrophobicContact CG2-CE 3.83Å; I194-V335 HydrophobicContact CD1-CB 4.49Å; I194-V335 HydrophobicContact CD1-CG2 4.04Å; I194-V335 HydrophobicContact CG1-CG2 4.29Å; I194-A338 HydrophobicContact CB-CB 3.85Å; I194-A338 HydrophobicContact CD1-CB 3.62Å; I194-A338 HydrophobicContact CG1-CB 4.37Å; I194-A338 HydrophobicContact CG2-CB 3.87Å
195	F	94.4	Very high	94.2	Very high	88 Å²	88	36.5 Å²	36.5	39%	0.386	18%	0.18	S	C	.	.	H	α-helix	trans	-55.7	-54	171.4	178.5	-85.7	0	0	0	110.1	L191 F192 W199 M277	L191-F195 VanDerWaalsContact O-CB 3.23Å; L191-F195 WeakPolarHBondContact O-CB 3.27Å; L191-F195 PolarHBondContact O-N 3.42Å; F192-F195 PolarHBondContact O-N 3.01Å; F195-W199 AromaticContact CD2-CD1 3.69Å; F195-W199 AromaticContact CD2-NE1 3.86Å; F195-W199 AromaticContact CE2-CD1 3.56Å; F195-W199 AromaticContact CE2-NE1 3.49Å; F195-W199 AromaticContact CG-CD1 3.98Å; F195-W199 AromaticContact CZ-CD1 3.73Å; F195-W199 HydrophobicContact CZ-CG 4.46Å; F195-W199 AromaticContact CZ-NE1 3.94Å; F195-W199 VanDerWaalsContact O-CB 3.3Å; F195-W199 WeakPolarHBondContact O-CB 3.49Å; F195-W199 VanDerWaalsContact O-CD1 3.23Å; F195-W199 PolarHBondContact O-N 2.89Å; F195-M277 HydrophobicContact CB-CE 4.4Å; F195-M277 HydrophobicContact CB-SD 4Å; F195-M277 HydrophobicContact CD2-SD 3.59Å; F195-M277 VanDerWaalsContact CD2-SD 3.59Å; F195-M277 HydrophobicContact CG-SD 4.27Å
196	L	94.1	Very high	94.7	Very high	91 Å²	91	37 Å²	37	48%	0.476	19%	0.185	S	C	.	.	H	α-helix	trans	-65.8	-45.2	178.6	-65.8	176.3	0	0	0	111.7	F192 L198 I200	F192-L196 WeakPolarHBondContact O-CG 3.42Å; F192-L196 PolarHBondContact O-N 3.28Å; L196-L198 PolarHBondContact O-N 3.42Å; L196-I200 HydrophobicContact CB-CD1 4.09Å; L196-I200 VanDerWaalsContact O-CB 3.24Å; L196-I200 WeakPolarHBondContact O-CB 3.48Å; L196-I200 WeakPolarHBondContact O-CD1 3.01Å; L196-I200 WeakPolarHBondContact O-CG1 3.5Å; L196-I200 PolarHBondContact O-N 3.4Å
197	G	94.4	Very high	95	Very high	2 Å²	2	42.5 Å²	42.5	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-58.5	-45.4	-178.1	0	0	0	0	0	112.7	C193 I194 S201	C193-G197 WeakPolarHBondContact O-CA 3.31Å; C193-G197 PolarHBondContact O-N 3.15Å; I194-G197 PolarHBondContact O-N 3.24Å; G197-S201 WeakPolarHBondContact O-CB 3.24Å; G197-S201 PolarHBondContact O-N 3.13Å; G197-S201 PolarHBondContact O-OG 3.44Å
198	L	96	Very high	95.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-76.8	-46.5	179.5	-62	179.9	0	0	0	112.4	I67 I194 L196 I200 S201 I202 M277 P280 I284 L319 V335	I67-L198 HydrophobicContact CG1-CD1 4.42Å; I67-L198 HydrophobicContact CG2-CD1 4.02Å; I194-L198 HydrophobicContact CD1-CD1 4.18Å; I194-L198 HydrophobicContact CG1-CD1 3.69Å; I194-L198 HydrophobicContact CG1-CG 3.81Å; I194-L198 WeakPolarHBondContact O-CB 3.38Å; I194-L198 WeakPolarHBondContact O-CG 3.44Å; I194-L198 PolarHBondContact O-N 3.35Å; L196-L198 PolarHBondContact O-N 3.42Å; L198-I200 PolarHBondContact O-N 3.42Å; L198-S201 WeakPolarHBondContact O-CB 2.98Å; L198-S201 PolarHBondContact O-N 3.4Å; L198-S201 VanDerWaalsContact O-N 3.11Å; L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 3.03Å; L198-M277 HydrophobicContact CD1-CE 4.45Å; L198-P280 HydrophobicContact CB-CB 3.82Å; L198-P280 HydrophobicContact CB-CG 4.26Å; L198-P280 HydrophobicContact CD1-CB 4.46Å; L198-P280 HydrophobicContact CD1-CG 4.28Å; L198-I284 HydrophobicContact CD2-CD1 3.74Å; L198-L319 HydrophobicContact CD2-CD1 4.45Å; L198-V335 HydrophobicContact CD2-CG2 3.62Å; L198-V335 HydrophobicContact CG-CG2 4.35Å
199	W	95.9	Very high	95.4	Very high	87 Å²	87	52.3 Å²	52.3	33%	0.33	27%	0.265	S	S	.	.	H	α-helix	trans	-64.8	-39.8	-177.5	-84.5	105.7	0	0	0	113.1	F195 S201 I202 P203 I279	F195-W199 AromaticContact CD2-CD1 3.69Å; F195-W199 AromaticContact CD2-NE1 3.86Å; F195-W199 AromaticContact CE2-CD1 3.56Å; F195-W199 AromaticContact CE2-NE1 3.49Å; F195-W199 AromaticContact CG-CD1 3.98Å; F195-W199 AromaticContact CZ-CD1 3.73Å; F195-W199 HydrophobicContact CZ-CG 4.46Å; F195-W199 AromaticContact CZ-NE1 3.94Å; F195-W199 VanDerWaalsContact O-CB 3.3Å; F195-W199 WeakPolarHBondContact O-CB 3.49Å; F195-W199 VanDerWaalsContact O-CD1 3.23Å; F195-W199 PolarHBondContact O-N 2.89Å; W199-S201 VanDerWaalsContact C-N 3.25Å; W199-S201 PolarHBondContact O-N 3.14Å; W199-I202 HydrophobicContact CE3-CD1 4.09Å; W199-I202 HydrophobicContact CZ3-CD1 4.47Å; W199-I202 PolarHBondContact O-N 2.87Å; W199-P203 WeakPolarHBondContact O-CD 3.23Å; W199-I279 HydrophobicContact CH2-CB 4.37Å; W199-I279 HydrophobicContact CH2-CG2 3.74Å; W199-I279 HydrophobicContact CZ2-CB 4.19Å; W199-I279 HydrophobicContact CZ2-CG2 4.06Å
200	I	95.3	Very high	95.5	Very high	71 Å²	71	50.4 Å²	50.4	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-68.9	-30.1	176.8	-57.3	170.2	0	0	0	109.8	L196 L198 I202 P203 F204 I327	L196-I200 HydrophobicContact CB-CD1 4.09Å; L196-I200 VanDerWaalsContact O-CB 3.24Å; L196-I200 WeakPolarHBondContact O-CB 3.48Å; L196-I200 WeakPolarHBondContact O-CD1 3.01Å; L196-I200 WeakPolarHBondContact O-CG1 3.5Å; L196-I200 PolarHBondContact O-N 3.4Å; L198-I200 PolarHBondContact O-N 3.42Å; I200-I202 VanDerWaalsContact C-N 3.34Å; I200-I202 PolarHBondContact O-N 3.42Å; I200-P203 WeakPolarHBondContact O-CD 3.49Å; I200-F204 HydrophobicContact CG2-CE2 4.18Å; I200-F204 VanDerWaalsContact O-CD2 3.23Å; I200-F204 WeakPolarHBondContact O-CD2 3.48Å; I200-I327 HydrophobicContact CB-CD1 4.22Å; I200-I327 HydrophobicContact CG2-CD1 3.23Å
201	S	96.9	Very high	95.6	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-30.9	178.9	-62.1	0	0	0	0	114.1	G197 L198 W199 F204 A205 L319 I327	G197-S201 WeakPolarHBondContact O-CB 3.24Å; G197-S201 PolarHBondContact O-N 3.13Å; G197-S201 PolarHBondContact O-OG 3.44Å; L198-S201 WeakPolarHBondContact O-CB 2.98Å; L198-S201 PolarHBondContact O-N 3.4Å; L198-S201 VanDerWaalsContact O-N 3.11Å; W199-S201 VanDerWaalsContact C-N 3.25Å; W199-S201 PolarHBondContact O-N 3.14Å; S201-F204 PolarHBondContact O-N 3.39Å; S201-A205 WeakPolarHBondContact O-CB 3.3Å; S201-A205 PolarHBondContact O-N 2.9Å; S201-L319 VanDerWaalsContact CB-CD2 3.49Å; S201-L319 VanDerWaalsContact OG-CD2 3.24Å; S201-L319 WeakPolarHBondContact OG-CD2 3.39Å; S201-I327 WeakPolarHBondContact OG-CG2 3.24Å
202	I	97.6	Very high	95.6	Very high	9 Å²	9	53.1 Å²	53.1	5%	0.046	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-51.8	-171.9	-70.4	160.1	0	0	0	113.4	L198 W199 I200 F204 A205 M206 P280 L283 I284	L198-I202 WeakPolarHBondContact O-CG1 3.26Å; L198-I202 PolarHBondContact O-N 3.03Å; W199-I202 HydrophobicContact CE3-CD1 4.09Å; W199-I202 HydrophobicContact CZ3-CD1 4.47Å; W199-I202 PolarHBondContact O-N 2.87Å; I200-I202 VanDerWaalsContact C-N 3.34Å; I200-I202 PolarHBondContact O-N 3.42Å; I202-F204 VanDerWaalsContact C-N 3.27Å; I202-F204 PolarHBondContact O-N 3.32Å; I202-A205 PolarHBondContact O-N 3.18Å; I202-M206 HydrophobicContact CG2-CE 3.69Å; I202-M206 HydrophobicContact CG2-CG 4.21Å; I202-M206 HydrophobicContact CG2-SD 3.72Å; I202-M206 WeakPolarHBondContact O-CB 3.37Å; I202-M206 WeakPolarHBondContact O-CG 3.13Å; I202-M206 PolarHBondContact O-N 3.38Å; I202-P280 VanDerWaalsContact CD1-CA 3.46Å; I202-P280 HydrophobicContact CD1-CB 3.49Å; I202-P280 VanDerWaalsContact CD1-CB 3.49Å; I202-L283 HydrophobicContact CD1-CB 4.1Å; I202-L283 HydrophobicContact CD1-CD1 3.97Å; I202-L283 HydrophobicContact CG1-CB 4.31Å; I202-L283 HydrophobicContact CG2-CB 4.36Å; I202-L283 HydrophobicContact CG2-CD1 4.14Å; I202-I284 HydrophobicContact CG1-CG1 4.37Å
203	P	97.1	Very high	95.8	Very high	73 Å²	73	51.3 Å²	51.3	47%	0.474	27%	0.269	S	S	.	.	H	α-helix	trans	-55.7	-42.4	177.9	-27.1	34.2	0	0	0	112.8	W199 I200 M206 V207	W199-P203 WeakPolarHBondContact O-CD 3.23Å; I200-P203 WeakPolarHBondContact O-CD 3.49Å; P203-M206 PolarHBondContact O-N 2.99Å; P203-V207 WeakPolarHBondContact O-CG1 3.1Å; P203-V207 WeakPolarHBondContact O-CG2 3.14Å; P203-V207 PolarHBondContact O-N 3.44Å; P203-V207 VanDerWaalsContact O-N 3.16Å
204	F	97.3	Very high	95.9	Very high	71 Å²	71	51.3 Å²	51.3	31%	0.311	27%	0.267	S	S	.	.	H	α-helix	trans	-68	-41.5	-180	-69.4	-80.3	0	0	0	112.4	I200 S201 I202 M206 V207 N208 P324 W326 I327	I200-F204 HydrophobicContact CG2-CE2 4.18Å; I200-F204 VanDerWaalsContact O-CD2 3.23Å; I200-F204 WeakPolarHBondContact O-CD2 3.48Å; S201-F204 PolarHBondContact O-N 3.39Å; I202-F204 VanDerWaalsContact C-N 3.27Å; I202-F204 PolarHBondContact O-N 3.32Å; F204-M206 VanDerWaalsContact C-N 3.32Å; F204-V207 PolarHBondContact O-N 2.78Å; F204-N208 PolarHBondContact O-N 2.93Å; F204-P324 HydrophobicContact CB-CG 4.44Å; F204-P324 HydrophobicContact CD1-CG 3.56Å; F204-P324 HydrophobicContact CE1-CG 4.06Å; F204-P324 HydrophobicContact CG-CG 4.1Å; F204-W326 HydrophobicContact CE1-CZ2 4.09Å; F204-W326 AromaticContact CE2-CH2 3.89Å; F204-W326 HydrophobicContact CE2-CH2 3.89Å; F204-W326 HydrophobicContact CE2-CZ2 4.03Å; F204-W326 AromaticContact CZ-CH2 3.76Å; F204-W326 HydrophobicContact CZ-CH2 3.76Å; F204-W326 AromaticContact CZ-CZ2 3.53Å; F204-W326 HydrophobicContact CZ-CZ2 3.53Å; F204-I327 HydrophobicContact CD2-CD1 3.82Å; F204-I327 HydrophobicContact CD2-CG1 3.71Å; F204-I327 HydrophobicContact CE2-CD1 3.69Å; F204-I327 HydrophobicContact CE2-CG1 3.86Å; F204-I327 HydrophobicContact CG-CG1 4.21Å; F204-I327 HydrophobicContact CZ-CG1 4.45Å
205	A	97.6	Very high	96	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-67	-35	177.3	0	0	0	0	0	111.8	S201 I202 T211 V287 V318 L322	S201-A205 WeakPolarHBondContact O-CB 3.3Å; S201-A205 PolarHBondContact O-N 2.9Å; I202-A205 PolarHBondContact O-N 3.18Å; A205-T211 PolarHBondContact O-OG1 2.87Å; A205-V287 HydrophobicContact CB-CG1 3.9Å; A205-V318 HydrophobicContact CB-CG1 3.88Å; A205-L322 HydrophobicContact CB-CB 4.15Å
206	M	97.5	Very high	96.1	Very high	65 Å²	65	59.2 Å²	59.2	32%	0.32	31%	0.313	S	S	.	.	H	α-helix	trans	-72.3	-29.8	178.6	-75.7	-178	167.7	0	0	114.3	I202 P203 F204 I214 L283 V287	I202-M206 HydrophobicContact CG2-CE 3.69Å; I202-M206 HydrophobicContact CG2-CG 4.21Å; I202-M206 HydrophobicContact CG2-SD 3.72Å; I202-M206 WeakPolarHBondContact O-CB 3.37Å; I202-M206 WeakPolarHBondContact O-CG 3.13Å; I202-M206 PolarHBondContact O-N 3.38Å; P203-M206 PolarHBondContact O-N 2.99Å; F204-M206 VanDerWaalsContact C-N 3.32Å; M206-I214 HydrophobicContact CE-CD1 3.74Å; M206-I214 HydrophobicContact CE-CG1 4.44Å; M206-L283 HydrophobicContact CE-CB 4.34Å; M206-L283 HydrophobicContact CE-CD1 4.46Å; M206-L283 HydrophobicContact CE-CD2 3.92Å; M206-L283 HydrophobicContact CE-CG 4.47Å; M206-V287 HydrophobicContact CE-CG2 4.36Å; M206-V287 HydrophobicContact CG-CG2 3.67Å
207	V	96.5	Very high	96.1	Very high	117 Å²	117	55.6 Å²	55.6	71%	0.709	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	1.8	179.5	-57.5	0	0	0	0	113.2	P203 F204	P203-V207 WeakPolarHBondContact O-CG1 3.1Å; P203-V207 WeakPolarHBondContact O-CG2 3.14Å; P203-V207 PolarHBondContact O-N 3.44Å; P203-V207 VanDerWaalsContact O-N 3.16Å; F204-V207 PolarHBondContact O-N 2.78Å
208	N	96.3	Very high	96.1	Very high	46 Å²	46	61 Å²	61	25%	0.246	31%	0.314	C	S	.	.			trans	-62.7	137.7	177.2	-167.8	-74.5	0	0	0	110.3	F204 A210 T211 L322	F204-N208 PolarHBondContact O-N 2.93Å; N208-A210 PolarHBondContact O-N 2.75Å; N208-A210 VanDerWaalsContact O-N 3.14Å; N208-A210 WeakPolarHBondContact OD1-CB 3.32Å; N208-A210 PolarHBondContact OD1-N 3.23Å; N208-T211 PolarHBondContact O-N 2.99Å; N208-L322 HydrophobicContact CB-CB 4.31Å; N208-L322 HydrophobicContact CB-CD2 4.41Å; N208-L322 WeakPolarHBondContact ND2-CA 3.28Å; N208-L322 PolarHBondContact ND2-O 3.41Å
209	E	95.1	Very high	96	Very high	184 Å²	184	66.7 Å²	66.7	86%	0.86	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.5	-177.1	-63.7	-179.6	178.2	0	0	113.5	T211	E209-T211 VanDerWaalsContact C-N 3.29Å
210	A	94.1	Very high	95.8	Very high	5 Å²	5	67.1 Å²	67.1	4%	0.041	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-11.3	175.5	0	0	0	0	0	113.4	N208 T291 N292 M295 T296 L322	N208-A210 PolarHBondContact O-N 2.75Å; N208-A210 VanDerWaalsContact O-N 3.14Å; N208-A210 WeakPolarHBondContact OD1-CB 3.32Å; N208-A210 PolarHBondContact OD1-N 3.23Å; A210-T291 HydrophobicContact CB-CG2 4.11Å; A210-T291 WeakPolarHBondContact O-CA 3.43Å; A210-N292 PolarHBondContact O-N 3.32Å; A210-M295 HydrophobicContact CB-CB 3.92Å; A210-T296 HydrophobicContact CB-CG2 3.76Å; A210-L322 HydrophobicContact CB-CD2 4.41Å
211	T	95.6	Very high	95.8	Very high	13 Å²	13	64.5 Å²	64.5	8%	0.08	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-105.3	117.8	-173.8	-57.2	0	0	0	0	110.9	A205 N208 E209 V287 T291	A205-T211 PolarHBondContact O-OG1 2.87Å; N208-T211 PolarHBondContact O-N 2.99Å; E209-T211 VanDerWaalsContact C-N 3.29Å; T211-V287 HydrophobicContact CG2-CG1 3.9Å; T211-T291 PolarHBondContact OG1-OG1 3.41Å
212	V	95.4	Very high	95.8	Very high	61 Å²	61	67.5 Å²	67.5	37%	0.37	35%	0.348	S	S	.	.			trans	-78	147.9	171.7	179.6	0	0	0	0	109	I214 Q216 T217 S290	V212-I214 PolarHBondContact O-N 3.12Å; V212-Q216 HydrophobicContact CG1-CB 4.18Å; V212-T217 HydrophobicContact CB-CG2 4.46Å; V212-T217 HydrophobicContact CG1-CG2 4.33Å; V212-S290 PolarHBondContact N-O 2.79Å; V212-S290 WeakPolarHBondContact O-CB 3.43Å
213	P	97	Very high	95.7	Very high	65 Å²	65	67.8 Å²	67.8	42%	0.422	35%	0.353	S	S	.	.			trans	-50	128	176.4	-30.1	36.3	0	0	0	112.5	T215 Q216 T217	P213-T215 PolarHBondContact O-N 3.33Å; P213-Q216 HydrophobicContact CB-CG 4.29Å; P213-Q216 WeakPolarHBondContact O-CB 3.46Å; P213-Q216 PolarHBondContact O-N 3.02Å; P213-T217 PolarHBondContact O-OG1 3.16Å
214	I	96.5	Very high	95.6	Very high	27 Å²	27	68.7 Å²	68.7	14%	0.138	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-25	-174.5	63.2	165	0	0	0	113.1	M206 V212 Q216 T217 W218 W221 L283 A286 V287	M206-I214 HydrophobicContact CE-CD1 3.74Å; M206-I214 HydrophobicContact CE-CG1 4.44Å; V212-I214 PolarHBondContact O-N 3.12Å; I214-Q216 VanDerWaalsContact C-N 3.33Å; I214-T217 WeakPolarHBondContact CA-OG1 3.2Å; I214-T217 CarbonylContact O-C 3.54Å; I214-T217 PolarHBondContact O-N 3.41Å; I214-T217 PolarHBondContact O-OG1 3.37Å; I214-W218 PolarHBondContact O-N 2.74Å; I214-W221 HydrophobicContact CB-CZ2 4Å; I214-W221 HydrophobicContact CD1-CH2 4.31Å; I214-W221 HydrophobicContact CD1-CZ2 3.98Å; I214-W221 HydrophobicContact CG1-CZ2 4.22Å; I214-W221 PolarHBondContact O-NE1 3.02Å; I214-L283 HydrophobicContact CD1-CD2 3.96Å; I214-A286 HydrophobicContact CB-CB 4.49Å; I214-A286 HydrophobicContact CG2-CB 4.25Å; I214-V287 HydrophobicContact CG2-CG2 3.94Å
215	T	95.8	Very high	95.5	Very high	112 Å²	112	67.4 Å²	67.4	69%	0.687	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-29.8	176.6	51.6	0	0	0	0	112.9	P213 T217	P213-T215 PolarHBondContact O-N 3.33Å; T215-T217 VanDerWaalsContact C-N 3.29Å
216	Q	96.2	Very high	95.3	Very high	143 Å²	143	71.2 Å²	71.2	67%	0.668	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-15.1	176.8	-62.4	-178.2	20.5	0	0	112.5	V212 P213 I214	V212-Q216 HydrophobicContact CG1-CB 4.18Å; P213-Q216 HydrophobicContact CB-CG 4.29Å; P213-Q216 WeakPolarHBondContact O-CB 3.46Å; P213-Q216 PolarHBondContact O-N 3.02Å; I214-Q216 VanDerWaalsContact C-N 3.33Å
217	T	94.4	Very high	95.1	Very high	14 Å²	14	73.2 Å²	73.2	9%	0.086	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	18.8	-178	47.4	0	0	0	0	111.6	V212 P213 I214 T215 D219 K220 W221 S290	V212-T217 HydrophobicContact CB-CG2 4.46Å; V212-T217 HydrophobicContact CG1-CG2 4.33Å; P213-T217 PolarHBondContact O-OG1 3.16Å; I214-T217 WeakPolarHBondContact CA-OG1 3.2Å; I214-T217 CarbonylContact O-C 3.54Å; I214-T217 PolarHBondContact O-N 3.41Å; I214-T217 PolarHBondContact O-OG1 3.37Å; T215-T217 VanDerWaalsContact C-N 3.29Å; T217-D219 PolarHBondContact O-N 3.41Å; T217-D219 VanDerWaalsContact O-N 3.11Å; T217-K220 HydrophobicContact CG2-CD 4.22Å; T217-K220 WeakPolarHBondContact O-CB 3.14Å; T217-K220 PolarHBondContact O-N 3.25Å; T217-W221 PolarHBondContact O-NE1 3.45Å; T217-S290 VanDerWaalsContact OG1-CB 3.28Å; T217-S290 WeakPolarHBondContact OG1-CB 3.4Å; T217-S290 PolarHBondContact OG1-OG 2.94Å
218	W	94.9	Very high	95	Very high	115 Å²	115	73.2 Å²	73.2	44%	0.436	39%	0.391	S	S	.	.	H	α-helix	trans	-48.3	-40.5	179.9	174.7	-117.4	0	0	0	112.5	L81 I214 K220 W221 K222	L81-W218 HydrophobicContact CD2-CH2 4.28Å; L81-W218 HydrophobicContact CD2-CZ3 4.38Å; I214-W218 PolarHBondContact O-N 2.74Å; W218-K220 PolarHBondContact O-N 2.88Å; W218-W221 HydrophobicContact CE3-CD2 4.21Å; W218-W221 AromaticContact CE3-CE2 3.83Å; W218-W221 HydrophobicContact CE3-CE3 4.17Å; W218-W221 AromaticContact CE3-CH2 3.44Å; W218-W221 HydrophobicContact CE3-CH2 3.44Å; W218-W221 VanDerWaalsContact CE3-CH2 3.44Å; W218-W221 AromaticContact CE3-CZ2 3.44Å; W218-W221 HydrophobicContact CE3-CZ2 3.44Å; W218-W221 VanDerWaalsContact CE3-CZ2 3.44Å; W218-W221 AromaticContact CE3-CZ3 3.82Å; W218-W221 HydrophobicContact CE3-CZ3 3.82Å; W218-W221 HydrophobicContact CH2-CZ3 4.49Å; W218-W221 HydrophobicContact CZ3-CD2 4.48Å; W218-W221 AromaticContact CZ3-CE3 3.97Å; W218-W221 HydrophobicContact CZ3-CE3 3.97Å; W218-W221 AromaticContact CZ3-CH2 3.3Å; W218-W221 HydrophobicContact CZ3-CH2 3.3Å; W218-W221 AromaticContact CZ3-CZ2 3.85Å; W218-W221 HydrophobicContact CZ3-CZ2 3.85Å; W218-W221 AromaticContact CZ3-CZ3 3.37Å; W218-W221 HydrophobicContact CZ3-CZ3 3.37Å; W218-W221 PolarHBondContact O-N 3.5Å; W218-K222 HydrophobicContact CD2-CB 3.68Å; W218-K222 HydrophobicContact CD2-CD 4.36Å; W218-K222 VanDerWaalsContact CE2-CB 3.42Å; W218-K222 HydrophobicContact CE3-CB 4Å; W218-K222 HydrophobicContact CG-CB 4.26Å; W218-K222 HydrophobicContact CG-CD 4.22Å; W218-K222 HydrophobicContact CH2-CB 3.87Å; W218-K222 HydrophobicContact CZ2-CB 3.53Å; W218-K222 HydrophobicContact CZ2-CD 4.47Å; W218-K222 HydrophobicContact CZ3-CB 4.1Å; W218-K222 VanDerWaalsContact NE1-CD 3.34Å; W218-K222 WeakPolarHBondContact O-CB 3.05Å; W218-K222 VanDerWaalsContact O-CG 3.22Å; W218-K222 WeakPolarHBondContact O-CG 3.4Å; W218-K222 PolarHBondContact O-N 3.26Å
219	D	94	Very high	94.9	Very high	121 Å²	121	71.8 Å²	71.8	65%	0.647	38%	0.383	S	S	*	.	H	α-helix	trans	-64.2	-20.5	178.9	-65.2	-42.1	0	0	0	114.5	T217 K222	T217-D219 PolarHBondContact O-N 3.41Å; T217-D219 VanDerWaalsContact O-N 3.11Å; D219-K222 VanDerWaalsContact OD1-CE 3.28Å; D219-K222 WeakPolarHBondContact OD1-CE 3.36Å; D219-K222 IonicContact OD1-NZ 2.68Å; D219-K222 PolarHBondContact OD1-NZ 2.76Å
220	K	91.9	Very high	94.9	Very high	96 Å²	96	65.5 Å²	65.5	42%	0.417	36%	0.36	S	S	.	.	H	α-helix	trans	-78.7	-29.5	178.7	-62.3	-171.1	176.8	-174.3	0	113.5	T217 W218 A289	T217-K220 HydrophobicContact CG2-CD 4.22Å; T217-K220 WeakPolarHBondContact O-CB 3.14Å; T217-K220 PolarHBondContact O-N 3.25Å; W218-K220 PolarHBondContact O-N 2.88Å; K220-A289 HydrophobicContact CB-CB 4.43Å; K220-A289 WeakPolarHBondContact CD-O 3.27Å
221	W	95.2	Very high	95.1	Very high	16 Å²	16	72.4 Å²	72.4	6%	0.061	39%	0.389	C	S	.	.	H	α-helix	trans	-129.2	-2.7	-169.6	62.4	-94.1	0	0	0	113.8	T74 G80 L81 I214 T217 W218 A286 A289	T74-W221 HydrophobicContact CG2-CB 4.4Å; T74-W221 HydrophobicContact CG2-CE3 4.08Å; T74-W221 WeakPolarHBondContact O-CB 3.5Å; G80-W221 CarbonylContact C-O 3.2Å; G80-W221 VanDerWaalsContact CA-O 3.27Å; G80-W221 WeakPolarHBondContact CA-O 3.26Å; L81-W221 HydrophobicContact CB-CE3 4.33Å; L81-W221 HydrophobicContact CD2-CZ3 4Å; L81-W221 PolarHBondContact N-O 2.97Å; I214-W221 HydrophobicContact CB-CZ2 4Å; I214-W221 HydrophobicContact CD1-CH2 4.31Å; I214-W221 HydrophobicContact CD1-CZ2 3.98Å; I214-W221 HydrophobicContact CG1-CZ2 4.22Å; I214-W221 PolarHBondContact O-NE1 3.02Å; T217-W221 PolarHBondContact O-NE1 3.45Å; W218-W221 HydrophobicContact CE3-CD2 4.21Å; W218-W221 AromaticContact CE3-CE2 3.83Å; W218-W221 HydrophobicContact CE3-CE3 4.17Å; W218-W221 AromaticContact CE3-CH2 3.44Å; W218-W221 HydrophobicContact CE3-CH2 3.44Å; W218-W221 VanDerWaalsContact CE3-CH2 3.44Å; W218-W221 AromaticContact CE3-CZ2 3.44Å; W218-W221 HydrophobicContact CE3-CZ2 3.44Å; W218-W221 VanDerWaalsContact CE3-CZ2 3.44Å; W218-W221 AromaticContact CE3-CZ3 3.82Å; W218-W221 HydrophobicContact CE3-CZ3 3.82Å; W218-W221 HydrophobicContact CH2-CZ3 4.49Å; W218-W221 HydrophobicContact CZ3-CD2 4.48Å; W218-W221 AromaticContact CZ3-CE3 3.97Å; W218-W221 HydrophobicContact CZ3-CE3 3.97Å; W218-W221 AromaticContact CZ3-CH2 3.3Å; W218-W221 HydrophobicContact CZ3-CH2 3.3Å; W218-W221 AromaticContact CZ3-CZ2 3.85Å; W218-W221 HydrophobicContact CZ3-CZ2 3.85Å; W218-W221 AromaticContact CZ3-CZ3 3.37Å; W218-W221 HydrophobicContact CZ3-CZ3 3.37Å; W218-W221 PolarHBondContact O-N 3.5Å; W221-A286 HydrophobicContact CD2-CB 3.51Å; W221-A286 HydrophobicContact CE3-CB 3.71Å; W221-A286 HydrophobicContact CG-CB 3.93Å; W221-A286 HydrophobicContact CH2-CB 4.12Å; W221-A286 HydrophobicContact CZ2-CB 3.97Å; W221-A286 HydrophobicContact CZ3-CB 3.99Å; W221-A289 HydrophobicContact CB-CB 3.94Å
222	K	96.3	Very high	95.1	Very high	64 Å²	64	73.3 Å²	73.3	28%	0.278	39%	0.392	S	S	.	.	S	Bend	trans	-67.8	-44.4	174.5	67.7	179.4	-164.6	-168.6	0	112.6	L81 V82 W218 D219	L81-K222 PolarHBondContact N-O 3.02Å; V82-K222 WeakPolarHBondContact CB-O 3.38Å; V82-K222 WeakPolarHBondContact CG2-O 3.47Å; V82-K222 PolarHBondContact N-O 3.49Å; W218-K222 HydrophobicContact CD2-CB 3.68Å; W218-K222 HydrophobicContact CD2-CD 4.36Å; W218-K222 VanDerWaalsContact CE2-CB 3.42Å; W218-K222 HydrophobicContact CE3-CB 4Å; W218-K222 HydrophobicContact CG-CB 4.26Å; W218-K222 HydrophobicContact CG-CD 4.22Å; W218-K222 HydrophobicContact CH2-CB 3.87Å; W218-K222 HydrophobicContact CZ2-CB 3.53Å; W218-K222 HydrophobicContact CZ2-CD 4.47Å; W218-K222 HydrophobicContact CZ3-CB 4.1Å; W218-K222 VanDerWaalsContact NE1-CD 3.34Å; W218-K222 WeakPolarHBondContact O-CB 3.05Å; W218-K222 VanDerWaalsContact O-CG 3.22Å; W218-K222 WeakPolarHBondContact O-CG 3.4Å; W218-K222 PolarHBondContact O-N 3.26Å; D219-K222 VanDerWaalsContact OD1-CE 3.28Å; D219-K222 WeakPolarHBondContact OD1-CE 3.36Å; D219-K222 IonicContact OD1-NZ 2.68Å; D219-K222 PolarHBondContact OD1-NZ 2.76Å
223	G	94.3	Very high	95.1	Very high	15 Å²	15	73.1 Å²	73.1	16%	0.155	39%	0.385	C	S	.	.			trans	73.3	169	-165	0	0	0	0	0	115	Q79	Q79-G223 WeakPolarHBondContact O-CA 3.46Å
224	S	95.4	Very high	95.2	Very high	91 Å²	91	73.4 Å²	73.4	64%	0.636	39%	0.385	S	S	*	.			trans	-145.8	151.9	171.9	54	0	0	0	0	110.7	W83	W83-S224 PolarHBondContact NE1-O 3.14Å
225	V	95	Very high	95.3	Very high	45 Å²	45	72.2 Å²	72.2	27%	0.273	38%	0.379	S	S	.	.			trans	-107.9	117.9	170.1	-172.9	0	0	0	0	107	V82 W83 D229 Y233	V82-V225 HydrophobicContact CG1-CG2 3.42Å; V82-V225 VanDerWaalsContact CG1-CG2 3.42Å; W83-V225 HydrophobicContact CZ2-CG1 4.23Å; W83-V225 HydrophobicContact CZ2-CG2 4.23Å; V225-D229 HydrophobicContact CG1-CB 4.21Å; V225-Y233 HydrophobicContact CB-CD2 4.37Å; V225-Y233 HydrophobicContact CG1-CD2 4.08Å; V225-Y233 HydrophobicContact CG1-CG 4.11Å; V225-Y233 HydrophobicContact CG2-CD2 3.3Å; V225-Y233 HydrophobicContact CG2-CE2 3.46Å; V225-Y233 VanDerWaalsContact CG2-CE2 3.46Å; V225-Y233 HydrophobicContact CG2-CG 3.99Å
226	D	93.6	Very high	95.3	Very high	81 Å²	81	67.2 Å²	67.2	43%	0.433	35%	0.348	S	S	.	.			trans	-61.3	135.2	168.5	-172.5	-52.5	0	0	0	108.2	M228 D229	D226-M228 PolarHBondContact O-N 2.92Å; D226-M228 WeakPolarHBondContact OD1-CB 3.3Å; D226-M228 PolarHBondContact OD1-N 3.43Å; D226-D229 WeakPolarHBondContact O-CA 3.34Å; D226-D229 PolarHBondContact O-N 3.4Å
227	P	94.1	Very high	95.4	Very high	107 Å²	107	62.7 Å²	62.7	70%	0.695	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-46.9	-33.6	174.2	-30.5	36.3	0	0	0	114.4	D229 S230	P227-D229 VanDerWaalsContact C-N 3.27Å; P227-D229 PolarHBondContact O-N 3.3Å; P227-S230 WeakPolarHBondContact O-CB 3.16Å; P227-S230 PolarHBondContact O-N 3.02Å; P227-S230 PolarHBondContact O-OG 3.44Å
228	M	93.8	Very high	95.6	Very high	117 Å²	117	64.4 Å²	64.4	58%	0.576	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-68.1	-23	176.2	-68.7	-66	179.7	0	0	113.9	D226 R470	D226-M228 PolarHBondContact O-N 2.92Å; D226-M228 WeakPolarHBondContact OD1-CB 3.3Å; D226-M228 PolarHBondContact OD1-N 3.43Å; M228-R470 WeakPolarHBondContact O-CD 3.32Å
229	D	94.6	Very high	95.8	Very high	15 Å²	15	59 Å²	59	8%	0.08	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-92.2	2.1	178	-61.2	-36.7	0	0	0	112.7	W83 V225 D226 P227 F231 F232 Y233 Y468 R470	W83-D229 HydrophobicContact CH2-CB 4.33Å; V225-D229 HydrophobicContact CG1-CB 4.21Å; D226-D229 WeakPolarHBondContact O-CA 3.34Å; D226-D229 PolarHBondContact O-N 3.4Å; P227-D229 VanDerWaalsContact C-N 3.27Å; P227-D229 PolarHBondContact O-N 3.3Å; D229-F231 VanDerWaalsContact C-N 3.3Å; D229-F231 PolarHBondContact O-N 3.39Å; D229-F232 PolarHBondContact O-N 3.35Å; D229-F232 VanDerWaalsContact O-N 3.09Å; D229-Y233 WeakPolarHBondContact O-CB 3.23Å; D229-Y233 PolarHBondContact O-N 3.12Å; D229-Y468 VanDerWaalsContact OD1-CE2 3.3Å; D229-Y468 WeakPolarHBondContact OD1-CE2 3.44Å; D229-Y468 PolarHBondContact OD1-OH 2.8Å; D229-Y468 PolarHBondContact OD2-OH 3.07Å; D229-Y468 VanDerWaalsContact OD2-OH 3.14Å; D229-R470 WeakPolarHBondContact OD1-CG 3.32Å; D229-R470 IonicContact OD1-CZ 3.6Å; D229-R470 IonicContact OD1-NE 2.65Å; D229-R470 PolarHBondContact OD1-NE 3.06Å; D229-R470 IonicContact OD1-NH2 3.57Å
230	S	95.7	Very high	96	Very high	53 Å²	53	53.2 Å²	53.2	37%	0.371	29%	0.285	S	S	.	.	H	α-helix	trans	-55	-42.1	-176.2	-60.1	0	0	0	0	113.2	P227 Y233 V234	P227-S230 WeakPolarHBondContact O-CB 3.16Å; P227-S230 PolarHBondContact O-N 3.02Å; P227-S230 PolarHBondContact O-OG 3.44Å; S230-Y233 PolarHBondContact O-N 2.93Å; S230-V234 VanDerWaalsContact O-CG2 3.32Å; S230-V234 WeakPolarHBondContact O-CG2 3.46Å; S230-V234 PolarHBondContact O-N 3.39Å
231	F	96.4	Very high	96.3	Very high	150 Å²	150	49.6 Å²	49.6	66%	0.658	27%	0.27	S	S	*	.	H	α-helix	trans	-69.4	-39.3	179	-74.7	-70.4	0	0	0	112.4	D229 V234 D235 R470	D229-F231 VanDerWaalsContact C-N 3.3Å; D229-F231 PolarHBondContact O-N 3.39Å; F231-V234 PolarHBondContact O-N 2.94Å; F231-D235 VanDerWaalsContact O-CB 3.27Å; F231-D235 WeakPolarHBondContact O-CB 3.46Å; F231-D235 PolarHBondContact O-N 3Å; F231-R470 WeakPolarHBondContact CB-O 3.28Å
232	F	95.6	Very high	96.5	Very high	31 Å²	31	51.5 Å²	51.5	14%	0.136	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-43.2	174.6	173.7	-112.1	0	0	0	111.4	W83 D229 V234 D235 N236 Y468 Q469	W83-F232 AromaticContact CH2-CD1 3.74Å; W83-F232 HydrophobicContact CH2-CD1 3.74Å; W83-F232 AromaticContact CH2-CE1 3.99Å; W83-F232 HydrophobicContact CH2-CE1 3.99Å; W83-F232 AromaticContact CZ3-CD1 3.77Å; W83-F232 HydrophobicContact CZ3-CD1 3.77Å; W83-F232 AromaticContact CZ3-CE1 3.7Å; W83-F232 HydrophobicContact CZ3-CE1 3.7Å; D229-F232 PolarHBondContact O-N 3.35Å; D229-F232 VanDerWaalsContact O-N 3.09Å; F232-V234 PolarHBondContact O-N 2.92Å; F232-D235 WeakPolarHBondContact O-CB 3.23Å; F232-D235 PolarHBondContact O-N 3.47Å; F232-N236 VanDerWaalsContact CE1-ND2 3.31Å; F232-N236 WeakPolarHBondContact CE1-ND2 3.46Å; F232-N236 WeakPolarHBondContact CE2-ND2 3.43Å; F232-N236 WeakPolarHBondContact CZ-ND2 3.41Å; F232-N236 PolarHBondContact O-N 3.38Å; F232-N236 PolarHBondContact O-ND2 3.4Å; F232-N236 PolarHBondContact O-OD1 3.45Å; F232-Y468 AromaticContact CD1-CD2 3.74Å; F232-Y468 HydrophobicContact CD1-CD2 3.74Å; F232-Y468 AromaticContact CD1-CE2 3.95Å; F232-Y468 HydrophobicContact CD1-CE2 3.95Å; F232-Y468 HydrophobicContact CD2-CD2 4.07Å; F232-Y468 AromaticContact CE1-CD2 3.85Å; F232-Y468 HydrophobicContact CE1-CD2 3.85Å; F232-Y468 HydrophobicContact CE1-CE2 4.3Å; F232-Y468 HydrophobicContact CE1-CG 4.24Å; F232-Y468 HydrophobicContact CE2-CD2 4.16Å; F232-Y468 HydrophobicContact CE2-CG 4.46Å; F232-Y468 AromaticContact CG-CD2 3.86Å; F232-Y468 HydrophobicContact CG-CD2 3.86Å; F232-Y468 HydrophobicContact CG-CE2 4.28Å; F232-Y468 HydrophobicContact CZ-CD2 4.05Å; F232-Y468 HydrophobicContact CZ-CG 4.18Å; F232-Q469 WeakPolarHBondContact CD2-O 3.36Å
233	Y	97.3	Very high	96.6	Very high	58 Å²	58	48.5 Å²	48.5	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-46.2	175.5	-175.5	-84.3	0	0	0	111.7	V82 W83 Q85 V225 D229 S230 L237	V82-Y233 HydrophobicContact CG1-CE2 3.85Å; V82-Y233 VanDerWaalsContact O-CE2 3.28Å; V82-Y233 WeakPolarHBondContact O-CE2 3.31Å; V82-Y233 PolarHBondContact O-OH 3.49Å; W83-Y233 HydrophobicContact CD2-CD2 4.19Å; W83-Y233 HydrophobicContact CD2-CE2 4.46Å; W83-Y233 AromaticContact CE3-CD2 3.95Å; W83-Y233 HydrophobicContact CE3-CD2 3.95Å; W83-Y233 HydrophobicContact CE3-CE2 4.45Å; W83-Y233 HydrophobicContact CH2-CD2 4Å; W83-Y233 HydrophobicContact CZ2-CD2 4.25Å; W83-Y233 AromaticContact CZ3-CD2 3.84Å; W83-Y233 HydrophobicContact CZ3-CD2 3.84Å; Q85-Y233 HydrophobicContact CG-CE2 4.11Å; Q85-Y233 VanDerWaalsContact NE2-CD1 3.35Å; Q85-Y233 VanDerWaalsContact NE2-CE1 3.33Å; Q85-Y233 PolarHBondContact NE2-O 3.31Å; Q85-Y233 PolarHBondContact OE1-O 3.33Å; V225-Y233 HydrophobicContact CB-CD2 4.37Å; V225-Y233 HydrophobicContact CG1-CD2 4.08Å; V225-Y233 HydrophobicContact CG1-CG 4.11Å; V225-Y233 HydrophobicContact CG2-CD2 3.3Å; V225-Y233 HydrophobicContact CG2-CE2 3.46Å; V225-Y233 VanDerWaalsContact CG2-CE2 3.46Å; V225-Y233 HydrophobicContact CG2-CG 3.99Å; D229-Y233 WeakPolarHBondContact O-CB 3.23Å; D229-Y233 PolarHBondContact O-N 3.12Å; S230-Y233 PolarHBondContact O-N 2.93Å; Y233-L237 PolarHBondContact O-N 3.3Å; Y233-L237 VanDerWaalsContact O-N 3.17Å
234	V	97.9	Very high	96.7	Very high	71 Å²	71	47.8 Å²	47.8	43%	0.43	26%	0.259	S	S	.	.	H	α-helix	trans	-68.7	-38.2	176.6	172.9	0	0	0	0	111.7	S230 F231 F232 N236 L237 L238	S230-V234 VanDerWaalsContact O-CG2 3.32Å; S230-V234 WeakPolarHBondContact O-CG2 3.46Å; S230-V234 PolarHBondContact O-N 3.39Å; F231-V234 PolarHBondContact O-N 2.94Å; F232-V234 PolarHBondContact O-N 2.92Å; V234-N236 VanDerWaalsContact C-N 3.31Å; V234-N236 PolarHBondContact O-N 3.02Å; V234-L237 PolarHBondContact O-N 2.71Å; V234-L238 HydrophobicContact CG1-CD1 3.9Å; V234-L238 HydrophobicContact CG1-CG 4.13Å; V234-L238 VanDerWaalsContact O-CG 3.3Å; V234-L238 WeakPolarHBondContact O-CG 3.38Å; V234-L238 PolarHBondContact O-N 3.19Å
235	D	98	Very high	96.8	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-57.4	-46.3	177.4	-165.8	31.9	0	0	0	111.5	F231 F232 L238 M239 P472 C473 K474 T475	F231-D235 VanDerWaalsContact O-CB 3.27Å; F231-D235 WeakPolarHBondContact O-CB 3.46Å; F231-D235 PolarHBondContact O-N 3Å; F232-D235 WeakPolarHBondContact O-CB 3.23Å; F232-D235 PolarHBondContact O-N 3.47Å; D235-L238 PolarHBondContact O-N 3.11Å; D235-M239 WeakPolarHBondContact O-CB 3.27Å; D235-M239 PolarHBondContact O-N 3.32Å; D235-P472 HydrophobicContact CB-CB 3.74Å; D235-P472 VanDerWaalsContact CG-CA 3.5Å; D235-P472 VanDerWaalsContact OD2-CA 3.31Å; D235-P472 WeakPolarHBondContact OD2-CA 3.38Å; D235-C473 PolarHBondContact OD2-N 3.36Å; D235-K474 WeakPolarHBondContact OD2-CB 3.42Å; D235-K474 PolarHBondContact OD2-N 3.34Å; D235-T475 WeakPolarHBondContact OD1-CA 3.42Å; D235-T475 WeakPolarHBondContact OD1-CB 3.08Å; D235-T475 PolarHBondContact OD1-N 3.17Å; D235-T475 PolarHBondContact OD1-OG1 3.27Å
236	N	97.7	Very high	96.9	Very high	7 Å²	7	41.3 Å²	41.3	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-64.2	-42.3	177.3	-65.6	-10	0	0	0	111.4	F232 V234 M239 L240 Y402	F232-N236 VanDerWaalsContact CE1-ND2 3.31Å; F232-N236 WeakPolarHBondContact CE1-ND2 3.46Å; F232-N236 WeakPolarHBondContact CE2-ND2 3.43Å; F232-N236 WeakPolarHBondContact CZ-ND2 3.41Å; F232-N236 PolarHBondContact O-N 3.38Å; F232-N236 PolarHBondContact O-ND2 3.4Å; F232-N236 PolarHBondContact O-OD1 3.45Å; V234-N236 VanDerWaalsContact C-N 3.31Å; V234-N236 PolarHBondContact O-N 3.02Å; N236-M239 WeakPolarHBondContact O-CB 3.48Å; N236-M239 PolarHBondContact O-N 3.34Å; N236-L240 WeakPolarHBondContact O-CD1 3.34Å; N236-L240 VanDerWaalsContact O-CG 3.26Å; N236-L240 WeakPolarHBondContact O-CG 3.38Å; N236-L240 PolarHBondContact O-N 3.4Å; N236-Y402 HydrophobicContact CB-CE2 3.94Å; N236-Y402 PolarHBondContact OD1-OH 3.46Å
237	L	98.2	Very high	96.9	Very high	47 Å²	47	37.8 Å²	37.8	25%	0.246	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-44.8	178.3	-178.7	62	0	0	0	111.5	Q85 Y233 V234 M239 L240 I241	Q85-L237 HydrophobicContact CB-CD1 4.43Å; Y233-L237 PolarHBondContact O-N 3.3Å; Y233-L237 VanDerWaalsContact O-N 3.17Å; V234-L237 PolarHBondContact O-N 2.71Å; L237-M239 VanDerWaalsContact C-N 3.33Å; L237-M239 PolarHBondContact O-N 2.93Å; L237-L240 PolarHBondContact O-N 2.95Å; L237-I241 HydrophobicContact CD1-CD1 4.08Å; L237-I241 HydrophobicContact CD1-CG1 4.37Å; L237-I241 HydrophobicContact CG-CD1 3.89Å; L237-I241 VanDerWaalsContact O-CG1 3.25Å; L237-I241 WeakPolarHBondContact O-CG1 3.47Å; L237-I241 PolarHBondContact O-N 3.02Å
238	L	98.7	Very high	97	Very high	51 Å²	51	32.8 Å²	32.8	27%	0.267	16%	0.163	S	C	.	.	H	α-helix	trans	-63.5	-39.9	177.2	-66.3	173	0	0	0	111.5	V234 D235 I241 F242 T475	V234-L238 HydrophobicContact CG1-CD1 3.9Å; V234-L238 HydrophobicContact CG1-CG 4.13Å; V234-L238 VanDerWaalsContact O-CG 3.3Å; V234-L238 WeakPolarHBondContact O-CG 3.38Å; V234-L238 PolarHBondContact O-N 3.19Å; D235-L238 PolarHBondContact O-N 3.11Å; L238-I241 PolarHBondContact O-N 3.3Å; L238-F242 HydrophobicContact CB-CD2 4.31Å; L238-F242 HydrophobicContact CD2-CD2 4.35Å; L238-F242 HydrophobicContact CD2-CE2 3.78Å; L238-F242 WeakPolarHBondContact O-CB 3.37Å; L238-F242 WeakPolarHBondContact O-CD2 3.49Å; L238-F242 PolarHBondContact O-N 3.46Å; L238-T475 HydrophobicContact CD1-CG2 4.19Å
239	M	98.4	Very high	97	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59	-46.8	173.8	-178.1	-163.3	65.5	0	0	111.4	D235 N236 L237 I241 G243 Y402 S405 D406 Y409 K474	D235-M239 WeakPolarHBondContact O-CB 3.27Å; D235-M239 PolarHBondContact O-N 3.32Å; N236-M239 WeakPolarHBondContact O-CB 3.48Å; N236-M239 PolarHBondContact O-N 3.34Å; L237-M239 VanDerWaalsContact C-N 3.33Å; L237-M239 PolarHBondContact O-N 2.93Å; M239-I241 PolarHBondContact O-N 2.93Å; M239-G243 WeakPolarHBondContact O-CA 3.37Å; M239-G243 PolarHBondContact O-N 3.23Å; M239-Y402 HydrophobicContact CE-CD1 4.29Å; M239-Y402 HydrophobicContact CE-CD2 3.57Å; M239-Y402 HydrophobicContact CE-CE1 3.88Å; M239-Y402 HydrophobicContact CE-CE2 3.07Å; M239-Y402 HydrophobicContact CE-CG 4.14Å; M239-S405 WeakPolarHBondContact CE-OG 3.34Å; M239-D406 VanDerWaalsContact SD-CA 3.54Å; M239-D406 HydrophobicContact SD-CB 3.8Å; M239-Y409 HydrophobicContact CB-CD1 3.58Å; M239-Y409 HydrophobicContact CB-CE1 3.96Å; M239-Y409 HydrophobicContact CB-CG 4.09Å; M239-Y409 HydrophobicContact CG-CD1 3.65Å; M239-Y409 HydrophobicContact CG-CG 3.96Å; M239-K474 HydrophobicContact CB-CD 4.39Å; M239-K474 HydrophobicContact CG-CD 4.4Å; M239-K474 HydrophobicContact SD-CD 3.59Å; M239-K474 VanDerWaalsContact SD-CD 3.59Å
240	L	98.2	Very high	97.1	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-66.5	-37.4	-179.9	-68.1	162.4	0	0	0	112.2	Q85 A86 Y90 N236 L237 G244 Y402	Q85-L240 HydrophobicContact CB-CD1 3.61Å; A86-L240 HydrophobicContact CB-CD1 4.2Å; A86-L240 HydrophobicContact CB-CD2 3.9Å; Y90-L240 VanDerWaalsContact CD1-O 3.22Å; Y90-L240 WeakPolarHBondContact CD1-O 3.47Å; Y90-L240 HydrophobicContact CE1-CD2 4.16Å; Y90-L240 WeakPolarHBondContact CE1-O 3.5Å; Y90-L240 HydrophobicContact CE2-CD2 3.82Å; N236-L240 WeakPolarHBondContact O-CD1 3.34Å; N236-L240 VanDerWaalsContact O-CG 3.26Å; N236-L240 WeakPolarHBondContact O-CG 3.38Å; N236-L240 PolarHBondContact O-N 3.4Å; L237-L240 PolarHBondContact O-N 2.95Å; L240-G244 PolarHBondContact O-N 2.84Å; L240-Y402 HydrophobicContact CD1-CD2 4.32Å; L240-Y402 HydrophobicContact CD2-CD2 4.12Å; L240-Y402 HydrophobicContact CG-CD2 4.41Å
241	I	98.4	Very high	97.1	Very high	20 Å²	20	24 Å²	24	10%	0.103	12%	0.115	C	C	.	.	H	α-helix	trans	-69.5	-52.9	177.5	-64.9	167.8	0	0	0	111.2	G89 L92 S93 V96 L237 L238 M239	G89-I241 WeakPolarHBondContact O-CA 3.49Å; L92-I241 HydrophobicContact CB-CD1 4.41Å; L92-I241 HydrophobicContact CB-CG1 4.03Å; L92-I241 HydrophobicContact CB-CG2 4.38Å; L92-I241 HydrophobicContact CD1-CD1 3.89Å; L92-I241 HydrophobicContact CD1-CG1 4.27Å; S93-I241 WeakPolarHBondContact CA-O 3.48Å; S93-I241 WeakPolarHBondContact CB-O 3.22Å; V96-I241 HydrophobicContact CG2-CG2 4.28Å; L237-I241 HydrophobicContact CD1-CD1 4.08Å; L237-I241 HydrophobicContact CD1-CG1 4.37Å; L237-I241 HydrophobicContact CG-CD1 3.89Å; L237-I241 VanDerWaalsContact O-CG1 3.25Å; L237-I241 WeakPolarHBondContact O-CG1 3.47Å; L237-I241 PolarHBondContact O-N 3.02Å; L238-I241 PolarHBondContact O-N 3.3Å; M239-I241 PolarHBondContact O-N 2.93Å
242	F	98.6	Very high	96.9	Very high	56 Å²	56	17 Å²	17	25%	0.246	8%	0.084	C	C	.	.	H	α-helix	trans	-89.3	-29.3	-170.5	-65.5	-55.8	0	0	0	113.2	V96 L238 G244 I245 P246 Y409 F413	V96-F242 HydrophobicContact CG1-CE1 4.31Å; L238-F242 HydrophobicContact CB-CD2 4.31Å; L238-F242 HydrophobicContact CD2-CD2 4.35Å; L238-F242 HydrophobicContact CD2-CE2 3.78Å; L238-F242 WeakPolarHBondContact O-CB 3.37Å; L238-F242 WeakPolarHBondContact O-CD2 3.49Å; L238-F242 PolarHBondContact O-N 3.46Å; F242-G244 VanDerWaalsContact C-N 3.26Å; F242-G244 PolarHBondContact O-N 3.46Å; F242-I245 HydrophobicContact CD1-CD1 3.9Å; F242-I245 PolarHBondContact O-N 2.97Å; F242-P246 WeakPolarHBondContact O-CD 3.33Å; F242-Y409 HydrophobicContact CB-CD2 3.6Å; F242-Y409 HydrophobicContact CB-CE2 3.62Å; F242-Y409 AromaticContact CD2-CE2 4Å; F242-Y409 HydrophobicContact CD2-CE2 4Å; F242-Y409 HydrophobicContact CG-CE2 4.28Å; F242-F413 HydrophobicContact CB-CD1 3.81Å; F242-F413 HydrophobicContact CB-CD2 4.04Å; F242-F413 HydrophobicContact CB-CE1 3.71Å; F242-F413 HydrophobicContact CB-CE2 3.97Å; F242-F413 HydrophobicContact CB-CG 3.96Å; F242-F413 HydrophobicContact CB-CZ 3.78Å; F242-F413 AromaticContact CD1-CE1 3.87Å; F242-F413 HydrophobicContact CD1-CE1 3.87Å; F242-F413 AromaticContact CD1-CE2 3.76Å; F242-F413 HydrophobicContact CD1-CE2 3.76Å; F242-F413 AromaticContact CD1-CZ 3.28Å; F242-F413 HydrophobicContact CD1-CZ 3.28Å; F242-F413 HydrophobicContact CD2-CE1 4.36Å; F242-F413 AromaticContact CE1-CZ 3.97Å; F242-F413 HydrophobicContact CE1-CZ 3.97Å; F242-F413 HydrophobicContact CG-CD1 4.34Å; F242-F413 AromaticContact CG-CE1 3.73Å; F242-F413 HydrophobicContact CG-CE1 3.73Å; F242-F413 HydrophobicContact CG-CE2 4.19Å; F242-F413 AromaticContact CG-CZ 3.64Å; F242-F413 HydrophobicContact CG-CZ 3.64Å; F242-F413 WeakPolarHBondContact O-CD2 3.37Å
243	G	97.8	Very high	96.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-68.5	-24	169.4	0	0	0	0	0	112.9	M239 I245 V408	M239-G243 WeakPolarHBondContact O-CA 3.37Å; M239-G243 PolarHBondContact O-N 3.23Å; G243-I245 PolarHBondContact O-N 3.32Å; G243-V408 WeakPolarHBondContact O-CG1 3.26Å
244	G	96.4	Very high	96.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.2	171.5	0	0	0	0	0	114.8	L240 F242	L240-G244 PolarHBondContact O-N 2.84Å; F242-G244 VanDerWaalsContact C-N 3.26Å; F242-G244 PolarHBondContact O-N 3.46Å
245	I	97.7	Very high	96.5	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.046	C	C	.	.	S	Bend	trans	-84.2	-55.4	-171.6	-59.9	168.6	0	0	0	113.1	V96 F101 F242 G243 W247 F251 F413 L416	V96-I245 HydrophobicContact CB-CD1 3.9Å; V96-I245 HydrophobicContact CG1-CD1 3.53Å; F101-I245 HydrophobicContact CB-CG2 4.5Å; F101-I245 HydrophobicContact CD1-CG2 4.34Å; F101-I245 HydrophobicContact CD2-CG2 3.62Å; F101-I245 HydrophobicContact CE2-CD1 4.16Å; F101-I245 HydrophobicContact CE2-CG2 3.83Å; F101-I245 HydrophobicContact CG-CG2 3.9Å; F101-I245 HydrophobicContact CZ-CG2 4.29Å; F242-I245 HydrophobicContact CD1-CD1 3.9Å; F242-I245 PolarHBondContact O-N 2.97Å; G243-I245 PolarHBondContact O-N 3.32Å; I245-W247 PolarHBondContact O-N 3.49Å; I245-F251 WeakPolarHBondContact O-CE2 3.05Å; I245-F413 HydrophobicContact CB-CD2 4.48Å; I245-F413 HydrophobicContact CD1-CD2 4.42Å; I245-F413 HydrophobicContact CD1-CE2 3.83Å; I245-L416 HydrophobicContact CG2-CD2 4Å
246	P	97.3	Very high	96.1	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.006	5%	0.046	C	C	.	.	S	Bend	trans	-79	50	-178.5	34.8	-34.1	0	0	0	111.1	M113 F242 V408 L412 F413 L416	M113-P246 VanDerWaalsContact CE-O 3.26Å; M113-P246 WeakPolarHBondContact CE-O 3.32Å; M113-P246 HydrophobicContact SD-CB 4.4Å; F242-P246 WeakPolarHBondContact O-CD 3.33Å; P246-V408 HydrophobicContact CB-CG1 4.47Å; P246-V408 HydrophobicContact CG-CG1 3.55Å; P246-L412 HydrophobicContact CB-CB 3.87Å; P246-L412 HydrophobicContact CG-CB 3.85Å; P246-F413 HydrophobicContact CG-CB 4.03Å; P246-L416 HydrophobicContact CB-CB 4.27Å; P246-L416 HydrophobicContact CB-CD2 3.79Å
247	W	95.1	Very high	95.8	Very high	6 Å²	6	9.1 Å²	9.1	2%	0.023	5%	0.045	C	C	.	.			trans	-107.8	127.5	-177.3	-152	-50.6	0	0	0	110.3	W61 Y90 E137 W140 I245 V249 Y250 F251 C404	W61-W247 HydrophobicContact CH2-CE3 4.4Å; Y90-W247 AromaticContact CE1-CZ3 3.76Å; Y90-W247 HydrophobicContact CE1-CZ3 3.76Å; Y90-W247 AromaticContact CZ-CZ3 3.98Å; E137-W247 VanDerWaalsContact CD-NE1 3.28Å; E137-W247 PolarHBondContact OE1-NE1 2.93Å; E137-W247 PolarHBondContact OE2-NE1 2.93Å; W140-W247 HydrophobicContact CB-CH2 4.44Å; W140-W247 HydrophobicContact CB-CZ2 3.86Å; W140-W247 HydrophobicContact CD2-CH2 4.43Å; W140-W247 AromaticContact CD2-CZ2 3.66Å; W140-W247 HydrophobicContact CD2-CZ2 3.66Å; W140-W247 AromaticContact CE3-CE2 3.94Å; W140-W247 AromaticContact CE3-CZ2 3.55Å; W140-W247 HydrophobicContact CE3-CZ2 3.55Å; W140-W247 AromaticContact CE3-NE1 3.77Å; W140-W247 HydrophobicContact CG-CH2 4.36Å; W140-W247 AromaticContact CG-CZ2 3.83Å; W140-W247 HydrophobicContact CG-CZ2 3.83Å; W140-W247 HydrophobicContact CZ3-CZ2 4.35Å; I245-W247 PolarHBondContact O-N 3.49Å; W247-V249 HydrophobicContact CG-CG1 4.24Å; W247-V249 PolarHBondContact O-N 3.01Å; W247-Y250 PolarHBondContact O-N 2.82Å; W247-F251 WeakPolarHBondContact O-CD2 3.39Å; W247-F251 PolarHBondContact O-N 2.67Å; W247-F251 VanDerWaalsContact O-N 3.11Å; W247-C404 HydrophobicContact CH2-CB 3.94Å; W247-C404 WeakPolarHBondContact CH2-SG 3.29Å; W247-C404 HydrophobicContact CZ2-CB 4.29Å
248	Q	95.2	Very high	95.3	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.009	5%	0.052	C	C	.	.	H	α-helix	trans	-64.4	-39.8	-176.5	169.1	72.7	0.6	0	0	112.2	M113 Y250 F251 Q252 S349 S352 M353	M113-Q248 HydrophobicContact CB-CB 4.33Å; M113-Q248 HydrophobicContact CE-CB 4.1Å; Q248-Y250 VanDerWaalsContact C-N 3.28Å; Q248-Y250 PolarHBondContact O-N 3.26Å; Q248-F251 CarbonylContact O-C 3.57Å; Q248-F251 PolarHBondContact O-N 3.48Å; Q248-Q252 VanDerWaalsContact O-CB 3.3Å; Q248-Q252 WeakPolarHBondContact O-CB 3.35Å; Q248-Q252 PolarHBondContact O-N 2.94Å; Q248-S349 WeakPolarHBondContact CB-OG 3.29Å; Q248-S349 WeakPolarHBondContact CG-OG 3.45Å; Q248-S352 PolarHBondContact NE2-OG 3.42Å; Q248-M353 HydrophobicContact CB-CE 3.54Å; Q248-M353 HydrophobicContact CB-CG 4.09Å; Q248-M353 HydrophobicContact CB-SD 3.44Å; Q248-M353 WeakPolarHBondContact CB-SD 3.28Å; Q248-M353 HydrophobicContact CG-CE 3.9Å; Q248-M353 HydrophobicContact CG-CG 3.64Å; Q248-M353 HydrophobicContact CG-SD 3.73Å
249	V	94.1	Very high	94.9	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-57.4	-41.6	178.2	88.8	0	0	0	0	112.7	T60 W140 W247 Q252 R253 S349	T60-V249 HydrophobicContact CG2-CB 4.21Å; T60-V249 HydrophobicContact CG2-CG1 3.88Å; T60-V249 HydrophobicContact CG2-CG2 3.32Å; W140-V249 HydrophobicContact CH2-CB 4.42Å; W140-V249 HydrophobicContact CH2-CG1 3.83Å; W140-V249 HydrophobicContact CH2-CG2 4.21Å; W140-V249 HydrophobicContact CZ3-CB 3.88Å; W140-V249 HydrophobicContact CZ3-CG1 3.57Å; W140-V249 HydrophobicContact CZ3-CG2 3.91Å; W247-V249 HydrophobicContact CG-CG1 4.24Å; W247-V249 PolarHBondContact O-N 3.01Å; V249-Q252 PolarHBondContact O-N 2.64Å; V249-R253 PolarHBondContact O-N 3.46Å; V249-S349 PolarHBondContact N-OG 3.04Å
250	Y	96	Very high	94.6	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.008	7%	0.065	C	C	.	.	H	α-helix	trans	-63.7	-52.2	175.8	165.9	-112.6	0	0	0	110.3	M57 L94 G97 G98 W247 Q248 Q252 R253 V254 S267	M57-Y250 HydrophobicContact CE-CD2 3.31Å; M57-Y250 HydrophobicContact CE-CE2 3.52Å; M57-Y250 HydrophobicContact CE-CG 4.39Å; M57-Y250 HydrophobicContact SD-CD2 3.76Å; M57-Y250 HydrophobicContact SD-CE2 4.4Å; L94-Y250 HydrophobicContact CD2-CD2 3.4Å; L94-Y250 HydrophobicContact CD2-CE2 3.57Å; L94-Y250 HydrophobicContact CD2-CG 4.41Å; G97-Y250 WeakPolarHBondContact CA-OH 3.43Å; G97-Y250 PolarHBondContact O-OH 3.07Å; G97-Y250 VanDerWaalsContact O-OH 3.12Å; G98-Y250 PolarHBondContact N-OH 2.81Å; W247-Y250 PolarHBondContact O-N 2.82Å; Q248-Y250 VanDerWaalsContact C-N 3.28Å; Q248-Y250 PolarHBondContact O-N 3.26Å; Y250-Q252 VanDerWaalsContact C-N 3.25Å; Y250-Q252 PolarHBondContact O-N 3.21Å; Y250-R253 PolarHBondContact O-N 3.37Å; Y250-R253 VanDerWaalsContact O-N 3.16Å; Y250-V254 HydrophobicContact CD1-CG2 4.48Å; Y250-V254 HydrophobicContact CD2-CG2 4.18Å; Y250-V254 HydrophobicContact CE1-CG2 4Å; Y250-V254 HydrophobicContact CE2-CG2 3.64Å; Y250-V254 PolarHBondContact O-N 3.36Å; Y250-S267 WeakPolarHBondContact CE2-OG 3.33Å; Y250-S267 PolarHBondContact OH-OG 2.99Å
251	F	95.7	Very high	94.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-66.7	-26.9	179.6	-79.2	-63	0	0	0	113	F101 M105 M113 I245 W247 Q248 R253 V254 L255 L416	F101-F251 HydrophobicContact CB-CE1 4.12Å; F101-F251 HydrophobicContact CB-CZ 3.84Å; M105-F251 HydrophobicContact CB-CD1 3.96Å; M105-F251 HydrophobicContact CB-CE1 3.79Å; M105-F251 HydrophobicContact CE-CD1 3.98Å; M105-F251 HydrophobicContact CE-CD2 4.46Å; M105-F251 HydrophobicContact CE-CE1 4.12Å; M105-F251 HydrophobicContact CE-CE2 4.5Å; M105-F251 HydrophobicContact CE-CG 4.18Å; M105-F251 HydrophobicContact CE-CZ 4.35Å; M105-F251 HydrophobicContact CG-CD1 3.97Å; M105-F251 HydrophobicContact CG-CE1 3.42Å; M105-F251 VanDerWaalsContact CG-CE1 3.42Å; M105-F251 HydrophobicContact CG-CZ 3.97Å; M113-F251 HydrophobicContact CB-CB 3.92Å; M113-F251 HydrophobicContact CB-CD2 3.71Å; M113-F251 HydrophobicContact CB-CG 4.12Å; M113-F251 HydrophobicContact CG-CD2 3.35Å; M113-F251 HydrophobicContact CG-CE2 3.86Å; M113-F251 HydrophobicContact CG-CG 4.24Å; I245-F251 WeakPolarHBondContact O-CE2 3.05Å; W247-F251 WeakPolarHBondContact O-CD2 3.39Å; W247-F251 PolarHBondContact O-N 2.67Å; W247-F251 VanDerWaalsContact O-N 3.11Å; Q248-F251 CarbonylContact O-C 3.57Å; Q248-F251 PolarHBondContact O-N 3.48Å; F251-R253 VanDerWaalsContact C-N 3.29Å; F251-R253 PolarHBondContact O-N 3.42Å; F251-V254 HydrophobicContact CD1-CB 4.25Å; F251-V254 HydrophobicContact CD1-CG1 4.14Å; F251-V254 PolarHBondContact O-N 3.37Å; F251-L255 HydrophobicContact CB-CD1 4.27Å; F251-L255 WeakPolarHBondContact O-CB 3.22Å; F251-L255 WeakPolarHBondContact O-CG 3.44Å; F251-L255 PolarHBondContact O-N 2.81Å; F251-L416 HydrophobicContact CE2-CD2 4.09Å; F251-L416 HydrophobicContact CZ-CD2 4.22Å
252	Q	92.3	Very high	94.2	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-61.3	-42.3	175	-166.3	173.9	28.4	0	0	110.3	M42 L180 Q248 V249 Y250 S256	M42-Q252 WeakPolarHBondContact O-CG 3.16Å; M42-Q252 PolarHBondContact O-NE2 2.63Å; L180-Q252 HydrophobicContact CD1-CG 4.1Å; L180-Q252 HydrophobicContact CD2-CG 3.9Å; Q248-Q252 VanDerWaalsContact O-CB 3.3Å; Q248-Q252 WeakPolarHBondContact O-CB 3.35Å; Q248-Q252 PolarHBondContact O-N 2.94Å; V249-Q252 PolarHBondContact O-N 2.64Å; Y250-Q252 VanDerWaalsContact C-N 3.25Å; Y250-Q252 PolarHBondContact O-N 3.21Å; Q252-S256 WeakPolarHBondContact O-CB 3.44Å; Q252-S256 PolarHBondContact O-N 3.46Å; Q252-S256 PolarHBondContact O-OG 2.83Å
253	R	94	Very high	94	Very high	1 Å²	1	15.1 Å²	15.1	0%	0.004	8%	0.079	C	C	.	.	H	α-helix	trans	-69.9	-44.8	174.9	-59.7	-48.8	-168.7	-95.9	7.2	112.2	T56 M57 T60 D187 V249 Y250 F251 L255 S256 S257 S345	T56-R253 PolarHBondContact OG1-NE 2.92Å; T56-R253 PolarHBondContact OG1-NH2 3.41Å; M57-R253 HydrophobicContact CE-CB 3.47Å; M57-R253 VanDerWaalsContact CE-CB 3.47Å; M57-R253 HydrophobicContact CE-CG 4.36Å; M57-R253 HydrophobicContact SD-CB 3.82Å; M57-R253 HydrophobicContact SD-CG 4.05Å; T60-R253 PolarHBondContact OG1-NE 3.07Å; T60-R253 PolarHBondContact OG1-NH2 3.45Å; T60-R253 VanDerWaalsContact OG1-NH2 3.12Å; D187-R253 IonicContact OD2-CZ 3.11Å; D187-R253 IonicContact OD2-NH2 3.84Å; D187-R253 PolarHBondContact OD2-NH2 2.84Å; V249-R253 PolarHBondContact O-N 3.46Å; Y250-R253 PolarHBondContact O-N 3.37Å; Y250-R253 VanDerWaalsContact O-N 3.16Å; F251-R253 VanDerWaalsContact C-N 3.29Å; F251-R253 PolarHBondContact O-N 3.42Å; R253-L255 PolarHBondContact O-N 2.86Å; R253-S256 WeakPolarHBondContact CA-OG 3.09Å; R253-S256 PolarHBondContact O-N 3.35Å; R253-S256 PolarHBondContact O-OG 3.41Å; R253-S257 PolarHBondContact O-N 3.49Å; R253-S257 PolarHBondContact O-OG 2.93Å; R253-S345 PolarHBondContact NH2-OG 3.33Å
254	V	95.3	Very high	93.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-56.6	-47.5	173.8	165.7	0	0	0	0	111.7	M57 A102 R106 Y250 F251 S257 A263	M57-V254 HydrophobicContact CE-CG2 4Å; A102-V254 HydrophobicContact CB-CG1 3.98Å; A102-V254 HydrophobicContact CB-CG2 4.17Å; R106-V254 HydrophobicContact CB-CG1 4.33Å; Y250-V254 HydrophobicContact CD1-CG2 4.48Å; Y250-V254 HydrophobicContact CD2-CG2 4.18Å; Y250-V254 HydrophobicContact CE1-CG2 4Å; Y250-V254 HydrophobicContact CE2-CG2 3.64Å; Y250-V254 PolarHBondContact O-N 3.36Å; F251-V254 HydrophobicContact CD1-CB 4.25Å; F251-V254 HydrophobicContact CD1-CG1 4.14Å; F251-V254 PolarHBondContact O-N 3.37Å; V254-S257 VanDerWaalsContact O-CB 3.24Å; V254-S257 WeakPolarHBondContact O-CB 3.18Å; V254-S257 PolarHBondContact O-N 3.02Å; V254-S257 PolarHBondContact O-OG 3.47Å; V254-A263 HydrophobicContact CB-CB 4.48Å; V254-A263 HydrophobicContact CG1-CB 3.93Å
255	L	93.2	Very high	94	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-75.4	-27.6	-174.8	-64.7	174.3	0	0	0	112.2	L43 R46 M105 R106 Y110 F251 R253 S257	L43-L255 HydrophobicContact CD1-CB 4.5Å; L43-L255 HydrophobicContact CD2-CB 3.8Å; R46-L255 WeakPolarHBondContact CG-O 3.19Å; M105-L255 HydrophobicContact CB-CD2 4.18Å; M105-L255 WeakPolarHBondContact O-CD2 3.49Å; R106-L255 PolarHBondContact NE-O 3.18Å; Y110-L255 WeakPolarHBondContact O-CD2 3.28Å; F251-L255 HydrophobicContact CB-CD1 4.27Å; F251-L255 WeakPolarHBondContact O-CB 3.22Å; F251-L255 WeakPolarHBondContact O-CG 3.44Å; F251-L255 PolarHBondContact O-N 2.81Å; R253-L255 PolarHBondContact O-N 2.86Å; L255-S257 PolarHBondContact O-N 3Å
256	S	89.9	Confident	93.9	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.007	11%	0.11	C	C	.	.	H	α-helix	trans	-74.1	-10.1	173.1	72.3	0	0	0	0	114.6	L43 R46 I48 Q252 R253	L43-S256 VanDerWaalsContact O-CB 3.24Å; L43-S256 WeakPolarHBondContact O-CB 3.34Å; R46-S256 CarbonylContact C-O 3.56Å; R46-S256 VanDerWaalsContact CA-O 3.25Å; R46-S256 WeakPolarHBondContact CA-O 3.49Å; I48-S256 PolarHBondContact N-O 2.94Å; Q252-S256 WeakPolarHBondContact O-CB 3.44Å; Q252-S256 PolarHBondContact O-N 3.46Å; Q252-S256 PolarHBondContact O-OG 2.83Å; R253-S256 WeakPolarHBondContact CA-OG 3.09Å; R253-S256 PolarHBondContact O-N 3.35Å; R253-S256 PolarHBondContact O-OG 3.41Å
257	S	90.4	Very high	93.9	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.014	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-67.1	147.1	-179.7	-62.3	0	0	0	0	112.2	R106 R253 V254 L255 T259 L266	R106-S257 VanDerWaalsContact CZ-O 3.28Å; R106-S257 PolarHBondContact NE-O 3.41Å; R106-S257 PolarHBondContact NH2-O 2.93Å; R253-S257 PolarHBondContact O-N 3.49Å; R253-S257 PolarHBondContact O-OG 2.93Å; V254-S257 VanDerWaalsContact O-CB 3.24Å; V254-S257 WeakPolarHBondContact O-CB 3.18Å; V254-S257 PolarHBondContact O-N 3.02Å; V254-S257 PolarHBondContact O-OG 3.47Å; L255-S257 PolarHBondContact O-N 3Å; S257-T259 PolarHBondContact O-N 3.48Å; S257-L266 WeakPolarHBondContact OG-CD2 3.32Å
258	K	88.2	Confident	94	Very high	93 Å²	93	25 Å²	25	40%	0.404	12%	0.122	S	C	.	.	S	Bend	trans	-62.3	-40.6	176.8	-68.3	-179.4	-169.3	-146.5	0	113.2	R46 N47 I48 R106	R46-K258 WeakPolarHBondContact O-CA 2.93Å; N47-K258 WeakPolarHBondContact O-CE 3.34Å; N47-K258 WeakPolarHBondContact OD1-CE 3.4Å; N47-K258 PolarHBondContact OD1-NZ 3.22Å; I48-K258 WeakPolarHBondContact O-CG 3.09Å; I48-K258 PolarHBondContact O-N 3.48Å; R106-K258 PolarHBondContact NH2-O 2.72Å
259	T	91.3	Very high	94.2	Very high	64 Å²	64	27.8 Å²	27.8	39%	0.393	14%	0.139	S	C	.	.	S	Bend	trans	-133.9	156.7	-177.9	73.5	0	0	0	0	111.7	S257 N261 Q262 A263	S257-T259 PolarHBondContact O-N 3.48Å; T259-N261 VanDerWaalsContact C-N 3.26Å; T259-N261 PolarHBondContact O-N 3.12Å; T259-Q262 PolarHBondContact O-N 3.22Å; T259-Q262 WeakPolarHBondContact OG1-CG 3.39Å; T259-Q262 PolarHBondContact OG1-N 3.32Å; T259-A263 PolarHBondContact O-N 3.11Å
260	A	92	Very high	94.3	Very high	16 Å²	16	27.8 Å²	27.8	13%	0.132	14%	0.139	C	C	.	.	H	α-helix	trans	-65.3	-30.9	177.4	0	0	0	0	0	112.5	N103 R106 T107 A263 R264	N103-A260 WeakPolarHBondContact OD1-CB 3.4Å; R106-A260 HydrophobicContact CB-CB 4.11Å; R106-A260 HydrophobicContact CG-CB 4.03Å; T107-A260 WeakPolarHBondContact OG1-CB 3.42Å; A260-A263 WeakPolarHBondContact O-CB 3.1Å; A260-A263 PolarHBondContact O-N 2.79Å; A260-R264 PolarHBondContact O-N 3.01Å
261	N	93.6	Very high	94.4	Very high	82 Å²	82	28.2 Å²	28.2	44%	0.439	14%	0.143	S	C	.	.	H	α-helix	trans	-65.9	-44	173.1	-165.9	46.2	0	0	0	111.9	T259 A263 R264 I265	T259-N261 VanDerWaalsContact C-N 3.26Å; T259-N261 PolarHBondContact O-N 3.12Å; N261-A263 VanDerWaalsContact C-N 3.27Å; N261-A263 PolarHBondContact O-N 3.24Å; N261-R264 PolarHBondContact O-N 3.25Å; N261-R264 PolarHBondContact OD1-NH2 3.1Å; N261-I265 WeakPolarHBondContact O-CG1 3.14Å; N261-I265 PolarHBondContact O-N 2.9Å
262	Q	94.1	Very high	94.4	Very high	46 Å²	46	34 Å²	34	22%	0.215	17%	0.172	C	C	.	.	H	α-helix	trans	-61.4	-38.3	175	-73.7	179.4	10.1	0	0	111.6	L50 T259 R264 I265 L266	L50-Q262 HydrophobicContact CB-CG 4.15Å; L50-Q262 HydrophobicContact CD1-CB 4.12Å; L50-Q262 HydrophobicContact CD1-CG 4.21Å; T259-Q262 PolarHBondContact O-N 3.22Å; T259-Q262 WeakPolarHBondContact OG1-CG 3.39Å; T259-Q262 PolarHBondContact OG1-N 3.32Å; Q262-R264 VanDerWaalsContact C-N 3.27Å; Q262-R264 PolarHBondContact O-N 3.24Å; Q262-I265 PolarHBondContact O-N 3.12Å; Q262-L266 WeakPolarHBondContact O-CB 3.29Å; Q262-L266 VanDerWaalsContact O-CG 3.29Å; Q262-L266 WeakPolarHBondContact O-CG 3.42Å; Q262-L266 PolarHBondContact O-N 3.04Å
263	A	93.6	Very high	94.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-34.1	176.9	0	0	0	0	0	113	R106 V254 T259 A260 N261 L266 S267	R106-A263 HydrophobicContact CB-CB 4.2Å; R106-A263 HydrophobicContact CG-CB 4.27Å; V254-A263 HydrophobicContact CB-CB 4.48Å; V254-A263 HydrophobicContact CG1-CB 3.93Å; T259-A263 PolarHBondContact O-N 3.11Å; A260-A263 WeakPolarHBondContact O-CB 3.1Å; A260-A263 PolarHBondContact O-N 2.79Å; N261-A263 VanDerWaalsContact C-N 3.27Å; N261-A263 PolarHBondContact O-N 3.24Å; A263-L266 WeakPolarHBondContact O-CG 3.36Å; A263-S267 PolarHBondContact O-OG 2.91Å
264	R	96.8	Very high	94.7	Very high	89 Å²	89	35 Å²	35	34%	0.336	18%	0.182	S	C	.	.	H	α-helix	trans	-71.4	-51.7	171.7	-66.6	-170	-70.3	-169.5	2.5	111.9	G98 A102 N103 A260 N261 Q262 L266 S267 F268	G98-R264 WeakPolarHBondContact O-CG 3.3Å; A102-R264 HydrophobicContact CB-CG 4.27Å; N103-R264 HydrophobicContact CB-CG 3.97Å; A260-R264 PolarHBondContact O-N 3.01Å; N261-R264 PolarHBondContact O-N 3.25Å; N261-R264 PolarHBondContact OD1-NH2 3.1Å; Q262-R264 VanDerWaalsContact C-N 3.27Å; Q262-R264 PolarHBondContact O-N 3.24Å; R264-L266 VanDerWaalsContact C-N 3.3Å; R264-L266 PolarHBondContact O-N 2.86Å; R264-S267 WeakPolarHBondContact O-CB 3.31Å; R264-S267 PolarHBondContact O-N 3.47Å; R264-F268 HydrophobicContact CB-CE2 4.13Å; R264-F268 WeakPolarHBondContact O-CD2 3.29Å; R264-F268 PolarHBondContact O-N 3.35Å; R264-F268 VanDerWaalsContact O-N 3.15Å
265	I	97.4	Very high	94.6	Very high	60 Å²	60	40 Å²	40	31%	0.308	20%	0.204	S	C	.	.	H	α-helix	trans	-58.7	-45.1	-175.9	-65.4	167.8	0	0	0	110.3	L50 N261 Q262 S267 F268 V269	L50-I265 HydrophobicContact CD1-CB 4.03Å; L50-I265 HydrophobicContact CD1-CG2 3.89Å; L50-I265 HydrophobicContact CD2-CG2 4.2Å; N261-I265 WeakPolarHBondContact O-CG1 3.14Å; N261-I265 PolarHBondContact O-N 2.9Å; Q262-I265 PolarHBondContact O-N 3.12Å; I265-S267 PolarHBondContact O-N 3.35Å; I265-F268 PolarHBondContact O-N 3.04Å; I265-V269 HydrophobicContact CG2-CG2 4.07Å; I265-V269 WeakPolarHBondContact O-CG2 3.44Å; I265-V269 PolarHBondContact O-N 3.33Å
266	L	96.7	Very high	94.7	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-30.8	178.7	71	82.4	0	0	0	112.6	L50 I54 M57 S257 Q262 A263 R264 A270	L50-L266 HydrophobicContact CD1-CB 4.24Å; I54-L266 HydrophobicContact CG1-CB 3.84Å; M57-L266 HydrophobicContact CB-CD1 4.06Å; M57-L266 HydrophobicContact CE-CD1 3.22Å; M57-L266 HydrophobicContact CG-CD1 4.05Å; M57-L266 HydrophobicContact SD-CD1 4.49Å; S257-L266 WeakPolarHBondContact OG-CD2 3.32Å; Q262-L266 WeakPolarHBondContact O-CB 3.29Å; Q262-L266 VanDerWaalsContact O-CG 3.29Å; Q262-L266 WeakPolarHBondContact O-CG 3.42Å; Q262-L266 PolarHBondContact O-N 3.04Å; A263-L266 WeakPolarHBondContact O-CG 3.36Å; R264-L266 VanDerWaalsContact C-N 3.3Å; R264-L266 PolarHBondContact O-N 2.86Å; L266-A270 WeakPolarHBondContact O-CB 3.46Å; L266-A270 PolarHBondContact O-N 3.39Å
267	S	97.3	Very high	94.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-71.1	-42.4	179.3	-54.9	0	0	0	0	110.4	L94 Y250 A263 R264 I265 S271	L94-S267 WeakPolarHBondContact O-CB 3.28Å; Y250-S267 WeakPolarHBondContact CE2-OG 3.33Å; Y250-S267 PolarHBondContact OH-OG 2.99Å; A263-S267 PolarHBondContact O-OG 2.91Å; R264-S267 WeakPolarHBondContact O-CB 3.31Å; R264-S267 PolarHBondContact O-N 3.47Å; I265-S267 PolarHBondContact O-N 3.35Å; S267-S271 PolarHBondContact O-N 2.91Å
268	F	97.7	Very high	95.2	Very high	65 Å²	65	42.2 Å²	42.2	29%	0.285	22%	0.222	S	C	.	.	H	α-helix	trans	-66.1	-46.8	175.8	-64.1	-52	0	0	0	113.1	V95 L99 R264 I265 S271 I272	V95-F268 HydrophobicContact CG1-CD1 4.22Å; V95-F268 HydrophobicContact CG1-CE1 3.99Å; V95-F268 WeakPolarHBondContact O-CE1 3.5Å; L99-F268 HydrophobicContact CB-CZ 4.45Å; L99-F268 HydrophobicContact CD2-CE1 4.03Å; L99-F268 HydrophobicContact CD2-CZ 3.62Å; L99-F268 HydrophobicContact CG-CE1 3.76Å; L99-F268 HydrophobicContact CG-CZ 3.71Å; R264-F268 HydrophobicContact CB-CE2 4.13Å; R264-F268 WeakPolarHBondContact O-CD2 3.29Å; R264-F268 PolarHBondContact O-N 3.35Å; R264-F268 VanDerWaalsContact O-N 3.15Å; I265-F268 PolarHBondContact O-N 3.04Å; F268-S271 VanDerWaalsContact O-CB 3.29Å; F268-S271 WeakPolarHBondContact O-CB 3.36Å; F268-S271 PolarHBondContact O-N 2.77Å; F268-I272 PolarHBondContact O-N 3.46Å
269	V	97.8	Very high	95.6	Very high	60 Å²	60	41 Å²	41	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-70.1	-37	-179.1	-177	0	0	0	0	110.6	I54 I265 S271 I272 G273	I54-V269 HydrophobicContact CD1-CB 4.09Å; I54-V269 HydrophobicContact CD1-CG1 4.08Å; I54-V269 HydrophobicContact CD1-CG2 4.26Å; I54-V269 HydrophobicContact CG1-CB 4.08Å; I54-V269 HydrophobicContact CG1-CG1 4.28Å; I54-V269 HydrophobicContact CG2-CB 4.04Å; I54-V269 HydrophobicContact CG2-CG1 3.54Å; I265-V269 HydrophobicContact CG2-CG2 4.07Å; I265-V269 WeakPolarHBondContact O-CG2 3.44Å; I265-V269 PolarHBondContact O-N 3.33Å; V269-S271 VanDerWaalsContact C-N 3.3Å; V269-S271 PolarHBondContact O-N 2.65Å; V269-I272 PolarHBondContact O-N 2.77Å; V269-G273 PolarHBondContact O-N 2.97Å
270	A	97.1	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.2	-33.6	174.4	0	0	0	0	0	112.4	M57 T58 L94 L266 I272 G273 C274	M57-A270 HydrophobicContact CB-CB 3.76Å; M57-A270 HydrophobicContact CG-CB 3.38Å; T58-A270 WeakPolarHBondContact OG1-CA 3.25Å; L94-A270 HydrophobicContact CD1-CB 4.09Å; L266-A270 WeakPolarHBondContact O-CB 3.46Å; L266-A270 PolarHBondContact O-N 3.39Å; A270-I272 PolarHBondContact O-N 3.28Å; A270-G273 PolarHBondContact O-N 2.86Å; A270-C274 WeakPolarHBondContact O-CB 3.28Å; A270-C274 PolarHBondContact O-N 3.27Å; A270-C274 PolarHBondContact O-SG 3.17Å
271	S	97.5	Very high	96.2	Very high	12 Å²	12	37.2 Å²	37.2	8%	0.084	19%	0.194	C	C	.	.	H	α-helix	trans	-55.5	-49.9	171.7	-177.9	0	0	0	0	112.2	A91 V95 S267 F268 V269 G273 C274 F275	A91-S271 VanDerWaalsContact C-OG 3.31Å; A91-S271 WeakPolarHBondContact O-CB 3.29Å; A91-S271 PolarHBondContact O-OG 3.35Å; V95-S271 VanDerWaalsContact CG2-OG 3.25Å; V95-S271 WeakPolarHBondContact CG2-OG 3.4Å; S267-S271 PolarHBondContact O-N 2.91Å; F268-S271 VanDerWaalsContact O-CB 3.29Å; F268-S271 WeakPolarHBondContact O-CB 3.36Å; F268-S271 PolarHBondContact O-N 2.77Å; V269-S271 VanDerWaalsContact C-N 3.3Å; V269-S271 PolarHBondContact O-N 2.65Å; S271-G273 VanDerWaalsContact C-N 3.34Å; S271-G273 PolarHBondContact O-N 3.37Å; S271-C274 PolarHBondContact O-N 3.46Å; S271-F275 PolarHBondContact O-N 2.86Å
272	I	97.2	Very high	96.4	Very high	122 Å²	122	34.4 Å²	34.4	63%	0.626	18%	0.18	S	C	*	.	H	α-helix	trans	-62.6	-44.1	176.8	-60.1	169.8	0	0	0	110.1	F268 V269 A270 F275 A276	F268-I272 PolarHBondContact O-N 3.46Å; V269-I272 PolarHBondContact O-N 2.77Å; A270-I272 PolarHBondContact O-N 3.28Å; I272-F275 PolarHBondContact O-N 2.94Å; I272-A276 WeakPolarHBondContact O-CB 3.37Å; I272-A276 PolarHBondContact O-N 2.93Å
273	G	95.9	Very high	96.6	Very high	20 Å²	20	33.9 Å²	33.9	21%	0.206	18%	0.178	C	C	.	.	H	α-helix	trans	-59.4	-46.5	177.6	0	0	0	0	0	112.9	V269 A270 S271 A276 M277	V269-G273 PolarHBondContact O-N 2.97Å; A270-G273 PolarHBondContact O-N 2.86Å; S271-G273 VanDerWaalsContact C-N 3.34Å; S271-G273 PolarHBondContact O-N 3.37Å; G273-A276 PolarHBondContact O-N 3.3Å; G273-M277 VanDerWaalsContact O-CG 3.31Å; G273-M277 WeakPolarHBondContact O-CG 3.42Å; G273-M277 PolarHBondContact O-N 3.45Å
274	C	96.4	Very high	96.8	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.007	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-49.4	176.7	-70.2	0	0	0	0	110.5	Y66 A270 S271 A276 M277 A278	Y66-C274 WeakPolarHBondContact CE1-O 3.26Å; Y66-C274 HydrophobicContact CE2-CB 4.29Å; Y66-C274 PolarHBondContact OH-O 3.15Å; A270-C274 WeakPolarHBondContact O-CB 3.28Å; A270-C274 PolarHBondContact O-N 3.27Å; A270-C274 PolarHBondContact O-SG 3.17Å; S271-C274 PolarHBondContact O-N 3.46Å; C274-A276 VanDerWaalsContact C-N 3.31Å; C274-A276 PolarHBondContact O-N 3.15Å; C274-M277 CarbonylContact O-C 3.49Å; C274-M277 WeakPolarHBondContact O-CA 3.48Å; C274-M277 WeakPolarHBondContact O-CB 3.48Å; C274-M277 PolarHBondContact O-N 2.88Å; C274-A278 PolarHBondContact O-N 3.38Å
275	F	93.6	Very high	96.8	Very high	107 Å²	107	29.7 Å²	29.7	47%	0.469	16%	0.162	S	C	.	.	H	α-helix	trans	-57.3	-44.1	178.2	-170.6	-92.7	0	0	0	112	V88 A91 S271 I272 M277 A278	V88-F275 HydrophobicContact CG2-CD2 4.43Å; V88-F275 HydrophobicContact CG2-CE2 4.01Å; A91-F275 HydrophobicContact CB-CB 4.46Å; S271-F275 PolarHBondContact O-N 2.86Å; I272-F275 PolarHBondContact O-N 2.94Å; F275-M277 VanDerWaalsContact C-N 3.29Å; F275-M277 PolarHBondContact O-N 3.32Å; F275-A278 WeakPolarHBondContact O-CB 3.29Å; F275-A278 PolarHBondContact O-N 3.22Å; F275-A278 VanDerWaalsContact O-N 3.16Å
276	A	94.7	Very high	96.8	Very high	36 Å²	36	26.8 Å²	26.8	30%	0.298	15%	0.148	S	C	.	.	H	α-helix	trans	-62.2	-34.8	175.6	0	0	0	0	0	112.9	I272 G273 C274 A278 P280	I272-A276 WeakPolarHBondContact O-CB 3.37Å; I272-A276 PolarHBondContact O-N 2.93Å; G273-A276 PolarHBondContact O-N 3.3Å; C274-A276 VanDerWaalsContact C-N 3.31Å; C274-A276 PolarHBondContact O-N 3.15Å; A276-A278 VanDerWaalsContact C-N 3.34Å; A276-P280 VanDerWaalsContact O-CD 3.28Å; A276-P280 WeakPolarHBondContact O-CD 3.48Å
277	M	94.8	Very high	96.9	Very high	5 Å²	5	26.8 Å²	26.8	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-77.5	-14.8	176.8	-71.1	-57	-57.9	0	0	114	V62 L191 I194 F195 L198 G273 C274 F275 P280	V62-M277 HydrophobicContact CB-CB 4.45Å; V62-M277 HydrophobicContact CG1-CB 3.83Å; V62-M277 HydrophobicContact CG1-CE 3.93Å; V62-M277 HydrophobicContact CG1-CG 4.13Å; V62-M277 HydrophobicContact CG2-CB 3.64Å; V62-M277 HydrophobicContact CG2-CG 3.98Å; L191-M277 HydrophobicContact CD1-CG 4.19Å; L191-M277 HydrophobicContact CD1-SD 4.38Å; I194-M277 HydrophobicContact CG1-CE 4.45Å; I194-M277 HydrophobicContact CG2-CE 3.83Å; F195-M277 HydrophobicContact CB-CE 4.4Å; F195-M277 HydrophobicContact CB-SD 4Å; F195-M277 HydrophobicContact CD2-SD 3.59Å; F195-M277 VanDerWaalsContact CD2-SD 3.59Å; F195-M277 HydrophobicContact CG-SD 4.27Å; L198-M277 HydrophobicContact CD1-CE 4.45Å; G273-M277 VanDerWaalsContact O-CG 3.31Å; G273-M277 WeakPolarHBondContact O-CG 3.42Å; G273-M277 PolarHBondContact O-N 3.45Å; C274-M277 CarbonylContact O-C 3.49Å; C274-M277 WeakPolarHBondContact O-CA 3.48Å; C274-M277 WeakPolarHBondContact O-CB 3.48Å; C274-M277 PolarHBondContact O-N 2.88Å; F275-M277 VanDerWaalsContact C-N 3.29Å; F275-M277 PolarHBondContact O-N 3.32Å; M277-P280 WeakPolarHBondContact O-CD 3.05Å; M277-P280 WeakPolarHBondContact O-CG 3.33Å
278	A	96.1	Very high	96.8	Very high	8 Å²	8	26.8 Å²	26.8	7%	0.066	15%	0.148	C	C	.	.	H	α-helix	trans	-72.7	-39.3	174.4	0	0	0	0	0	111.7	Y66 P87 C274 F275 A276 S281 V282	Y66-A278 HydrophobicContact CE1-CB 3.66Å; P87-A278 HydrophobicContact CB-CB 3.66Å; P87-A278 HydrophobicContact CG-CB 4.37Å; C274-A278 PolarHBondContact O-N 3.38Å; F275-A278 WeakPolarHBondContact O-CB 3.29Å; F275-A278 PolarHBondContact O-N 3.22Å; F275-A278 VanDerWaalsContact O-N 3.16Å; A276-A278 VanDerWaalsContact C-N 3.34Å; A278-S281 WeakPolarHBondContact O-CB 3.48Å; A278-S281 PolarHBondContact O-N 3.07Å; A278-S281 VanDerWaalsContact O-N 3.08Å; A278-V282 PolarHBondContact O-N 2.8Å
279	I	97	Very high	96.7	Very high	68 Å²	68	23.8 Å²	23.8	35%	0.349	14%	0.135	S	C	.	.	H	α-helix	trans	-50.4	-53	-176.9	-60	171.5	0	0	0	112.5	W199 S281 V282 L283	W199-I279 HydrophobicContact CH2-CB 4.37Å; W199-I279 HydrophobicContact CH2-CG2 3.74Å; W199-I279 HydrophobicContact CZ2-CB 4.19Å; W199-I279 HydrophobicContact CZ2-CG2 4.06Å; I279-S281 VanDerWaalsContact C-N 3.26Å; I279-S281 PolarHBondContact O-N 2.87Å; I279-V282 PolarHBondContact O-N 2.73Å; I279-L283 HydrophobicContact CG2-CD1 3.87Å; I279-L283 HydrophobicContact CG2-CG 4.3Å; I279-L283 WeakPolarHBondContact O-CG 3.34Å; I279-L283 PolarHBondContact O-N 3.23Å
280	P	96.9	Very high	96.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-33.4	-178.4	24.1	-36	0	0	0	113.5	L198 I202 A276 M277 L283 I284	L198-P280 HydrophobicContact CB-CB 3.82Å; L198-P280 HydrophobicContact CB-CG 4.26Å; L198-P280 HydrophobicContact CD1-CB 4.46Å; L198-P280 HydrophobicContact CD1-CG 4.28Å; I202-P280 VanDerWaalsContact CD1-CA 3.46Å; I202-P280 HydrophobicContact CD1-CB 3.49Å; I202-P280 VanDerWaalsContact CD1-CB 3.49Å; A276-P280 VanDerWaalsContact O-CD 3.28Å; A276-P280 WeakPolarHBondContact O-CD 3.48Å; M277-P280 WeakPolarHBondContact O-CD 3.05Å; M277-P280 WeakPolarHBondContact O-CG 3.33Å; P280-L283 PolarHBondContact O-N 2.88Å; P280-I284 WeakPolarHBondContact O-CB 3.25Å; P280-I284 VanDerWaalsContact O-CG1 3.28Å; P280-I284 WeakPolarHBondContact O-CG1 3.31Å; P280-I284 PolarHBondContact O-N 3.41Å
281	S	97.4	Very high	96.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-70.5	-39.9	178	-52.5	0	0	0	0	111.8	I67 A71 A278 I279 I284 G285	I67-S281 WeakPolarHBondContact CA-OG 3.45Å; I67-S281 WeakPolarHBondContact O-CB 3.47Å; A71-S281 WeakPolarHBondContact CA-O 3.32Å; A71-S281 WeakPolarHBondContact CB-O 3.49Å; A278-S281 WeakPolarHBondContact O-CB 3.48Å; A278-S281 PolarHBondContact O-N 3.07Å; A278-S281 VanDerWaalsContact O-N 3.08Å; I279-S281 VanDerWaalsContact C-N 3.26Å; I279-S281 PolarHBondContact O-N 2.87Å; S281-I284 PolarHBondContact O-N 2.97Å; S281-G285 PolarHBondContact O-N 3.29Å
282	V	98	Very high	96.3	Very high	22 Å²	22	23.1 Å²	23.1	13%	0.133	13%	0.129	C	C	.	.	H	α-helix	trans	-59.8	-48	170.7	168.6	0	0	0	0	110.6	T70 T74 L81 A278 I279 I284 G285 A286	T70-V282 HydrophobicContact CG2-CG2 3.53Å; T74-V282 HydrophobicContact CG2-CG1 4.14Å; L81-V282 HydrophobicContact CD1-CB 4.4Å; L81-V282 HydrophobicContact CD1-CG1 3.63Å; L81-V282 HydrophobicContact CD1-CG2 3.81Å; L81-V282 HydrophobicContact CD2-CG1 4.35Å; A278-V282 PolarHBondContact O-N 2.8Å; I279-V282 PolarHBondContact O-N 2.73Å; V282-I284 VanDerWaalsContact C-N 3.31Å; V282-I284 PolarHBondContact O-N 2.99Å; V282-G285 PolarHBondContact O-N 2.86Å; V282-A286 WeakPolarHBondContact O-CB 3.46Å; V282-A286 PolarHBondContact O-N 3.4Å
283	L	98.3	Very high	96	Very high	35 Å²	35	17.3 Å²	17.3	18%	0.183	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-37.4	-179.8	-68.4	176	0	0	0	112.1	I202 M206 I214 I279 P280 A286 V287	I202-L283 HydrophobicContact CD1-CB 4.1Å; I202-L283 HydrophobicContact CD1-CD1 3.97Å; I202-L283 HydrophobicContact CG1-CB 4.31Å; I202-L283 HydrophobicContact CG2-CB 4.36Å; I202-L283 HydrophobicContact CG2-CD1 4.14Å; M206-L283 HydrophobicContact CE-CB 4.34Å; M206-L283 HydrophobicContact CE-CD1 4.46Å; M206-L283 HydrophobicContact CE-CD2 3.92Å; M206-L283 HydrophobicContact CE-CG 4.47Å; I214-L283 HydrophobicContact CD1-CD2 3.96Å; I279-L283 HydrophobicContact CG2-CD1 3.87Å; I279-L283 HydrophobicContact CG2-CG 4.3Å; I279-L283 WeakPolarHBondContact O-CG 3.34Å; I279-L283 PolarHBondContact O-N 3.23Å; P280-L283 PolarHBondContact O-N 2.88Å; L283-A286 PolarHBondContact O-N 3.17Å; L283-V287 WeakPolarHBondContact O-CB 3.41Å; L283-V287 VanDerWaalsContact O-CG2 3.28Å; L283-V287 WeakPolarHBondContact O-CG2 3.35Å; L283-V287 PolarHBondContact O-N 3.18Å
284	I	97.9	Very high	95.7	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-64.6	-44.5	173.2	-74.9	168.8	0	0	0	111.4	A71 L198 I202 P280 S281 V282 A286 V287 G288 L315 V318 L319	A71-I284 HydrophobicContact CB-CG2 4.31Å; L198-I284 HydrophobicContact CD2-CD1 3.74Å; I202-I284 HydrophobicContact CG1-CG1 4.37Å; P280-I284 WeakPolarHBondContact O-CB 3.25Å; P280-I284 VanDerWaalsContact O-CG1 3.28Å; P280-I284 WeakPolarHBondContact O-CG1 3.31Å; P280-I284 PolarHBondContact O-N 3.41Å; S281-I284 PolarHBondContact O-N 2.97Å; V282-I284 VanDerWaalsContact C-N 3.31Å; V282-I284 PolarHBondContact O-N 2.99Å; I284-A286 PolarHBondContact O-N 3.49Å; I284-V287 PolarHBondContact O-N 2.92Å; I284-G288 PolarHBondContact O-N 3.27Å; I284-L315 HydrophobicContact CD1-CD1 4.29Å; I284-L315 HydrophobicContact CG2-CB 4.17Å; I284-L315 HydrophobicContact CG2-CD1 4.22Å; I284-L315 HydrophobicContact CG2-CG 4.05Å; I284-V318 HydrophobicContact CG1-CG1 4.44Å; I284-V318 HydrophobicContact CG2-CB 3.91Å; I284-V318 HydrophobicContact CG2-CG1 3.94Å; I284-V318 HydrophobicContact CG2-CG2 4.15Å; I284-L319 HydrophobicContact CD1-CD2 4.39Å
285	G	97.6	Very high	95.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-43.4	175.3	0	0	0	0	0	112.4	A71 S281 V282 G288 A289	A71-G285 WeakPolarHBondContact O-CA 3.46Å; S281-G285 PolarHBondContact O-N 3.29Å; V282-G285 PolarHBondContact O-N 2.86Å; G285-G288 PolarHBondContact O-N 2.9Å; G285-A289 PolarHBondContact O-N 2.89Å
286	A	98	Very high	95.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-50	174.8	0	0	0	0	0	111.7	T74 I214 W221 V282 L283 I284 G288 A289 S290	T74-A286 HydrophobicContact CG2-CB 4.49Å; I214-A286 HydrophobicContact CB-CB 4.49Å; I214-A286 HydrophobicContact CG2-CB 4.25Å; W221-A286 HydrophobicContact CD2-CB 3.51Å; W221-A286 HydrophobicContact CE3-CB 3.71Å; W221-A286 HydrophobicContact CG-CB 3.93Å; W221-A286 HydrophobicContact CH2-CB 4.12Å; W221-A286 HydrophobicContact CZ2-CB 3.97Å; W221-A286 HydrophobicContact CZ3-CB 3.99Å; V282-A286 WeakPolarHBondContact O-CB 3.46Å; V282-A286 PolarHBondContact O-N 3.4Å; L283-A286 PolarHBondContact O-N 3.17Å; I284-A286 PolarHBondContact O-N 3.49Å; A286-G288 VanDerWaalsContact C-N 3.26Å; A286-G288 PolarHBondContact O-N 3.46Å; A286-A289 PolarHBondContact O-N 2.85Å; A286-S290 WeakPolarHBondContact O-CB 3.35Å; A286-S290 PolarHBondContact O-N 3.38Å; A286-S290 PolarHBondContact O-OG 3.43Å
287	V	97.8	Very high	94.8	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-56.3	-42.2	175.1	164.1	0	0	0	0	111.2	A205 M206 T211 I214 L283 I284 A289 S290 T291 V318 L322	A205-V287 HydrophobicContact CB-CG1 3.9Å; M206-V287 HydrophobicContact CE-CG2 4.36Å; M206-V287 HydrophobicContact CG-CG2 3.67Å; T211-V287 HydrophobicContact CG2-CG1 3.9Å; I214-V287 HydrophobicContact CG2-CG2 3.94Å; L283-V287 WeakPolarHBondContact O-CB 3.41Å; L283-V287 VanDerWaalsContact O-CG2 3.28Å; L283-V287 WeakPolarHBondContact O-CG2 3.35Å; L283-V287 PolarHBondContact O-N 3.18Å; I284-V287 PolarHBondContact O-N 2.92Å; V287-A289 VanDerWaalsContact C-N 3.31Å; V287-A289 PolarHBondContact O-N 3.41Å; V287-S290 CarbonylContact O-C 3.58Å; V287-S290 PolarHBondContact O-N 3.31Å; V287-T291 WeakPolarHBondContact O-CB 3.26Å; V287-T291 PolarHBondContact O-N 3.33Å; V287-T291 VanDerWaalsContact O-N 3.09Å; V287-T291 PolarHBondContact O-OG1 2.9Å; V287-V318 HydrophobicContact CG1-CG1 4.17Å; V287-L322 HydrophobicContact CG1-CD1 3.7Å
288	G	96.1	Very high	94.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.6	-42	174.9	0	0	0	0	0	113	Y75 I284 G285 A286 S290 T291 W293	Y75-G288 VanDerWaalsContact CD2-C 3.48Å; Y75-G288 WeakPolarHBondContact CE2-O 3.27Å; I284-G288 PolarHBondContact O-N 3.27Å; G285-G288 PolarHBondContact O-N 2.9Å; A286-G288 VanDerWaalsContact C-N 3.26Å; A286-G288 PolarHBondContact O-N 3.46Å; G288-S290 VanDerWaalsContact C-N 3.31Å; G288-T291 PolarHBondContact O-N 3.39Å; G288-W293 PolarHBondContact O-NE1 3.46Å
289	A	95.1	Very high	93.1	Very high	2 Å²	2	36.3 Å²	36.3	2%	0.017	19%	0.193	C	C	.	.	H	α-helix	trans	-74.9	-23.3	179.4	0	0	0	0	0	112.8	Y75 K220 W221 G285 A286 V287	Y75-A289 HydrophobicContact CD2-CB 3.87Å; Y75-A289 VanDerWaalsContact CD2-N 3.33Å; Y75-A289 HydrophobicContact CE2-CB 4.29Å; K220-A289 HydrophobicContact CB-CB 4.43Å; K220-A289 WeakPolarHBondContact CD-O 3.27Å; W221-A289 HydrophobicContact CB-CB 3.94Å; G285-A289 PolarHBondContact O-N 2.89Å; A286-A289 PolarHBondContact O-N 2.85Å; V287-A289 VanDerWaalsContact C-N 3.31Å; V287-A289 PolarHBondContact O-N 3.41Å
290	S	96	Very high	91.8	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.021	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-0.1	177.7	-50.9	0	0	0	0	113.9	V212 T217 A286 V287 G288	V212-S290 PolarHBondContact N-O 2.79Å; V212-S290 WeakPolarHBondContact O-CB 3.43Å; T217-S290 VanDerWaalsContact OG1-CB 3.28Å; T217-S290 WeakPolarHBondContact OG1-CB 3.4Å; T217-S290 PolarHBondContact OG1-OG 2.94Å; A286-S290 WeakPolarHBondContact O-CB 3.35Å; A286-S290 PolarHBondContact O-N 3.38Å; A286-S290 PolarHBondContact O-OG 3.43Å; V287-S290 CarbonylContact O-C 3.58Å; V287-S290 PolarHBondContact O-N 3.31Å; G288-S290 VanDerWaalsContact C-N 3.31Å
291	T	94.9	Very high	90	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.037	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-96.8	134.4	-177.3	-65.4	0	0	0	0	111.1	A210 T211 V287 G288 W293 T296 L322	A210-T291 HydrophobicContact CB-CG2 4.11Å; A210-T291 WeakPolarHBondContact O-CA 3.43Å; T211-T291 PolarHBondContact OG1-OG1 3.41Å; V287-T291 WeakPolarHBondContact O-CB 3.26Å; V287-T291 PolarHBondContact O-N 3.33Å; V287-T291 VanDerWaalsContact O-N 3.09Å; V287-T291 PolarHBondContact O-OG1 2.9Å; G288-T291 PolarHBondContact O-N 3.39Å; T291-W293 HydrophobicContact CG2-CD2 4.12Å; T291-W293 HydrophobicContact CG2-CG 4.3Å; T291-W293 HydrophobicContact CG2-CZ2 4.45Å; T291-W293 PolarHBondContact O-N 3.48Å; T291-T296 HydrophobicContact CG2-CG2 4.01Å; T291-L322 HydrophobicContact CG2-CD1 3.97Å; T291-L322 HydrophobicContact CG2-CD2 3.81Å; T291-L322 HydrophobicContact CG2-CG 4.5Å; T291-L322 VanDerWaalsContact OG1-CD1 3.27Å; T291-L322 WeakPolarHBondContact OG1-CD1 3.42Å
292	N	92.3	Very high	88.2	Confident	49 Å²	49	43.7 Å²	43.7	26%	0.262	24%	0.243	S	C	.	.			trans	-83.6	99.4	164.4	-174.7	-10	0	0	0	109.4	A210 T294 M295	A210-N292 PolarHBondContact O-N 3.32Å; N292-T294 PolarHBondContact O-N 3.4Å; N292-T294 PolarHBondContact OD1-N 3.23Å; N292-T294 PolarHBondContact OD1-OG1 3.16Å; N292-M295 HydrophobicContact CB-CG 4.34Å; N292-M295 HydrophobicContact CB-SD 4.25Å; N292-M295 PolarHBondContact O-N 3.15Å; N292-M295 VanDerWaalsContact O-N 3.11Å
293	W	91.7	Very high	86.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-66.1	-22	-172.9	-70.8	89	0	0	0	113.9	G288 T291 M295 T296 Y298 T300 E303 P305 I314 L317 V318 L322	G288-W293 PolarHBondContact O-NE1 3.46Å; T291-W293 HydrophobicContact CG2-CD2 4.12Å; T291-W293 HydrophobicContact CG2-CG 4.3Å; T291-W293 HydrophobicContact CG2-CZ2 4.45Å; T291-W293 PolarHBondContact O-N 3.48Å; W293-M295 PolarHBondContact O-N 2.89Å; W293-T296 HydrophobicContact CE3-CG2 4.31Å; W293-T296 WeakPolarHBondContact O-CB 3.26Å; W293-T296 PolarHBondContact O-N 3.04Å; W293-T296 PolarHBondContact O-OG1 3.4Å; W293-Y298 AromaticContact CE3-CD1 3.89Å; W293-Y298 HydrophobicContact CE3-CD1 3.89Å; W293-Y298 HydrophobicContact CE3-CG 4.28Å; W293-T300 HydrophobicContact CB-CG2 3.94Å; W293-E303 VanDerWaalsContact CD1-O 3.27Å; W293-E303 PolarHBondContact N-O 3.29Å; W293-P305 HydrophobicContact CD2-CG 4.3Å; W293-P305 HydrophobicContact CG-CG 4.3Å; W293-I314 HydrophobicContact CH2-CD1 4.23Å; W293-I314 HydrophobicContact CZ2-CD1 3.42Å; W293-I314 VanDerWaalsContact CZ2-CD1 3.42Å; W293-L317 HydrophobicContact CH2-CB 3.55Å; W293-L317 HydrophobicContact CZ3-CB 3.77Å; W293-V318 HydrophobicContact CH2-CG2 4.03Å; W293-V318 HydrophobicContact CZ2-CG2 4.1Å; W293-L322 HydrophobicContact CH2-CD1 4.45Å
294	T	88.6	Confident	85.1	Confident	68 Å²	68	49 Å²	49	42%	0.417	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-68	-20	175.6	66.7	0	0	0	0	113.5	N292 T296 E303	N292-T294 PolarHBondContact O-N 3.4Å; N292-T294 PolarHBondContact OD1-N 3.23Å; N292-T294 PolarHBondContact OD1-OG1 3.16Å; T294-T296 VanDerWaalsContact C-N 3.3Å; T294-E303 HydrophobicContact CG2-CG 4.29Å
295	M	89.7	Confident	83.6	Confident	122 Å²	122	48.9 Å²	48.9	60%	0.601	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-84.8	-5.4	174.2	-65.4	-177.7	64.6	0	0	112.8	A210 N292 W293	A210-M295 HydrophobicContact CB-CB 3.92Å; N292-M295 HydrophobicContact CB-CG 4.34Å; N292-M295 HydrophobicContact CB-SD 4.25Å; N292-M295 PolarHBondContact O-N 3.15Å; N292-M295 VanDerWaalsContact O-N 3.11Å; W293-M295 PolarHBondContact O-N 2.89Å
296	T	89.9	Confident	82.5	Confident	22 Å²	22	52.4 Å²	52.4	14%	0.135	29%	0.291	C	S	.	.	S	Bend	trans	-98.6	166.4	-177.6	76.9	0	0	0	0	111.3	A210 T291 W293 T294 Y298 L322	A210-T296 HydrophobicContact CB-CG2 3.76Å; T291-T296 HydrophobicContact CG2-CG2 4.01Å; W293-T296 HydrophobicContact CE3-CG2 4.31Å; W293-T296 WeakPolarHBondContact O-CB 3.26Å; W293-T296 PolarHBondContact O-N 3.04Å; W293-T296 PolarHBondContact O-OG1 3.4Å; T294-T296 VanDerWaalsContact C-N 3.3Å; T296-Y298 PolarHBondContact O-N 2.87Å; T296-Y298 VanDerWaalsContact OG1-CB 3.29Å; T296-Y298 WeakPolarHBondContact OG1-CB 3Å; T296-Y298 PolarHBondContact OG1-N 3.27Å; T296-Y298 VanDerWaalsContact OG1-N 3.16Å; T296-L322 HydrophobicContact CG2-CD2 3.79Å
297	N	86	Confident	81.8	Confident	151 Å²	151	55.4 Å²	55.4	81%	0.807	31%	0.309	S	S	*	.	S	Bend	trans	-74.7	4	171.7	-65.8	-41.9	0	0	0	113.4	N299 Y321	N297-N299 PolarHBondContact O-N 3.36Å; N297-Y321 HydrophobicContact CB-CD1 4.07Å; N297-Y321 HydrophobicContact CB-CE1 4.18Å
298	Y	84.6	Confident	81.1	Confident	41 Å²	41	58.6 Å²	58.6	16%	0.161	33%	0.33	C	S	.	.	S	Bend	trans	-75.9	104	169.4	-176.7	-121.2	0	0	0	107.6	W293 T296 T300 L317 Y321	W293-Y298 AromaticContact CE3-CD1 3.89Å; W293-Y298 HydrophobicContact CE3-CD1 3.89Å; W293-Y298 HydrophobicContact CE3-CG 4.28Å; T296-Y298 PolarHBondContact O-N 2.87Å; T296-Y298 VanDerWaalsContact OG1-CB 3.29Å; T296-Y298 WeakPolarHBondContact OG1-CB 3Å; T296-Y298 PolarHBondContact OG1-N 3.27Å; T296-Y298 VanDerWaalsContact OG1-N 3.16Å; Y298-T300 HydrophobicContact CD1-CG2 3.66Å; Y298-T300 HydrophobicContact CE1-CG2 4.04Å; Y298-T300 PolarHBondContact O-N 3.35Å; Y298-L317 HydrophobicContact CD2-CD2 3.58Å; Y298-L317 HydrophobicContact CE1-CD1 4.03Å; Y298-L317 HydrophobicContact CE2-CD1 4.18Å; Y298-L317 HydrophobicContact CE2-CD2 3.43Å; Y298-L317 VanDerWaalsContact CE2-CD2 3.43Å; Y298-L317 HydrophobicContact CE2-CG 4.47Å; Y298-L317 HydrophobicContact CG-CD2 4.23Å; Y298-Y321 HydrophobicContact CD2-CD2 4.27Å; Y298-Y321 AromaticContact CD2-CE2 3.61Å; Y298-Y321 HydrophobicContact CD2-CE2 3.61Å; Y298-Y321 AromaticContact CD2-CZ 4Å; Y298-Y321 HydrophobicContact CG-CD2 4.39Å; Y298-Y321 HydrophobicContact CG-CE2 4.15Å
299	N	70.3	Confident	80.5	Confident	172 Å²	172	62.7 Å²	62.7	92%	0.92	35%	0.349	S	S	*	.			trans	-68.3	71.1	-170.8	-166.5	28.2	0	0	0	112.4	N297	N297-N299 PolarHBondContact O-N 3.36Å
300	T	70	Confident	80.2	Confident	29 Å²	29	64.5 Å²	64.5	18%	0.178	36%	0.357	C	S	.	.			trans	-118	145.8	178.6	-174.9	0	0	0	0	111.1	W293 Y298 S302	W293-T300 HydrophobicContact CB-CG2 3.94Å; Y298-T300 HydrophobicContact CD1-CG2 3.66Å; Y298-T300 HydrophobicContact CE1-CG2 4.04Å; Y298-T300 PolarHBondContact O-N 3.35Å; T300-S302 VanDerWaalsContact C-N 3.34Å; T300-S302 VanDerWaalsContact CG2-O 3.25Å; T300-S302 WeakPolarHBondContact CG2-O 3.48Å; T300-S302 PolarHBondContact OG1-N 3.23Å
301	T	59.4	Low	80	Confident	151 Å²	151	65.2 Å²	65.2	93%	0.926	36%	0.361	S	S	*	.	S	Bend	trans	-88.6	-4.5	172.8	57.1	0	0	0	0	112.6
302	S	61	Low	79.9	Confident	43 Å²	43	65.2 Å²	65.2	30%	0.301	36%	0.36	S	S	.	.	S	Bend	trans	-106.4	139.4	-177.9	-179	0	0	0	0	111	T300 L304	T300-S302 VanDerWaalsContact C-N 3.34Å; T300-S302 VanDerWaalsContact CG2-O 3.25Å; T300-S302 WeakPolarHBondContact CG2-O 3.48Å; T300-S302 PolarHBondContact OG1-N 3.23Å; S302-L304 WeakPolarHBondContact CB-O 3.24Å; S302-L304 PolarHBondContact O-N 3.39Å; S302-L304 PolarHBondContact OG-N 3.21Å; S302-L304 PolarHBondContact OG-O 3.22Å
303	E	64.4	Low	80	Confident	117 Å²	117	64.5 Å²	64.5	55%	0.547	36%	0.356	S	S	.	.	S	Bend	trans	-62.3	-26.8	172.7	-69.2	-171.4	169.6	0	0	112.8	W293 T294	W293-E303 VanDerWaalsContact CD1-O 3.27Å; W293-E303 PolarHBondContact N-O 3.29Å; T294-E303 HydrophobicContact CG2-CG 4.29Å
304	L	65.9	Low	80.2	Confident	50 Å²	50	64.5 Å²	64.5	26%	0.262	36%	0.356	S	S	.	.	S	Bend	trans	-128.9	127.3	178	-73.8	98.4	0	0	0	110.5	Y75 S302 S306	Y75-L304 WeakPolarHBondContact OH-CB 3.29Å; S302-L304 WeakPolarHBondContact CB-O 3.24Å; S302-L304 PolarHBondContact O-N 3.39Å; S302-L304 PolarHBondContact OG-N 3.21Å; S302-L304 PolarHBondContact OG-O 3.22Å; L304-S306 PolarHBondContact O-N 2.88Å
305	P	66.9	Low	80.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.336	C	S	.	.			trans	-55	108.6	155.1	10	-15.5	0	0	0	108.3	Y75 W293 E310 I314	Y75-P305 HydrophobicContact CE1-CG 4.45Å; Y75-P305 WeakPolarHBondContact CE1-O 3.47Å; Y75-P305 VanDerWaalsContact CZ-O 3.27Å; Y75-P305 WeakPolarHBondContact OH-CD 3.3Å; Y75-P305 VanDerWaalsContact OH-CG 3.31Å; Y75-P305 WeakPolarHBondContact OH-CG 3.37Å; Y75-P305 PolarHBondContact OH-O 3.38Å; W293-P305 HydrophobicContact CD2-CG 4.3Å; W293-P305 HydrophobicContact CG-CG 4.3Å; P305-E310 WeakPolarHBondContact CA-OE2 3.46Å; P305-E310 HydrophobicContact CB-CB 3.45Å; P305-E310 VanDerWaalsContact CB-CB 3.45Å; P305-E310 HydrophobicContact CB-CG 4.23Å; P305-I314 HydrophobicContact CG-CD1 4.32Å
306	S	73.4	Confident	80.9	Confident	73 Å²	73	55.5 Å²	55.5	51%	0.51	31%	0.308	S	S	.	.			trans	-118.9	-11.5	-163.7	53.9	0	0	0	0	113	L304 E310 M311	L304-S306 PolarHBondContact O-N 2.88Å; S306-E310 PolarHBondContact N-OE2 2.93Å; S306-M311 WeakPolarHBondContact O-CE 3.21Å
307	T	84.3	Confident	81.1	Confident	63 Å²	63	54.5 Å²	54.5	39%	0.387	30%	0.302	S	S	.	.	S	Bend	trans	-81.8	149.2	173.3	65.1	0	0	0	0	110.2	E309 E310 M311	T307-E309 PolarHBondContact O-N 2.55Å; T307-E309 VanDerWaalsContact O-N 3.12Å; T307-E310 PolarHBondContact N-OE2 2.78Å; T307-E310 VanDerWaalsContact N-OE2 3.12Å; T307-E310 PolarHBondContact O-N 3.34Å; T307-E310 WeakPolarHBondContact OG1-CG 3.18Å; T307-E310 PolarHBondContact OG1-N 3.29Å; T307-E310 PolarHBondContact OG1-OE2 3.42Å; T307-M311 WeakPolarHBondContact O-CG 3.38Å; T307-M311 PolarHBondContact O-N 3.48Å
308	P	81.9	Confident	81.7	Confident	68 Å²	68	47.3 Å²	47.3	44%	0.442	26%	0.263	S	S	.	.	H	α-helix	trans	-52.8	-34.5	173.6	-27.8	35.2	0	0	0	112.8	E310 M311 K312 Q395	P308-E310 VanDerWaalsContact C-N 3.31Å; P308-E310 PolarHBondContact O-N 2.47Å; P308-M311 PolarHBondContact O-N 2.76Å; P308-K312 PolarHBondContact O-N 3.27Å; P308-Q395 HydrophobicContact CB-CB 4.46Å
309	E	84.1	Confident	82.2	Confident	86 Å²	86	45.4 Å²	45.4	40%	0.402	26%	0.256	S	S	.	.	H	α-helix	trans	-66.3	-29.9	177.6	-68.9	-170.6	172.7	0	0	113.9	T307 K312 Q395	T307-E309 PolarHBondContact O-N 2.55Å; T307-E309 VanDerWaalsContact O-N 3.12Å; E309-K312 WeakPolarHBondContact O-CG 3.41Å; E309-K312 PolarHBondContact O-NZ 3.23Å; E309-Q395 HydrophobicContact CG-CB 4.4Å; E309-Q395 HydrophobicContact CG-CG 3.92Å; E309-Q395 PolarHBondContact OE1-NE2 2.82Å
310	E	88.6	Confident	83.4	Confident	41 Å²	41	38.9 Å²	38.9	19%	0.192	22%	0.218	C	C	.	.	H	α-helix	trans	-87.3	-35.5	175.6	-65.1	168.6	124.7	0	0	111.9	P305 S306 T307 P308 K312 L313	P305-E310 WeakPolarHBondContact CA-OE2 3.46Å; P305-E310 HydrophobicContact CB-CB 3.45Å; P305-E310 VanDerWaalsContact CB-CB 3.45Å; P305-E310 HydrophobicContact CB-CG 4.23Å; S306-E310 PolarHBondContact N-OE2 2.93Å; T307-E310 PolarHBondContact N-OE2 2.78Å; T307-E310 VanDerWaalsContact N-OE2 3.12Å; T307-E310 PolarHBondContact O-N 3.34Å; T307-E310 WeakPolarHBondContact OG1-CG 3.18Å; T307-E310 PolarHBondContact OG1-N 3.29Å; T307-E310 PolarHBondContact OG1-OE2 3.42Å; P308-E310 VanDerWaalsContact C-N 3.31Å; P308-E310 PolarHBondContact O-N 2.47Å; E310-K312 VanDerWaalsContact C-N 3.26Å; E310-K312 PolarHBondContact O-N 2.99Å; E310-L313 WeakPolarHBondContact O-CA 3.4Å; E310-L313 VanDerWaalsContact O-CB 3.29Å; E310-L313 WeakPolarHBondContact O-CB 3.24Å; E310-L313 PolarHBondContact O-N 2.66Å
311	M	92.4	Very high	84.5	Confident	18 Å²	18	39.9 Å²	39.9	9%	0.089	22%	0.219	C	C	.	.	H	α-helix	trans	-55.5	-41.5	178.2	-71.9	177.1	174.6	0	0	111.8	E72 Y75 N76 S306 T307 P308 L313 I314	E72-M311 HydrophobicContact CG-CB 4.19Å; Y75-M311 HydrophobicContact CD1-CB 4.16Å; Y75-M311 HydrophobicContact CD1-CG 3.83Å; Y75-M311 HydrophobicContact CE1-CB 4.4Å; Y75-M311 HydrophobicContact CE1-CG 3.75Å; N76-M311 HydrophobicContact CB-SD 4.09Å; S306-M311 WeakPolarHBondContact O-CE 3.21Å; T307-M311 WeakPolarHBondContact O-CG 3.38Å; T307-M311 PolarHBondContact O-N 3.48Å; P308-M311 PolarHBondContact O-N 2.76Å; M311-L313 PolarHBondContact O-N 3.42Å; M311-L313 VanDerWaalsContact O-N 3.15Å; M311-I314 VanDerWaalsContact O-CB 3.3Å; M311-I314 WeakPolarHBondContact O-CB 3.24Å; M311-I314 VanDerWaalsContact O-CG2 3.24Å; M311-I314 WeakPolarHBondContact O-CG2 3.46Å; M311-I314 PolarHBondContact O-N 3.32Å
312	K	92.7	Very high	86.2	Confident	5 Å²	5	32.8 Å²	32.8	2%	0.022	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.1	177.4	82	-177.5	-172.6	-88	0	113.7	E72 A150 P308 E309 E310 Q395 I397	E72-K312 HydrophobicContact CG-CB 4.5Å; A150-K312 HydrophobicContact CB-CG 4.48Å; P308-K312 PolarHBondContact O-N 3.27Å; E309-K312 WeakPolarHBondContact O-CG 3.41Å; E309-K312 PolarHBondContact O-NZ 3.23Å; E310-K312 VanDerWaalsContact C-N 3.26Å; E310-K312 PolarHBondContact O-N 2.99Å; K312-Q395 WeakPolarHBondContact CD-O 3.42Å; K312-I397 HydrophobicContact CB-CD1 3.79Å; K312-I397 HydrophobicContact CB-CG1 4.15Å; K312-I397 HydrophobicContact CG-CD1 4.43Å
313	L	94.2	Very high	87.9	Confident	34 Å²	34	31.3 Å²	31.3	18%	0.178	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-5.4	177.6	-50.7	-178.6	0	0	0	112.3	A150 V154 E310 M311 L315 P316 L317	A150-L313 HydrophobicContact CB-CD2 3.56Å; V154-L313 HydrophobicContact CG2-CB 4.08Å; V154-L313 HydrophobicContact CG2-CD1 4.4Å; V154-L313 HydrophobicContact CG2-CD2 4.3Å; V154-L313 HydrophobicContact CG2-CG 4.49Å; E310-L313 WeakPolarHBondContact O-CA 3.4Å; E310-L313 VanDerWaalsContact O-CB 3.29Å; E310-L313 WeakPolarHBondContact O-CB 3.24Å; E310-L313 PolarHBondContact O-N 2.66Å; M311-L313 PolarHBondContact O-N 3.42Å; M311-L313 VanDerWaalsContact O-N 3.15Å; L313-L315 VanDerWaalsContact C-N 3.3Å; L313-L315 PolarHBondContact O-N 2.98Å; L313-P316 WeakPolarHBondContact O-CD 3.1Å; L313-P316 WeakPolarHBondContact O-CG 3.2Å; L313-L317 HydrophobicContact CB-CD1 3.91Å; L313-L317 HydrophobicContact CB-CG 3.98Å; L313-L317 WeakPolarHBondContact O-CB 3.03Å; L313-L317 WeakPolarHBondContact O-CG 3.49Å; L313-L317 PolarHBondContact O-N 3.47Å
314	I	96.2	Very high	89.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.9	-42.1	-168.3	-165	67	0	0	0	113.1	A71 Y75 W293 P305 M311 L317 V318	A71-I314 HydrophobicContact CB-CG2 3.94Å; Y75-I314 HydrophobicContact CD1-CB 4.28Å; Y75-I314 HydrophobicContact CD1-CD1 4.19Å; Y75-I314 HydrophobicContact CD1-CG1 4.16Å; Y75-I314 HydrophobicContact CD2-CD1 3.53Å; Y75-I314 HydrophobicContact CD2-CG1 3.65Å; Y75-I314 HydrophobicContact CE1-CD1 4.2Å; Y75-I314 HydrophobicContact CE2-CD1 3.55Å; Y75-I314 HydrophobicContact CE2-CG1 4.21Å; Y75-I314 HydrophobicContact CG-CB 4.15Å; Y75-I314 HydrophobicContact CG-CD1 3.88Å; Y75-I314 HydrophobicContact CG-CG1 3.63Å; Y75-I314 HydrophobicContact CG-CG2 4.38Å; W293-I314 HydrophobicContact CH2-CD1 4.23Å; W293-I314 HydrophobicContact CZ2-CD1 3.42Å; W293-I314 VanDerWaalsContact CZ2-CD1 3.42Å; P305-I314 HydrophobicContact CG-CD1 4.32Å; M311-I314 VanDerWaalsContact O-CB 3.3Å; M311-I314 WeakPolarHBondContact O-CB 3.24Å; M311-I314 VanDerWaalsContact O-CG2 3.24Å; M311-I314 WeakPolarHBondContact O-CG2 3.46Å; M311-I314 PolarHBondContact O-N 3.32Å; I314-L317 PolarHBondContact O-N 3.37Å; I314-V318 HydrophobicContact CG1-CG2 4.38Å; I314-V318 VanDerWaalsContact O-CG2 3.31Å; I314-V318 WeakPolarHBondContact O-CG2 3.45Å; I314-V318 PolarHBondContact O-N 3.04Å
315	L	97	Very high	90.6	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-55.5	179.7	-177.6	138.8	0	0	0	112.5	I67 A71 I284 L313 L317 V318 L319 V335	I67-L315 HydrophobicContact CG2-CD1 3.33Å; I67-L315 HydrophobicContact CG2-CD2 4.27Å; I67-L315 HydrophobicContact CG2-CG 4.45Å; A71-L315 HydrophobicContact CB-CB 3.86Å; A71-L315 HydrophobicContact CB-CD1 3.91Å; A71-L315 HydrophobicContact CB-CG 4.5Å; I284-L315 HydrophobicContact CD1-CD1 4.29Å; I284-L315 HydrophobicContact CG2-CB 4.17Å; I284-L315 HydrophobicContact CG2-CD1 4.22Å; I284-L315 HydrophobicContact CG2-CG 4.05Å; L313-L315 VanDerWaalsContact C-N 3.3Å; L313-L315 PolarHBondContact O-N 2.98Å; L315-L317 VanDerWaalsContact C-N 3.26Å; L315-L317 PolarHBondContact O-N 3.39Å; L315-V318 PolarHBondContact O-N 3.28Å; L315-L319 HydrophobicContact CD2-CD1 3.84Å; L315-L319 HydrophobicContact CG-CD1 4.47Å; L315-L319 WeakPolarHBondContact O-CG 3.3Å; L315-L319 PolarHBondContact O-N 3.29Å; L315-L319 VanDerWaalsContact O-N 3.11Å; L315-V335 HydrophobicContact CD2-CG1 3.94Å; L315-V335 HydrophobicContact CD2-CG2 4.13Å
316	P	95.9	Very high	91.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-28.2	176.2	22.9	-32.3	0	0	0	113.3	T151 V154 L313 R320 L332	T151-P316 HydrophobicContact CG2-CB 4.37Å; V154-P316 HydrophobicContact CB-CB 3.88Å; V154-P316 HydrophobicContact CB-CG 4.29Å; V154-P316 HydrophobicContact CG1-CB 4.03Å; V154-P316 HydrophobicContact CG2-CB 4.03Å; V154-P316 HydrophobicContact CG2-CG 3.92Å; L313-P316 WeakPolarHBondContact O-CD 3.1Å; L313-P316 WeakPolarHBondContact O-CG 3.2Å; P316-R320 VanDerWaalsContact O-CB 3.24Å; P316-R320 WeakPolarHBondContact O-CB 3.29Å; P316-R320 PolarHBondContact O-N 3.34Å; P316-L332 HydrophobicContact CB-CD2 3.75Å
317	L	95	Very high	92.8	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-46.7	173.9	-70.9	178	0	0	0	112	V154 W293 Y298 L313 I314 L315 L319 R320 Y321	V154-L317 HydrophobicContact CG1-CD2 4.11Å; V154-L317 HydrophobicContact CG2-CD2 3.93Å; V154-L317 HydrophobicContact CG2-CG 4.23Å; W293-L317 HydrophobicContact CH2-CB 3.55Å; W293-L317 HydrophobicContact CZ3-CB 3.77Å; Y298-L317 HydrophobicContact CD2-CD2 3.58Å; Y298-L317 HydrophobicContact CE1-CD1 4.03Å; Y298-L317 HydrophobicContact CE2-CD1 4.18Å; Y298-L317 HydrophobicContact CE2-CD2 3.43Å; Y298-L317 VanDerWaalsContact CE2-CD2 3.43Å; Y298-L317 HydrophobicContact CE2-CG 4.47Å; Y298-L317 HydrophobicContact CG-CD2 4.23Å; L313-L317 HydrophobicContact CB-CD1 3.91Å; L313-L317 HydrophobicContact CB-CG 3.98Å; L313-L317 WeakPolarHBondContact O-CB 3.03Å; L313-L317 WeakPolarHBondContact O-CG 3.49Å; L313-L317 PolarHBondContact O-N 3.47Å; I314-L317 PolarHBondContact O-N 3.37Å; L315-L317 VanDerWaalsContact C-N 3.26Å; L315-L317 PolarHBondContact O-N 3.39Å; L317-L319 VanDerWaalsContact C-N 3.34Å; L317-L319 PolarHBondContact O-N 3.04Å; L317-R320 PolarHBondContact O-N 3.37Å; L317-Y321 HydrophobicContact CB-CD2 4.45Å; L317-Y321 HydrophobicContact CD2-CD2 3.86Å; L317-Y321 HydrophobicContact CD2-CE2 3.6Å; L317-Y321 WeakPolarHBondContact O-CB 3.33Å; L317-Y321 WeakPolarHBondContact O-CD2 3.42Å; L317-Y321 PolarHBondContact O-N 2.85Å
318	V	96.6	Very high	93.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-45.9	176.6	166.8	0	0	0	0	110.5	A205 I284 V287 W293 I314 L315 R320 L322	A205-V318 HydrophobicContact CB-CG1 3.88Å; I284-V318 HydrophobicContact CG1-CG1 4.44Å; I284-V318 HydrophobicContact CG2-CB 3.91Å; I284-V318 HydrophobicContact CG2-CG1 3.94Å; I284-V318 HydrophobicContact CG2-CG2 4.15Å; V287-V318 HydrophobicContact CG1-CG1 4.17Å; W293-V318 HydrophobicContact CH2-CG2 4.03Å; W293-V318 HydrophobicContact CZ2-CG2 4.1Å; I314-V318 HydrophobicContact CG1-CG2 4.38Å; I314-V318 VanDerWaalsContact O-CG2 3.31Å; I314-V318 WeakPolarHBondContact O-CG2 3.45Å; I314-V318 PolarHBondContact O-N 3.04Å; L315-V318 PolarHBondContact O-N 3.28Å; V318-R320 PolarHBondContact O-N 3.21Å; V318-L322 HydrophobicContact CB-CD1 4.34Å; V318-L322 HydrophobicContact CG1-CD1 4.15Å; V318-L322 HydrophobicContact CG2-CD1 4.02Å; V318-L322 WeakPolarHBondContact O-CB 3.48Å; V318-L322 PolarHBondContact O-N 3.19Å
319	L	96.4	Very high	93.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63.1	-40.6	177.5	-66.2	177.1	0	0	0	112.2	L198 S201 I284 L315 L317 C323 S328 L332 V335	L198-L319 HydrophobicContact CD2-CD1 4.45Å; S201-L319 VanDerWaalsContact CB-CD2 3.49Å; S201-L319 VanDerWaalsContact OG-CD2 3.24Å; S201-L319 WeakPolarHBondContact OG-CD2 3.39Å; I284-L319 HydrophobicContact CD1-CD2 4.39Å; L315-L319 HydrophobicContact CD2-CD1 3.84Å; L315-L319 HydrophobicContact CG-CD1 4.47Å; L315-L319 WeakPolarHBondContact O-CG 3.3Å; L315-L319 PolarHBondContact O-N 3.29Å; L315-L319 VanDerWaalsContact O-N 3.11Å; L317-L319 VanDerWaalsContact C-N 3.34Å; L317-L319 PolarHBondContact O-N 3.04Å; L319-C323 WeakPolarHBondContact O-CB 3.37Å; L319-S328 WeakPolarHBondContact O-CB 3.44Å; L319-S328 PolarHBondContact O-OG 3.21Å; L319-L332 HydrophobicContact CB-CD2 3.8Å; L319-L332 HydrophobicContact CB-CG 3.97Å; L319-L332 HydrophobicContact CD1-CD2 3.95Å; L319-L332 HydrophobicContact CD1-CG 4.36Å; L319-V335 HydrophobicContact CD1-CG2 4.09Å
320	R	94.5	Very high	94.1	Very high	36 Å²	36	28.1 Å²	28.1	14%	0.136	14%	0.137	C	C	.	.	H	α-helix	trans	-73.4	-44.9	-178.1	179.7	173.8	169.7	169.5	0.4	113	M1 Y3 V154 P316 L317 V318 L332	M1-R320 PolarHBondContact O-NH2 3.12Å; Y3-R320 HydrophobicContact CD1-CG 4.42Å; Y3-R320 HydrophobicContact CG-CG 4.48Å; V154-R320 HydrophobicContact CG1-CB 3.99Å; V154-R320 HydrophobicContact CG1-CG 4.43Å; V154-R320 WeakPolarHBondContact O-CD 3.47Å; V154-R320 PolarHBondContact O-NH1 3.21Å; P316-R320 VanDerWaalsContact O-CB 3.24Å; P316-R320 WeakPolarHBondContact O-CB 3.29Å; P316-R320 PolarHBondContact O-N 3.34Å; L317-R320 PolarHBondContact O-N 3.37Å; V318-R320 PolarHBondContact O-N 3.21Å; R320-L332 HydrophobicContact CB-CD1 4.34Å
321	Y	93.8	Very high	94.3	Very high	50 Å²	50	26.1 Å²	26.1	20%	0.196	13%	0.128	C	C	.	.	H	α-helix	trans	-106.8	-21.2	-164.1	-67.3	-71.3	0	0	0	114.4	N297 Y298 L317	N297-Y321 HydrophobicContact CB-CD1 4.07Å; N297-Y321 HydrophobicContact CB-CE1 4.18Å; Y298-Y321 HydrophobicContact CD2-CD2 4.27Å; Y298-Y321 AromaticContact CD2-CE2 3.61Å; Y298-Y321 HydrophobicContact CD2-CE2 3.61Å; Y298-Y321 AromaticContact CD2-CZ 4Å; Y298-Y321 HydrophobicContact CG-CD2 4.39Å; Y298-Y321 HydrophobicContact CG-CE2 4.15Å; L317-Y321 HydrophobicContact CB-CD2 4.45Å; L317-Y321 HydrophobicContact CD2-CD2 3.86Å; L317-Y321 HydrophobicContact CD2-CE2 3.6Å; L317-Y321 WeakPolarHBondContact O-CB 3.33Å; L317-Y321 WeakPolarHBondContact O-CD2 3.42Å; L317-Y321 PolarHBondContact O-N 2.85Å
322	L	95.9	Very high	94.4	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-11.1	-179.4	-53.7	-178.8	0	0	0	113.2	A205 N208 A210 V287 T291 W293 T296 V318	A205-L322 HydrophobicContact CB-CB 4.15Å; N208-L322 HydrophobicContact CB-CB 4.31Å; N208-L322 HydrophobicContact CB-CD2 4.41Å; N208-L322 WeakPolarHBondContact ND2-CA 3.28Å; N208-L322 PolarHBondContact ND2-O 3.41Å; A210-L322 HydrophobicContact CB-CD2 4.41Å; V287-L322 HydrophobicContact CG1-CD1 3.7Å; T291-L322 HydrophobicContact CG2-CD1 3.97Å; T291-L322 HydrophobicContact CG2-CD2 3.81Å; T291-L322 HydrophobicContact CG2-CG 4.5Å; T291-L322 VanDerWaalsContact OG1-CD1 3.27Å; T291-L322 WeakPolarHBondContact OG1-CD1 3.42Å; W293-L322 HydrophobicContact CH2-CD1 4.45Å; T296-L322 HydrophobicContact CG2-CD2 3.79Å; V318-L322 HydrophobicContact CB-CD1 4.34Å; V318-L322 HydrophobicContact CG1-CD1 4.15Å; V318-L322 HydrophobicContact CG2-CD1 4.02Å; V318-L322 WeakPolarHBondContact O-CB 3.48Å; V318-L322 PolarHBondContact O-N 3.19Å
323	C	96.4	Very high	94.4	Very high	12 Å²	12	25 Å²	25	8%	0.081	12%	0.123	C	C	.	.	S	Bend	trans	-108.4	151	179.4	-58.3	0	0	0	0	112.3	L319 I327	L319-C323 WeakPolarHBondContact O-CB 3.37Å; C323-I327 HydrophobicContact CB-CB 3.93Å; C323-I327 HydrophobicContact CB-CG2 3.49Å; C323-I327 VanDerWaalsContact CB-CG2 3.49Å
324	P	94	Very high	94.3	Very high	38 Å²	38	23.4 Å²	23.4	25%	0.247	12%	0.115	C	C	.	.			trans	-56.7	154.2	170.1	-25.1	33	0	0	0	112.5	F204 W326 I327 S328	F204-P324 HydrophobicContact CB-CG 4.44Å; F204-P324 HydrophobicContact CD1-CG 3.56Å; F204-P324 HydrophobicContact CE1-CG 4.06Å; F204-P324 HydrophobicContact CG-CG 4.1Å; P324-W326 VanDerWaalsContact C-N 3.28Å; P324-W326 PolarHBondContact O-N 2.67Å; P324-W326 VanDerWaalsContact O-N 3.11Å; P324-I327 HydrophobicContact CG-CG1 4.45Å; P324-I327 WeakPolarHBondContact O-CB 3.4Å; P324-I327 PolarHBondContact O-N 3.08Å; P324-S328 PolarHBondContact O-N 3.45Å
325	P	92.1	Very high	94.1	Very high	88 Å²	88	23.4 Å²	23.4	57%	0.571	12%	0.115	S	C	*	.	H	α-helix	trans	-54.9	-36.8	-174.6	-29.2	35.2	0	0	0	115.5	Y3 F329	Y3-P325 WeakPolarHBondContact OH-CA 3.33Å; Y3-P325 PolarHBondContact OH-O 2.84Å; P325-F329 WeakPolarHBondContact O-CB 3.32Å; P325-F329 PolarHBondContact O-N 3.02Å
326	W	92	Very high	93.9	Very high	153 Å²	153	23.4 Å²	23.4	58%	0.58	12%	0.115	S	C	*	.	H	α-helix	trans	-73.6	-31.2	179.7	62.5	-90.6	0	0	0	112.8	F204 P324 V330	F204-W326 HydrophobicContact CE1-CZ2 4.09Å; F204-W326 AromaticContact CE2-CH2 3.89Å; F204-W326 HydrophobicContact CE2-CH2 3.89Å; F204-W326 HydrophobicContact CE2-CZ2 4.03Å; F204-W326 AromaticContact CZ-CH2 3.76Å; F204-W326 HydrophobicContact CZ-CH2 3.76Å; F204-W326 AromaticContact CZ-CZ2 3.53Å; F204-W326 HydrophobicContact CZ-CZ2 3.53Å; P324-W326 VanDerWaalsContact C-N 3.28Å; P324-W326 PolarHBondContact O-N 2.67Å; P324-W326 VanDerWaalsContact O-N 3.11Å; W326-V330 WeakPolarHBondContact O-CG2 3.15Å; W326-V330 PolarHBondContact O-N 3.36Å
327	I	94.3	Very high	93.5	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.015	12%	0.115	C	C	.	.	H	α-helix	trans	-71.1	-48.6	171.9	-68.2	-66.7	0	0	0	110.1	I200 S201 F204 C323 P324 F329 V330 G331	I200-I327 HydrophobicContact CB-CD1 4.22Å; I200-I327 HydrophobicContact CG2-CD1 3.23Å; S201-I327 WeakPolarHBondContact OG-CG2 3.24Å; F204-I327 HydrophobicContact CD2-CD1 3.82Å; F204-I327 HydrophobicContact CD2-CG1 3.71Å; F204-I327 HydrophobicContact CE2-CD1 3.69Å; F204-I327 HydrophobicContact CE2-CG1 3.86Å; F204-I327 HydrophobicContact CG-CG1 4.21Å; F204-I327 HydrophobicContact CZ-CG1 4.45Å; C323-I327 HydrophobicContact CB-CB 3.93Å; C323-I327 HydrophobicContact CB-CG2 3.49Å; C323-I327 VanDerWaalsContact CB-CG2 3.49Å; P324-I327 HydrophobicContact CG-CG1 4.45Å; P324-I327 WeakPolarHBondContact O-CB 3.4Å; P324-I327 PolarHBondContact O-N 3.08Å; I327-F329 VanDerWaalsContact C-N 3.25Å; I327-F329 PolarHBondContact O-N 2.74Å; I327-V330 PolarHBondContact O-N 2.83Å; I327-V330 VanDerWaalsContact O-N 3.1Å; I327-G331 PolarHBondContact O-N 2.8Å
328	S	94.1	Very high	93.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-54.6	-43.7	176.2	177.5	0	0	0	0	111.5	Y3 L319 P324 G331 L332	Y3-S328 VanDerWaalsContact CE1-OG 3.22Å; Y3-S328 WeakPolarHBondContact CE1-OG 3.23Å; Y3-S328 WeakPolarHBondContact OH-CB 3.3Å; Y3-S328 PolarHBondContact OH-OG 3.03Å; L319-S328 WeakPolarHBondContact O-CB 3.44Å; L319-S328 PolarHBondContact O-OG 3.21Å; P324-S328 PolarHBondContact O-N 3.45Å; S328-G331 PolarHBondContact O-N 3.24Å; S328-L332 VanDerWaalsContact O-CB 3.32Å; S328-L332 WeakPolarHBondContact O-CB 3.44Å; S328-L332 WeakPolarHBondContact O-CG 3.43Å; S328-L332 PolarHBondContact O-N 3.46Å; S328-L332 WeakPolarHBondContact OG-CD1 3.24Å
329	F	91.9	Very high	93	Very high	56 Å²	56	23.6 Å²	23.6	25%	0.246	12%	0.116	C	C	.	.	H	α-helix	trans	-53.9	-55.6	172.7	-179.9	-79.8	0	0	0	111.7	P5 I8 A9 F13 P325 I327 G333	P5-F329 HydrophobicContact CB-CD2 4.4Å; P5-F329 WeakPolarHBondContact O-CD2 3.37Å; P5-F329 WeakPolarHBondContact O-CE2 3.28Å; I8-F329 HydrophobicContact CB-CE2 4.12Å; I8-F329 HydrophobicContact CG2-CE2 3.89Å; I8-F329 HydrophobicContact CG2-CZ 4.4Å; A9-F329 VanDerWaalsContact CA-CE2 3.46Å; A9-F329 VanDerWaalsContact CA-CZ 3.49Å; A9-F329 HydrophobicContact CB-CB 4.43Å; A9-F329 HydrophobicContact CB-CD1 3.93Å; A9-F329 HydrophobicContact CB-CD2 3.57Å; A9-F329 HydrophobicContact CB-CE1 3.97Å; A9-F329 HydrophobicContact CB-CE2 3.61Å; A9-F329 HydrophobicContact CB-CG 3.71Å; A9-F329 HydrophobicContact CB-CZ 3.8Å; A9-F329 WeakPolarHBondContact CB-O 3.42Å; A9-F329 VanDerWaalsContact N-CE2 3.33Å; F13-F329 HydrophobicContact CE2-CE1 4.36Å; P325-F329 WeakPolarHBondContact O-CB 3.32Å; P325-F329 PolarHBondContact O-N 3.02Å; I327-F329 VanDerWaalsContact C-N 3.25Å; I327-F329 PolarHBondContact O-N 2.74Å; F329-G333 PolarHBondContact O-N 2.92Å; F329-G333 VanDerWaalsContact O-N 3.11Å
330	V	91.9	Very high	92.5	Very high	51 Å²	51	23.9 Å²	23.9	31%	0.309	12%	0.118	S	C	.	.	H	α-helix	trans	-66	-45.4	-177.8	177.1	0	0	0	0	111	F13 W326 I327 A334	F13-V330 HydrophobicContact CZ-CG1 4.5Å; W326-V330 WeakPolarHBondContact O-CG2 3.15Å; W326-V330 PolarHBondContact O-N 3.36Å; I327-V330 PolarHBondContact O-N 2.83Å; I327-V330 VanDerWaalsContact O-N 3.1Å; V330-A334 WeakPolarHBondContact O-CB 3.42Å; V330-A334 PolarHBondContact O-N 3.29Å
331	G	93.7	Very high	92.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.5	-55	-178.3	0	0	0	0	0	112.5	I327 S328 A334 V335	I327-G331 PolarHBondContact O-N 2.8Å; S328-G331 PolarHBondContact O-N 3.24Å; G331-A334 PolarHBondContact O-N 3.47Å; G331-V335 WeakPolarHBondContact O-CB 3.36Å; G331-V335 WeakPolarHBondContact O-CG2 3.34Å; G331-V335 PolarHBondContact O-N 3.49Å
332	L	93.7	Very high	92	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67.7	-39	-177.6	-65.6	168.3	0	0	0	112.3	Y3 T151 I155 P316 L319 R320 S328 S336	Y3-L332 HydrophobicContact CD1-CD1 4.18Å; Y3-L332 HydrophobicContact CE1-CD1 4.06Å; T151-L332 HydrophobicContact CG2-CD2 4.03Å; I155-L332 HydrophobicContact CD1-CB 3.76Å; I155-L332 HydrophobicContact CD1-CD1 4Å; I155-L332 HydrophobicContact CD1-CD2 4.5Å; I155-L332 HydrophobicContact CD1-CG 4.31Å; I155-L332 HydrophobicContact CG1-CD1 3.86Å; P316-L332 HydrophobicContact CB-CD2 3.75Å; L319-L332 HydrophobicContact CB-CD2 3.8Å; L319-L332 HydrophobicContact CB-CG 3.97Å; L319-L332 HydrophobicContact CD1-CD2 3.95Å; L319-L332 HydrophobicContact CD1-CG 4.36Å; R320-L332 HydrophobicContact CB-CD1 4.34Å; S328-L332 VanDerWaalsContact O-CB 3.32Å; S328-L332 WeakPolarHBondContact O-CB 3.44Å; S328-L332 WeakPolarHBondContact O-CG 3.43Å; S328-L332 PolarHBondContact O-N 3.46Å; S328-L332 WeakPolarHBondContact OG-CD1 3.24Å; L332-S336 WeakPolarHBondContact O-CB 3.47Å; L332-S336 PolarHBondContact O-N 2.76Å; L332-S336 PolarHBondContact O-OG 3.43Å
333	G	92.3	Very high	91.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-48.4	175.3	0	0	0	0	0	112	F329 S336 A337	F329-G333 PolarHBondContact O-N 2.92Å; F329-G333 VanDerWaalsContact O-N 3.11Å; G333-S336 PolarHBondContact O-N 3.16Å; G333-A337 WeakPolarHBondContact O-CB 3.32Å; G333-A337 PolarHBondContact O-N 2.96Å
334	A	92.2	Very high	91.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.1	-37.4	179.2	0	0	0	0	0	113.3	F13 C193 V330 G331 A337 A338	F13-A334 HydrophobicContact CE1-CB 4.09Å; F13-A334 HydrophobicContact CZ-CB 4.25Å; C193-A334 HydrophobicContact CB-CB 3.95Å; C193-A334 WeakPolarHBondContact O-CB 3.29Å; V330-A334 WeakPolarHBondContact O-CB 3.42Å; V330-A334 PolarHBondContact O-N 3.29Å; G331-A334 PolarHBondContact O-N 3.47Å; A334-A337 WeakPolarHBondContact O-CB 3.26Å; A334-A337 PolarHBondContact O-N 2.86Å; A334-A338 WeakPolarHBondContact O-CB 3.49Å; A334-A338 PolarHBondContact O-N 3.25Å
335	V	93.1	Very high	91.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.8	-52.3	173.2	169.5	0	0	0	0	110.3	I194 L198 L315 L319 G331 A337 A338 V339	I194-V335 HydrophobicContact CD1-CB 4.49Å; I194-V335 HydrophobicContact CD1-CG2 4.04Å; I194-V335 HydrophobicContact CG1-CG2 4.29Å; L198-V335 HydrophobicContact CD2-CG2 3.62Å; L198-V335 HydrophobicContact CG-CG2 4.35Å; L315-V335 HydrophobicContact CD2-CG1 3.94Å; L315-V335 HydrophobicContact CD2-CG2 4.13Å; L319-V335 HydrophobicContact CD1-CG2 4.09Å; G331-V335 WeakPolarHBondContact O-CB 3.36Å; G331-V335 WeakPolarHBondContact O-CG2 3.34Å; G331-V335 PolarHBondContact O-N 3.49Å; V335-A337 PolarHBondContact O-N 3.49Å; V335-A338 PolarHBondContact O-N 3.28Å; V335-V339 HydrophobicContact CG1-CG2 3.95Å; V335-V339 VanDerWaalsContact O-CB 3.23Å; V335-V339 WeakPolarHBondContact O-CB 3.47Å; V335-V339 WeakPolarHBondContact O-CG2 3.18Å; V335-V339 PolarHBondContact O-N 3.31Å
336	S	92.2	Very high	91.3	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.007	6%	0.059	C	C	.	.	H	α-helix	trans	-57.7	-39.6	179.3	-56	0	0	0	0	111.9	L148 T151 L332 G333 M340	L148-S336 WeakPolarHBondContact CD2-O 3.18Å; T151-S336 VanDerWaalsContact CG2-OG 3.26Å; T151-S336 WeakPolarHBondContact CG2-OG 3.46Å; L332-S336 WeakPolarHBondContact O-CB 3.47Å; L332-S336 PolarHBondContact O-N 2.76Å; L332-S336 PolarHBondContact O-OG 3.43Å; G333-S336 PolarHBondContact O-N 3.16Å; S336-M340 WeakPolarHBondContact O-CB 3.27Å; S336-M340 PolarHBondContact O-N 3.44Å
337	A	88.5	Confident	91.3	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-62.7	-55.7	175.7	0	0	0	0	0	113.4	F13 I17 Q190 G333 A334 V335 M340	F13-A337 HydrophobicContact CB-CB 4.08Å; F13-A337 HydrophobicContact CD1-CB 4.22Å; F13-A337 HydrophobicContact CG-CB 4.49Å; I17-A337 HydrophobicContact CD1-CB 3.19Å; I17-A337 HydrophobicContact CG1-CB 4.49Å; Q190-A337 HydrophobicContact CG-CB 4.29Å; Q190-A337 PolarHBondContact NE2-O 3.48Å; G333-A337 WeakPolarHBondContact O-CB 3.32Å; G333-A337 PolarHBondContact O-N 2.96Å; A334-A337 WeakPolarHBondContact O-CB 3.26Å; A334-A337 PolarHBondContact O-N 2.86Å; V335-A337 PolarHBondContact O-N 3.49Å; A337-M340 WeakPolarHBondContact O-CB 3.22Å; A337-M340 PolarHBondContact O-N 2.79Å
338	A	89.3	Confident	91.1	Very high	5 Å²	5	6 Å²	6	4%	0.041	3%	0.032	C	C	.	.	H	α-helix	trans	-71.2	-39.8	-174.9	0	0	0	0	0	112.1	Q190 I194 A334 V335 M340 S341	Q190-A338 HydrophobicContact CB-CB 4.05Å; I194-A338 HydrophobicContact CB-CB 3.85Å; I194-A338 HydrophobicContact CD1-CB 3.62Å; I194-A338 HydrophobicContact CG1-CB 4.37Å; I194-A338 HydrophobicContact CG2-CB 3.87Å; A334-A338 WeakPolarHBondContact O-CB 3.49Å; A334-A338 PolarHBondContact O-N 3.25Å; V335-A338 PolarHBondContact O-N 3.28Å; A338-M340 PolarHBondContact O-N 2.96Å; A338-S341 WeakPolarHBondContact O-CB 3.5Å; A338-S341 PolarHBondContact O-N 3.31Å
339	V	90.1	Very high	91	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-59.2	-37.1	176.7	174	0	0	0	0	110.9	I144 A147 L148 V335 S341 S342 A343	I144-V339 HydrophobicContact CG2-CG1 3.69Å; I144-V339 WeakPolarHBondContact CG2-O 3.46Å; A147-V339 HydrophobicContact CB-CG1 4.16Å; L148-V339 HydrophobicContact CD1-CG1 4.35Å; L148-V339 HydrophobicContact CD2-CB 3.77Å; L148-V339 HydrophobicContact CD2-CG1 3.58Å; L148-V339 HydrophobicContact CG-CB 4.31Å; L148-V339 HydrophobicContact CG-CG1 3.55Å; V335-V339 HydrophobicContact CG1-CG2 3.95Å; V335-V339 VanDerWaalsContact O-CB 3.23Å; V335-V339 WeakPolarHBondContact O-CB 3.47Å; V335-V339 WeakPolarHBondContact O-CG2 3.18Å; V335-V339 PolarHBondContact O-N 3.31Å; V339-S341 VanDerWaalsContact C-N 3.31Å; V339-S341 PolarHBondContact O-N 3.33Å; V339-S342 PolarHBondContact O-N 2.9Å; V339-A343 PolarHBondContact O-N 3.39Å
340	M	87.5	Confident	91.1	Very high	7 Å²	7	3.4 Å²	3.4	3%	0.034	2%	0.021	C	C	.	.	H	α-helix	trans	-59.4	-39.5	175.3	-167.6	64.8	77	0	0	112.8	Y14 L148 I170 A171 S336 A337 A338 S342 A343 D344	Y14-M340 HydrophobicContact CE1-CE 4.34Å; Y14-M340 HydrophobicContact CE2-CE 4.33Å; Y14-M340 WeakPolarHBondContact OH-CE 3.43Å; L148-M340 HydrophobicContact CD1-CE 3.65Å; L148-M340 HydrophobicContact CD1-SD 3.64Å; L148-M340 HydrophobicContact CD2-CE 4.28Å; I170-M340 HydrophobicContact CB-CE 4.1Å; I170-M340 HydrophobicContact CG2-CE 3.67Å; A171-M340 WeakPolarHBondContact CA-SD 3.18Å; A171-M340 HydrophobicContact CB-CE 4.26Å; A171-M340 HydrophobicContact CB-SD 3.23Å; A171-M340 WeakPolarHBondContact CB-SD 3.27Å; S336-M340 WeakPolarHBondContact O-CB 3.27Å; S336-M340 PolarHBondContact O-N 3.44Å; A337-M340 WeakPolarHBondContact O-CB 3.22Å; A337-M340 PolarHBondContact O-N 2.79Å; A338-M340 PolarHBondContact O-N 2.96Å; M340-S342 VanDerWaalsContact C-N 3.28Å; M340-S342 PolarHBondContact O-N 2.92Å; M340-A343 WeakPolarHBondContact O-CA 3.2Å; M340-A343 VanDerWaalsContact O-CB 3.24Å; M340-A343 WeakPolarHBondContact O-CB 3.47Å; M340-A343 PolarHBondContact O-N 2.92Å; M340-D344 PolarHBondContact O-N 3.17Å; M340-D344 VanDerWaalsContact O-N 3.12Å
341	S	86	Confident	91.2	Very high	1 Å²	1	1 Å²	1	1%	0.007	1%	0.006	C	C	.	.	H	α-helix	trans	-66	-31.2	-177.1	-144.7	0	0	0	0	113.9	D187 Q190 A338 V339 A343 D344 S345	D187-S341 WeakPolarHBondContact OD1-CB 3.46Å; D187-S341 PolarHBondContact OD1-OG 2.96Å; Q190-S341 PolarHBondContact OE1-OG 3.33Å; A338-S341 WeakPolarHBondContact O-CB 3.5Å; A338-S341 PolarHBondContact O-N 3.31Å; V339-S341 VanDerWaalsContact C-N 3.31Å; V339-S341 PolarHBondContact O-N 3.33Å; S341-A343 VanDerWaalsContact C-N 3.32Å; S341-D344 PolarHBondContact O-N 2.81Å; S341-S345 WeakPolarHBondContact O-CB 3.45Å; S341-S345 PolarHBondContact O-N 3.3Å; S341-S345 PolarHBondContact O-OG 3.48Å
342	S	91.8	Very high	91	Very high	0 Å²	0	1 Å²	1	0%	0	1%	0.006	C	C	.	.	H	α-helix	trans	-67.9	-34.9	171.9	-55.9	0	0	0	0	111.5	T60 G63 V339 M340 S345 S346	T60-S342 PolarHBondContact O-OG 2.83Å; G63-S342 WeakPolarHBondContact CA-OG 3.35Å; V339-S342 PolarHBondContact O-N 2.9Å; M340-S342 VanDerWaalsContact C-N 3.28Å; M340-S342 PolarHBondContact O-N 2.92Å; S342-S345 PolarHBondContact O-N 2.98Å; S342-S346 WeakPolarHBondContact O-CB 3.35Å; S342-S346 PolarHBondContact O-N 3.38Å
343	A	91.3	Very high	91.1	Very high	1 Å²	1	1 Å²	1	1%	0.008	1%	0.006	C	C	.	.	H	α-helix	trans	-62.8	-47.4	175.4	0	0	0	0	0	110	I144 A171 V339 M340 S341 S345 S346 V347	I144-A343 HydrophobicContact CG2-CB 3.67Å; A171-A343 HydrophobicContact CB-CB 4.26Å; V339-A343 PolarHBondContact O-N 3.39Å; M340-A343 WeakPolarHBondContact O-CA 3.2Å; M340-A343 VanDerWaalsContact O-CB 3.24Å; M340-A343 WeakPolarHBondContact O-CB 3.47Å; M340-A343 PolarHBondContact O-N 2.92Å; S341-A343 VanDerWaalsContact C-N 3.32Å; A343-S345 VanDerWaalsContact C-N 3.31Å; A343-S345 PolarHBondContact O-N 3.44Å; A343-S346 PolarHBondContact O-N 3.46Å; A343-V347 WeakPolarHBondContact O-CB 3.36Å; A343-V347 VanDerWaalsContact O-CG2 3.31Å; A343-V347 WeakPolarHBondContact O-CG2 3.07Å; A343-V347 PolarHBondContact O-N 3Å
344	D	87.1	Confident	91.2	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-57.4	-46.7	177	-61.5	-44.6	0	0	0	111.4	Y174 T175 V183 M340 S341 L348	Y174-D344 WeakPolarHBondContact CD1-OD2 3.22Å; Y174-D344 VanDerWaalsContact CE1-OD2 3.26Å; Y174-D344 WeakPolarHBondContact CE1-OD2 3.07Å; T175-D344 WeakPolarHBondContact CA-OD1 3.48Å; T175-D344 WeakPolarHBondContact CB-OD1 3.36Å; T175-D344 HydrophobicContact CG2-CB 4.28Å; T175-D344 PolarHBondContact N-OD1 2.99Å; T175-D344 PolarHBondContact OG1-OD1 3.24Å; V183-D344 HydrophobicContact CG2-CB 4.39Å; M340-D344 PolarHBondContact O-N 3.17Å; M340-D344 VanDerWaalsContact O-N 3.12Å; S341-D344 PolarHBondContact O-N 2.81Å; D344-L348 WeakPolarHBondContact O-CB 3.45Å; D344-L348 PolarHBondContact O-N 3.04Å
345	S	90.8	Very high	91.3	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-63.1	-44	-179.3	-65.6	0	0	0	0	112.1	V183 R253 S341 S342 A343 S349	V183-S345 WeakPolarHBondContact CG1-OG 3.46Å; R253-S345 PolarHBondContact NH2-OG 3.33Å; S341-S345 WeakPolarHBondContact O-CB 3.45Å; S341-S345 PolarHBondContact O-N 3.3Å; S341-S345 PolarHBondContact O-OG 3.48Å; S342-S345 PolarHBondContact O-N 2.98Å; A343-S345 VanDerWaalsContact C-N 3.31Å; A343-S345 PolarHBondContact O-N 3.44Å; S345-S349 WeakPolarHBondContact O-CB 3.24Å; S345-S349 PolarHBondContact O-N 3.4Å
346	S	93.9	Very high	91.3	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-69.9	-45.8	-179.8	-173.3	0	0	0	0	112.6	E137 W140 T141 S342 A343 S349 A350	E137-S346 PolarHBondContact O-OG 3.49Å; E137-S346 WeakPolarHBondContact OE2-CA 3.25Å; E137-S346 WeakPolarHBondContact OE2-CB 3.41Å; E137-S346 PolarHBondContact OE2-OG 2.75Å; W140-S346 VanDerWaalsContact CE3-CB 3.46Å; T141-S346 WeakPolarHBondContact OG1-CB 3.31Å; T141-S346 PolarHBondContact OG1-OG 2.9Å; S342-S346 WeakPolarHBondContact O-CB 3.35Å; S342-S346 PolarHBondContact O-N 3.38Å; A343-S346 PolarHBondContact O-N 3.46Å; S346-S349 VanDerWaalsContact O-CB 3.3Å; S346-S349 WeakPolarHBondContact O-CB 3.44Å; S346-S349 PolarHBondContact O-N 2.95Å; S346-A350 PolarHBondContact O-N 3.42Å
347	V	92.7	Very high	91.4	Very high	3 Å²	3	7.3 Å²	7.3	2%	0.018	3%	0.032	C	C	.	.	H	α-helix	trans	-69.7	-40.6	-179.1	-178.2	0	0	0	0	110.9	T141 L172 A343 S349 A350 A351 I380 I383	T141-V347 HydrophobicContact CG2-CG2 3.47Å; T141-V347 VanDerWaalsContact CG2-CG2 3.47Å; L172-V347 HydrophobicContact CD2-CG1 4.38Å; A343-V347 WeakPolarHBondContact O-CB 3.36Å; A343-V347 VanDerWaalsContact O-CG2 3.31Å; A343-V347 WeakPolarHBondContact O-CG2 3.07Å; A343-V347 PolarHBondContact O-N 3Å; V347-S349 VanDerWaalsContact C-N 3.33Å; V347-A350 PolarHBondContact O-N 3.05Å; V347-A351 WeakPolarHBondContact O-CB 3.41Å; V347-A351 PolarHBondContact O-N 3.28Å; V347-I380 HydrophobicContact CG1-CB 3.94Å; V347-I380 HydrophobicContact CG1-CG1 4.01Å; V347-I380 HydrophobicContact CG1-CG2 3.74Å; V347-I383 HydrophobicContact CG1-CB 4.44Å; V347-I383 HydrophobicContact CG1-CG2 4.35Å
348	L	88.7	Confident	91.7	Very high	2 Å²	2	7.9 Å²	7.9	1%	0.01	4%	0.036	C	C	.	.	H	α-helix	trans	-64.1	-40.1	173.4	-177.2	63.1	0	0	0	111.3	T175 D344 A351 S352 M376	T175-L348 HydrophobicContact CG2-CB 4.37Å; D344-L348 WeakPolarHBondContact O-CB 3.45Å; D344-L348 PolarHBondContact O-N 3.04Å; L348-A351 PolarHBondContact O-N 3.48Å; L348-S352 WeakPolarHBondContact O-CB 3.47Å; L348-S352 PolarHBondContact O-N 2.76Å; L348-S352 PolarHBondContact O-OG 3.24Å; L348-M376 HydrophobicContact CD1-CE 4.13Å; L348-M376 HydrophobicContact CD1-SD 3.77Å
349	S	91.6	Very high	92.1	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-55.9	-54.4	174.8	170.2	0	0	0	0	111.1	E137 Q248 V249 S345 S346 V347 S352 M353	E137-S349 VanDerWaalsContact CD-OG 3.31Å; E137-S349 WeakPolarHBondContact OE1-CB 3.37Å; E137-S349 PolarHBondContact OE1-OG 3.1Å; Q248-S349 WeakPolarHBondContact CB-OG 3.29Å; Q248-S349 WeakPolarHBondContact CG-OG 3.45Å; V249-S349 PolarHBondContact N-OG 3.04Å; S345-S349 WeakPolarHBondContact O-CB 3.24Å; S345-S349 PolarHBondContact O-N 3.4Å; S346-S349 VanDerWaalsContact O-CB 3.3Å; S346-S349 WeakPolarHBondContact O-CB 3.44Å; S346-S349 PolarHBondContact O-N 2.95Å; V347-S349 VanDerWaalsContact C-N 3.33Å; S349-S352 PolarHBondContact O-N 3.16Å; S349-S352 PolarHBondContact O-OG 2.97Å; S349-M353 PolarHBondContact O-N 3.27Å
350	A	94.8	Very high	92.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-63.4	-44.8	179.2	0	0	0	0	0	112.9	L134 E137 S346 V347 S352 M353 F354 I383	L134-A350 HydrophobicContact CD1-CB 4.1Å; E137-A350 HydrophobicContact CB-CB 3.7Å; E137-A350 HydrophobicContact CG-CB 3.95Å; S346-A350 PolarHBondContact O-N 3.42Å; V347-A350 PolarHBondContact O-N 3.05Å; A350-S352 VanDerWaalsContact C-N 3.32Å; A350-S352 PolarHBondContact O-N 3.36Å; A350-M353 PolarHBondContact O-N 2.91Å; A350-F354 PolarHBondContact O-N 2.83Å; A350-I383 HydrophobicContact CB-CD1 3.69Å; A350-I383 HydrophobicContact CB-CG2 4.2Å
351	A	93.2	Very high	92.4	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-62.9	-38.3	178.3	0	0	0	0	0	112.2	V347 L348 F354 A355 M376 I380 I383	V347-A351 WeakPolarHBondContact O-CB 3.41Å; V347-A351 PolarHBondContact O-N 3.28Å; L348-A351 PolarHBondContact O-N 3.48Å; A351-F354 PolarHBondContact O-N 3.39Å; A351-A355 WeakPolarHBondContact O-CB 3.14Å; A351-A355 PolarHBondContact O-N 3.48Å; A351-M376 HydrophobicContact CB-CG 3.69Å; A351-M376 WeakPolarHBondContact CB-O 3.22Å; A351-I380 HydrophobicContact CB-CG1 3.81Å; A351-I383 HydrophobicContact CB-CD1 4.42Å
352	S	90.9	Very high	92.8	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.007	6%	0.062	C	C	.	.	H	α-helix	trans	-65.6	-42.9	178.9	77.3	0	0	0	0	112.1	Q248 L348 S349 A350 R356	Q248-S352 PolarHBondContact NE2-OG 3.42Å; L348-S352 WeakPolarHBondContact O-CB 3.47Å; L348-S352 PolarHBondContact O-N 2.76Å; L348-S352 PolarHBondContact O-OG 3.24Å; S349-S352 PolarHBondContact O-N 3.16Å; S349-S352 PolarHBondContact O-OG 2.97Å; A350-S352 VanDerWaalsContact C-N 3.32Å; A350-S352 PolarHBondContact O-N 3.36Å; S352-R356 WeakPolarHBondContact O-CB 3.15Å; S352-R356 PolarHBondContact O-N 2.98Å; S352-R356 VanDerWaalsContact O-N 3.16Å
353	M	94.2	Very high	92.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.3	-44.7	173.9	-73.2	-172.7	-68.6	0	0	111.4	M113 L114 F130 A133 E137 Q248 S349 A350 N357	M113-M353 HydrophobicContact CE-SD 3.84Å; L114-M353 HydrophobicContact CD1-CB 4.21Å; L114-M353 HydrophobicContact CD1-CG 4.16Å; L114-M353 HydrophobicContact CD1-SD 3.66Å; L114-M353 HydrophobicContact CG-CG 4.49Å; L114-M353 HydrophobicContact CG-SD 3.85Å; F130-M353 HydrophobicContact CD2-CB 3.74Å; F130-M353 HydrophobicContact CE2-CB 3.7Å; F130-M353 HydrophobicContact CE2-CE 4.39Å; A133-M353 HydrophobicContact CB-CE 3.92Å; A133-M353 HydrophobicContact CB-SD 4.01Å; E137-M353 HydrophobicContact CG-CE 4.16Å; Q248-M353 HydrophobicContact CB-CE 3.54Å; Q248-M353 HydrophobicContact CB-CG 4.09Å; Q248-M353 HydrophobicContact CB-SD 3.44Å; Q248-M353 WeakPolarHBondContact CB-SD 3.28Å; Q248-M353 HydrophobicContact CG-CE 3.9Å; Q248-M353 HydrophobicContact CG-CG 3.64Å; Q248-M353 HydrophobicContact CG-SD 3.73Å; S349-M353 PolarHBondContact O-N 3.27Å; A350-M353 PolarHBondContact O-N 2.91Å; M353-N357 WeakPolarHBondContact O-CA 3.42Å; M353-N357 VanDerWaalsContact O-CB 3.31Å; M353-N357 WeakPolarHBondContact O-CB 3.4Å; M353-N357 PolarHBondContact O-N 2.73Å
354	F	96.3	Very high	93.1	Very high	63 Å²	63	26.1 Å²	26.1	28%	0.276	12%	0.115	S	C	.	.	I	π-helix	trans	-62.1	-51	-179.9	-177.5	-103.2	0	0	0	111.8	F130 A350 A351 R356 V358 V359 I375 S379	F130-F354 HydrophobicContact CD1-CD2 4.49Å; F130-F354 HydrophobicContact CE1-CB 4.34Å; F130-F354 AromaticContact CE1-CD2 3.61Å; F130-F354 HydrophobicContact CE1-CD2 3.61Å; F130-F354 HydrophobicContact CE1-CE2 4.47Å; F130-F354 HydrophobicContact CE1-CG 4.45Å; F130-F354 HydrophobicContact CE2-CB 4.01Å; F130-F354 HydrophobicContact CZ-CB 3.62Å; F130-F354 AromaticContact CZ-CD2 3.75Å; F130-F354 HydrophobicContact CZ-CD2 3.75Å; F130-F354 HydrophobicContact CZ-CG 4.15Å; A350-F354 PolarHBondContact O-N 2.83Å; A351-F354 PolarHBondContact O-N 3.39Å; F354-R356 VanDerWaalsContact C-N 3.34Å; F354-R356 PolarHBondContact O-N 3.33Å; F354-V358 HydrophobicContact CD2-CB 3.99Å; F354-V358 HydrophobicContact CD2-CG1 4.18Å; F354-V358 HydrophobicContact CD2-CG2 4.21Å; F354-V358 HydrophobicContact CE2-CB 4.33Å; F354-V358 HydrophobicContact CE2-CG1 4.05Å; F354-V358 WeakPolarHBondContact O-CA 3.2Å; F354-V358 VanDerWaalsContact O-CB 3.31Å; F354-V358 WeakPolarHBondContact O-CB 3.3Å; F354-V358 PolarHBondContact O-N 3.45Å; F354-V359 HydrophobicContact CD1-CG2 3.71Å; F354-V359 HydrophobicContact CE1-CG2 3.27Å; F354-V359 HydrophobicContact CE2-CG2 4.18Å; F354-V359 HydrophobicContact CG-CG2 4.38Å; F354-V359 HydrophobicContact CZ-CG2 3.54Å; F354-V359 PolarHBondContact O-N 2.96Å; F354-I375 HydrophobicContact CD1-CG2 4.19Å; F354-I375 HydrophobicContact CE1-CG2 4.22Å; F354-S379 WeakPolarHBondContact CD1-OG 3.37Å; F354-S379 WeakPolarHBondContact CE1-OG 3.35Å
355	A	94.4	Very high	93.3	Very high	2 Å²	2	32.1 Å²	32.1	2%	0.017	14%	0.143	C	C	.	.	I	π-helix	trans	-61.1	-42.8	-177.6	0	0	0	0	0	111.8	A351 K360 V372 I375 M376	A351-A355 WeakPolarHBondContact O-CB 3.14Å; A351-A355 PolarHBondContact O-N 3.48Å; A355-K360 VanDerWaalsContact O-CB 3.31Å; A355-K360 WeakPolarHBondContact O-CB 3.42Å; A355-K360 PolarHBondContact O-N 2.95Å; A355-V372 HydrophobicContact CB-CG1 4.01Å; A355-I375 HydrophobicContact CB-CB 4.26Å; A355-I375 HydrophobicContact CB-CG2 3.85Å; A355-M376 HydrophobicContact CB-CB 3.97Å
356	R	91.2	Very high	93.4	Very high	69 Å²	69	41.4 Å²	41.4	26%	0.26	18%	0.184	S	C	.	.	I	π-helix	trans	-85.5	-56.2	-175.8	-177.4	-177.7	171.1	111.2	-3	113.6	M42 V111 D115 S352 F354 A361	M42-R356 HydrophobicContact CE-CB 4.17Å; V111-R356 VanDerWaalsContact CB-NH2 3.32Å; V111-R356 VanDerWaalsContact CG1-NH1 3.34Å; D115-R356 IonicContact OD1-NE 3.48Å; D115-R356 PolarHBondContact OD1-NE 2.82Å; D115-R356 IonicContact OD1-NH2 3.07Å; D115-R356 IonicContact OD2-CZ 2.75Å; D115-R356 IonicContact OD2-NE 3.76Å; D115-R356 IonicContact OD2-NH2 3.83Å; D115-R356 PolarHBondContact OD2-NH2 3.43Å; D115-R356 VanDerWaalsContact OD2-NH2 3.11Å; S352-R356 WeakPolarHBondContact O-CB 3.15Å; S352-R356 PolarHBondContact O-N 2.98Å; S352-R356 VanDerWaalsContact O-N 3.16Å; F354-R356 VanDerWaalsContact C-N 3.34Å; F354-R356 PolarHBondContact O-N 3.33Å; R356-A361 PolarHBondContact O-N 2.72Å
357	N	94.4	Very high	93.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-87.2	-15.1	-169.2	-60.2	107.6	0	0	0	113.2	T112 L114 D115 Q118 M353 A361	T112-N357 WeakPolarHBondContact CB-OD1 3.08Å; T112-N357 WeakPolarHBondContact CG2-OD1 3.19Å; T112-N357 PolarHBondContact OG1-ND2 3.35Å; T112-N357 PolarHBondContact OG1-OD1 2.72Å; L114-N357 HydrophobicContact CB-CB 4.36Å; L114-N357 HydrophobicContact CD1-CB 4.37Å; D115-N357 PolarHBondContact OD1-ND2 2.73Å; Q118-N357 PolarHBondContact OE1-ND2 2.56Å; M353-N357 WeakPolarHBondContact O-CA 3.42Å; M353-N357 VanDerWaalsContact O-CB 3.31Å; M353-N357 WeakPolarHBondContact O-CB 3.4Å; M353-N357 PolarHBondContact O-N 2.73Å; N357-A361 WeakPolarHBondContact O-CB 3.18Å
358	V	96.4	Very high	93.3	Very high	12 Å²	12	44.1 Å²	44.1	7%	0.073	20%	0.204	C	C	.	.	I	π-helix	trans	-110.9	-66.7	176.8	-174.1	0	0	0	0	110.6	F130 F354 I362 F363	F130-V358 HydrophobicContact CB-CG2 3.8Å; F130-V358 HydrophobicContact CD1-CG2 3.5Å; F130-V358 VanDerWaalsContact CD1-CG2 3.5Å; F130-V358 HydrophobicContact CD2-CG2 4.18Å; F130-V358 HydrophobicContact CE1-CG2 4.09Å; F130-V358 HydrophobicContact CG-CG2 3.53Å; F354-V358 HydrophobicContact CD2-CB 3.99Å; F354-V358 HydrophobicContact CD2-CG1 4.18Å; F354-V358 HydrophobicContact CD2-CG2 4.21Å; F354-V358 HydrophobicContact CE2-CB 4.33Å; F354-V358 HydrophobicContact CE2-CG1 4.05Å; F354-V358 WeakPolarHBondContact O-CA 3.2Å; F354-V358 VanDerWaalsContact O-CB 3.31Å; F354-V358 WeakPolarHBondContact O-CB 3.3Å; F354-V358 PolarHBondContact O-N 3.45Å; V358-I362 HydrophobicContact CG1-CD1 4.39Å; V358-I362 WeakPolarHBondContact O-CB 3.39Å; V358-I362 WeakPolarHBondContact O-CG1 3.46Å; V358-I362 PolarHBondContact O-N 2.85Å; V358-F363 HydrophobicContact CG1-CD2 4.29Å; V358-F363 HydrophobicContact CG1-CE2 3.91Å
359	V	96.3	Very high	93.2	Very high	21 Å²	21	46.5 Å²	46.5	13%	0.127	22%	0.215	C	C	.	.	I	π-helix	trans	-68.1	-57.9	-171.4	-177.1	0	0	0	0	111.4	F354 A361 F363 W364 I375	F354-V359 HydrophobicContact CD1-CG2 3.71Å; F354-V359 HydrophobicContact CE1-CG2 3.27Å; F354-V359 HydrophobicContact CE2-CG2 4.18Å; F354-V359 HydrophobicContact CG-CG2 4.38Å; F354-V359 HydrophobicContact CZ-CG2 3.54Å; F354-V359 PolarHBondContact O-N 2.96Å; V359-A361 PolarHBondContact O-N 2.91Å; V359-F363 CarbonylContact O-C 3.23Å; V359-F363 WeakPolarHBondContact O-CA 3.28Å; V359-F363 PolarHBondContact O-N 3.29Å; V359-W364 PolarHBondContact O-N 3.19Å; V359-I375 HydrophobicContact CB-CD1 4.31Å; V359-I375 HydrophobicContact CB-CG2 4.04Å; V359-I375 HydrophobicContact CG1-CD1 3.55Å; V359-I375 HydrophobicContact CG1-CG1 4.29Å; V359-I375 HydrophobicContact CG1-CG2 4.2Å; V359-I375 HydrophobicContact CG2-CG2 3.85Å
360	K	93.2	Very high	93	Very high	52 Å²	52	51.5 Å²	51.5	23%	0.226	24%	0.24	C	C	.	.	I	π-helix	trans	-62.2	-45.5	179	-170.4	-178.3	-162.8	169.8	0	111.2	A355 W364 Q365 A367 E369 V372	A355-K360 VanDerWaalsContact O-CB 3.31Å; A355-K360 WeakPolarHBondContact O-CB 3.42Å; A355-K360 PolarHBondContact O-N 2.95Å; K360-W364 CarbonylContact O-C 3.58Å; K360-W364 VanDerWaalsContact O-C 3.23Å; K360-Q365 WeakPolarHBondContact O-CA 3.3Å; K360-Q365 PolarHBondContact O-N 3.27Å; K360-Q365 VanDerWaalsContact O-N 3.14Å; K360-A367 WeakPolarHBondContact CE-O 3.02Å; K360-A367 HydrophobicContact CG-CB 4.43Å; K360-E369 IonicContact NZ-OE1 2.77Å; K360-E369 PolarHBondContact NZ-OE1 3.24Å; K360-V372 HydrophobicContact CB-CG2 4.35Å; K360-V372 HydrophobicContact CD-CG2 3.72Å; K360-V372 HydrophobicContact CG-CG2 4.26Å
361	A	91.7	Very high	92.9	Very high	7 Å²	7	54.8 Å²	54.8	6%	0.058	26%	0.255	C	S	.	.	I	π-helix	trans	-67.1	-41.8	-176	0	0	0	0	0	113.9	E123 R356 N357 V359 Q365	E123-A361 HydrophobicContact CB-CB 4.21Å; E123-A361 HydrophobicContact CG-CB 4.11Å; R356-A361 PolarHBondContact O-N 2.72Å; N357-A361 WeakPolarHBondContact O-CB 3.18Å; V359-A361 PolarHBondContact O-N 2.91Å; A361-Q365 WeakPolarHBondContact O-CG 3.23Å; A361-Q365 PolarHBondContact O-NE2 3.33Å
362	I	93.8	Very high	92.8	Very high	44 Å²	44	55 Å²	55	23%	0.226	26%	0.257	C	S	.	.	I	π-helix	trans	-104.2	-47.8	-168.9	-54.4	173.2	0	0	0	111.8	E123 V358	E123-I362 HydrophobicContact CB-CG1 4.12Å; E123-I362 WeakPolarHBondContact O-CD1 3.46Å; V358-I362 HydrophobicContact CG1-CD1 4.39Å; V358-I362 WeakPolarHBondContact O-CB 3.39Å; V358-I362 WeakPolarHBondContact O-CG1 3.46Å; V358-I362 PolarHBondContact O-N 2.85Å
363	F	94.5	Very high	92.7	Very high	157 Å²	157	56.5 Å²	56.5	69%	0.689	27%	0.265	S	S	*	.	I	π-helix	trans	-99.1	-32	-167	-63.4	-72.5	0	0	0	113.5	V358 V359	V358-F363 HydrophobicContact CG1-CD2 4.29Å; V358-F363 HydrophobicContact CG1-CE2 3.91Å; V359-F363 CarbonylContact O-C 3.23Å; V359-F363 WeakPolarHBondContact O-CA 3.28Å; V359-F363 PolarHBondContact O-N 3.29Å
364	W	94.2	Very high	92.5	Very high	115 Å²	115	64.1 Å²	64.1	44%	0.436	29%	0.294	S	S	.	.			trans	-143.3	68.2	-173.7	-163.5	-1.3	0	0	0	112.7	V359 K360 K366 A367 Q371 I375	V359-W364 PolarHBondContact O-N 3.19Å; K360-W364 CarbonylContact O-C 3.58Å; K360-W364 VanDerWaalsContact O-C 3.23Å; W364-K366 PolarHBondContact O-N 3.48Å; W364-K366 VanDerWaalsContact O-N 3.1Å; W364-A367 HydrophobicContact CB-CB 4.25Å; W364-A367 HydrophobicContact CD2-CB 3.86Å; W364-A367 HydrophobicContact CE3-CB 4.37Å; W364-A367 HydrophobicContact CG-CB 3.78Å; W364-A367 VanDerWaalsContact O-CB 3.24Å; W364-A367 WeakPolarHBondContact O-CB 3.36Å; W364-A367 PolarHBondContact O-N 3.09Å; W364-Q371 HydrophobicContact CH2-CB 4.43Å; W364-Q371 HydrophobicContact CH2-CG 4.1Å; W364-Q371 HydrophobicContact CZ2-CG 4.45Å; W364-I375 HydrophobicContact CE3-CD1 4.24Å
365	Q	92.9	Very high	92.4	Very high	126 Å²	126	62.4 Å²	62.4	59%	0.589	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-24	-178	-63.4	121.1	-1.7	0	0	114.5	K360 A361	K360-Q365 WeakPolarHBondContact O-CA 3.3Å; K360-Q365 PolarHBondContact O-N 3.27Å; K360-Q365 VanDerWaalsContact O-N 3.14Å; A361-Q365 WeakPolarHBondContact O-CG 3.23Å; A361-Q365 PolarHBondContact O-NE2 3.33Å
366	K	93	Very high	92.2	Very high	195 Å²	195	62.9 Å²	62.9	85%	0.848	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	3.7	177.6	-61.8	-175	-179.3	-180	0	113.7	W364 S368	W364-K366 PolarHBondContact O-N 3.48Å; W364-K366 VanDerWaalsContact O-N 3.1Å; K366-S368 PolarHBondContact O-N 3.36Å
367	A	91	Very high	92.2	Very high	6 Å²	6	64.5 Å²	64.5	5%	0.05	30%	0.295	C	S	.	.			trans	-59.2	126.7	-179.5	0	0	0	0	0	110.7	K360 W364 Q371 V372	K360-A367 WeakPolarHBondContact CE-O 3.02Å; K360-A367 HydrophobicContact CG-CB 4.43Å; W364-A367 HydrophobicContact CB-CB 4.25Å; W364-A367 HydrophobicContact CD2-CB 3.86Å; W364-A367 HydrophobicContact CE3-CB 4.37Å; W364-A367 HydrophobicContact CG-CB 3.78Å; W364-A367 VanDerWaalsContact O-CB 3.24Å; W364-A367 WeakPolarHBondContact O-CB 3.36Å; W364-A367 PolarHBondContact O-N 3.09Å; A367-Q371 HydrophobicContact CB-CB 4.33Å; A367-V372 HydrophobicContact CB-CG2 4.1Å
368	S	91.7	Very high	92.1	Very high	55 Å²	55	67.2 Å²	67.2	39%	0.385	32%	0.318	S	S	.	.			trans	-67.5	162.3	171.6	62.9	0	0	0	0	111.3	K366 I370 Q371 V372	K366-S368 PolarHBondContact O-N 3.36Å; S368-I370 VanDerWaalsContact C-N 3.29Å; S368-I370 PolarHBondContact O-N 2.8Å; S368-Q371 WeakPolarHBondContact O-CB 3.26Å; S368-Q371 PolarHBondContact O-N 2.85Å; S368-Q371 VanDerWaalsContact OG-CD 3.24Å; S368-Q371 WeakPolarHBondContact OG-CG 3.18Å; S368-Q371 PolarHBondContact OG-N 2.86Å; S368-Q371 PolarHBondContact OG-OE1 2.94Å; S368-V372 WeakPolarHBondContact O-CG2 3.23Å; S368-V372 PolarHBondContact O-N 2.89Å
369	E	87.1	Confident	92	Very high	52 Å²	52	67.1 Å²	67.1	24%	0.243	32%	0.317	C	S	.	.	H	α-helix	trans	-56.4	-42.1	179.5	-60.5	-59.7	113.2	0	0	112.2	T38 K360 Q371 V372 L373	T38-E369 WeakPolarHBondContact CB-OE2 3.39Å; T38-E369 HydrophobicContact CG2-CB 4.06Å; T38-E369 WeakPolarHBondContact CG2-OE2 3.22Å; T38-E369 PolarHBondContact OG1-OE2 3.14Å; K360-E369 IonicContact NZ-OE1 2.77Å; K360-E369 PolarHBondContact NZ-OE1 3.24Å; E369-Q371 VanDerWaalsContact C-N 3.34Å; E369-Q371 PolarHBondContact O-N 3.23Å; E369-V372 WeakPolarHBondContact O-CB 3.37Å; E369-V372 PolarHBondContact O-N 3.28Å; E369-L373 WeakPolarHBondContact O-CG 3.4Å; E369-L373 PolarHBondContact O-N 3.42Å
370	I	88.8	Confident	91.8	Very high	104 Å²	104	66.2 Å²	66.2	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-40.9	176.7	-63.2	170.6	0	0	0	111.4	S368 L373 W374	S368-I370 VanDerWaalsContact C-N 3.29Å; S368-I370 PolarHBondContact O-N 2.8Å; I370-L373 PolarHBondContact O-N 3.4Å; I370-W374 VanDerWaalsContact O-CD1 3.23Å; I370-W374 PolarHBondContact O-N 3.35Å
371	Q	92.5	Very high	91.8	Very high	69 Å²	69	68.8 Å²	68.8	32%	0.322	32%	0.323	S	S	.	.	H	α-helix	trans	-66.8	-38.9	178.1	-73.5	163.9	-28.4	0	0	111.5	W364 A367 S368 E369 L373 W374 I375	W364-Q371 HydrophobicContact CH2-CB 4.43Å; W364-Q371 HydrophobicContact CH2-CG 4.1Å; W364-Q371 HydrophobicContact CZ2-CG 4.45Å; A367-Q371 HydrophobicContact CB-CB 4.33Å; S368-Q371 WeakPolarHBondContact O-CB 3.26Å; S368-Q371 PolarHBondContact O-N 2.85Å; S368-Q371 VanDerWaalsContact OG-CD 3.24Å; S368-Q371 WeakPolarHBondContact OG-CG 3.18Å; S368-Q371 PolarHBondContact OG-N 2.86Å; S368-Q371 PolarHBondContact OG-OE1 2.94Å; E369-Q371 VanDerWaalsContact C-N 3.34Å; E369-Q371 PolarHBondContact O-N 3.23Å; Q371-L373 VanDerWaalsContact C-N 3.3Å; Q371-L373 PolarHBondContact O-N 2.84Å; Q371-W374 PolarHBondContact O-N 3.03Å; Q371-I375 WeakPolarHBondContact O-CD1 3.35Å; Q371-I375 VanDerWaalsContact O-CG1 3.31Å; Q371-I375 WeakPolarHBondContact O-CG1 3.34Å; Q371-I375 PolarHBondContact O-N 3.18Å
372	V	91	Very high	92	Very high	6 Å²	6	73.3 Å²	73.3	4%	0.036	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-41.2	174.5	177.2	0	0	0	0	110.8	T38 A355 K360 A367 S368 E369 I375 M376	T38-V372 HydrophobicContact CG2-CB 4.12Å; T38-V372 HydrophobicContact CG2-CG1 4.04Å; A355-V372 HydrophobicContact CB-CG1 4.01Å; K360-V372 HydrophobicContact CB-CG2 4.35Å; K360-V372 HydrophobicContact CD-CG2 3.72Å; K360-V372 HydrophobicContact CG-CG2 4.26Å; A367-V372 HydrophobicContact CB-CG2 4.1Å; S368-V372 WeakPolarHBondContact O-CG2 3.23Å; S368-V372 PolarHBondContact O-N 2.89Å; E369-V372 WeakPolarHBondContact O-CB 3.37Å; E369-V372 PolarHBondContact O-N 3.28Å; V372-I375 PolarHBondContact O-N 3.49Å; V372-M376 WeakPolarHBondContact O-CB 3.13Å; V372-M376 PolarHBondContact O-N 3.21Å
373	L	88	Confident	92.1	Very high	32 Å²	32	71.8 Å²	71.8	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-38.9	175.4	-66.5	176.9	0	0	0	112.5	T38 V41 E369 I370 Q371 M376 R377	T38-L373 HydrophobicContact CG2-CD2 4.18Å; T38-L373 HydrophobicContact CG2-CG 4.22Å; V41-L373 HydrophobicContact CB-CD2 3.91Å; V41-L373 HydrophobicContact CG1-CD2 3.98Å; V41-L373 HydrophobicContact CG2-CD2 3.86Å; E369-L373 WeakPolarHBondContact O-CG 3.4Å; E369-L373 PolarHBondContact O-N 3.42Å; I370-L373 PolarHBondContact O-N 3.4Å; Q371-L373 VanDerWaalsContact C-N 3.3Å; Q371-L373 PolarHBondContact O-N 2.84Å; L373-M376 HydrophobicContact CD2-CE 3.87Å; L373-M376 PolarHBondContact O-N 3.3Å; L373-R377 WeakPolarHBondContact O-CG 3.46Å; L373-R377 PolarHBondContact O-N 3.11Å
374	W	91.3	Very high	92.1	Very high	160 Å²	160	64.4 Å²	64.4	61%	0.606	31%	0.31	S	S	*	.	H	α-helix	trans	-66	-42.1	174.5	-82.7	112.5	0	0	0	112.8	I370 Q371 M376 R377 A378	I370-W374 VanDerWaalsContact O-CD1 3.23Å; I370-W374 PolarHBondContact O-N 3.35Å; Q371-W374 PolarHBondContact O-N 3.03Å; W374-M376 VanDerWaalsContact C-N 3.3Å; W374-M376 PolarHBondContact O-N 3.31Å; W374-R377 PolarHBondContact O-N 3.01Å; W374-A378 PolarHBondContact O-N 2.87Å
375	I	93.9	Very high	92.2	Very high	27 Å²	27	61.8 Å²	61.8	14%	0.138	31%	0.313	C	S	.	.	H	α-helix	trans	-58.6	-47.3	174.1	-68.3	156.5	0	0	0	109.5	F354 A355 V359 W364 Q371 V372 R377 A378 S379	F354-I375 HydrophobicContact CD1-CG2 4.19Å; F354-I375 HydrophobicContact CE1-CG2 4.22Å; A355-I375 HydrophobicContact CB-CB 4.26Å; A355-I375 HydrophobicContact CB-CG2 3.85Å; V359-I375 HydrophobicContact CB-CD1 4.31Å; V359-I375 HydrophobicContact CB-CG2 4.04Å; V359-I375 HydrophobicContact CG1-CD1 3.55Å; V359-I375 HydrophobicContact CG1-CG1 4.29Å; V359-I375 HydrophobicContact CG1-CG2 4.2Å; V359-I375 HydrophobicContact CG2-CG2 3.85Å; W364-I375 HydrophobicContact CE3-CD1 4.24Å; Q371-I375 WeakPolarHBondContact O-CD1 3.35Å; Q371-I375 VanDerWaalsContact O-CG1 3.31Å; Q371-I375 WeakPolarHBondContact O-CG1 3.34Å; Q371-I375 PolarHBondContact O-N 3.18Å; V372-I375 PolarHBondContact O-N 3.49Å; I375-R377 VanDerWaalsContact C-N 3.34Å; I375-R377 PolarHBondContact O-N 3.36Å; I375-A378 PolarHBondContact O-N 3.49Å; I375-S379 WeakPolarHBondContact O-CB 3.4Å; I375-S379 PolarHBondContact O-N 3.34Å; I375-S379 PolarHBondContact O-OG 3.4Å
376	M	89.8	Confident	92.3	Very high	11 Å²	11	59.9 Å²	59.9	5%	0.054	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-45.9	177.7	-171	-176.8	64.8	0	0	111.5	V41 L348 A351 A355 V372 L373 W374 A378 S379 I380	V41-M376 HydrophobicContact CG1-CE 3.48Å; V41-M376 VanDerWaalsContact CG1-CE 3.48Å; V41-M376 HydrophobicContact CG1-SD 4.33Å; L348-M376 HydrophobicContact CD1-CE 4.13Å; L348-M376 HydrophobicContact CD1-SD 3.77Å; A351-M376 HydrophobicContact CB-CG 3.69Å; A351-M376 WeakPolarHBondContact CB-O 3.22Å; A355-M376 HydrophobicContact CB-CB 3.97Å; V372-M376 WeakPolarHBondContact O-CB 3.13Å; V372-M376 PolarHBondContact O-N 3.21Å; L373-M376 HydrophobicContact CD2-CE 3.87Å; L373-M376 PolarHBondContact O-N 3.3Å; W374-M376 VanDerWaalsContact C-N 3.3Å; W374-M376 PolarHBondContact O-N 3.31Å; M376-A378 PolarHBondContact O-N 3.44Å; M376-S379 WeakPolarHBondContact O-CB 3.43Å; M376-S379 PolarHBondContact O-N 2.86Å; M376-I380 WeakPolarHBondContact O-CG1 3.34Å; M376-I380 PolarHBondContact O-N 3.44Å
377	R	90.4	Very high	92.6	Very high	103 Å²	103	50.6 Å²	50.6	39%	0.389	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-42	176.3	-73.5	174.8	173.8	173.5	-0.1	113.3	L176 L373 W374 I375 S379 I380 F381	L176-R377 HydrophobicContact CD2-CB 4.07Å; L176-R377 HydrophobicContact CD2-CG 4.22Å; L373-R377 WeakPolarHBondContact O-CG 3.46Å; L373-R377 PolarHBondContact O-N 3.11Å; W374-R377 PolarHBondContact O-N 3.01Å; I375-R377 VanDerWaalsContact C-N 3.34Å; I375-R377 PolarHBondContact O-N 3.36Å; R377-S379 VanDerWaalsContact C-N 3.33Å; R377-I380 WeakPolarHBondContact O-CB 3.46Å; R377-I380 PolarHBondContact O-N 2.85Å; R377-F381 WeakPolarHBondContact O-CD2 3.33Å
378	A	93.3	Very high	92.9	Very high	58 Å²	58	51 Å²	51	48%	0.479	26%	0.264	S	S	.	.	H	α-helix	trans	-64.3	-39.9	175.5	0	0	0	0	0	111.4	W374 I375 M376 I380 F381 V382	W374-A378 PolarHBondContact O-N 2.87Å; I375-A378 PolarHBondContact O-N 3.49Å; M376-A378 PolarHBondContact O-N 3.44Å; A378-I380 VanDerWaalsContact C-N 3.34Å; A378-I380 PolarHBondContact O-N 3.47Å; A378-F381 PolarHBondContact O-N 2.89Å; A378-V382 PolarHBondContact O-N 3Å
379	S	94.1	Very high	93.1	Very high	9 Å²	9	55.1 Å²	55.1	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-35.4	177.1	-60.5	0	0	0	0	113.2	F354 I375 M376 R377 F381 V382 I383	F354-S379 WeakPolarHBondContact CD1-OG 3.37Å; F354-S379 WeakPolarHBondContact CE1-OG 3.35Å; I375-S379 WeakPolarHBondContact O-CB 3.4Å; I375-S379 PolarHBondContact O-N 3.34Å; I375-S379 PolarHBondContact O-OG 3.4Å; M376-S379 WeakPolarHBondContact O-CB 3.43Å; M376-S379 PolarHBondContact O-N 2.86Å; R377-S379 VanDerWaalsContact C-N 3.33Å; S379-F381 VanDerWaalsContact C-N 3.28Å; S379-F381 PolarHBondContact O-N 3.39Å; S379-V382 PolarHBondContact O-N 3.5Å; S379-I383 VanDerWaalsContact O-CB 3.31Å; S379-I383 WeakPolarHBondContact O-CB 3.3Å; S379-I383 WeakPolarHBondContact O-CD1 3.41Å; S379-I383 WeakPolarHBondContact O-CG1 3.46Å; S379-I383 PolarHBondContact O-N 3.15Å
380	I	92.4	Very high	93.5	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-52.7	-48.8	174.2	-71	169	0	0	0	110.2	L172 T175 L176 V347 A351 M376 R377 A378 G384	L172-I380 HydrophobicContact CD2-CG2 3.71Å; L172-I380 WeakPolarHBondContact CD2-O 3.47Å; T175-I380 HydrophobicContact CG2-CD1 3.96Å; T175-I380 HydrophobicContact CG2-CG1 4.42Å; T175-I380 HydrophobicContact CG2-CG2 4.26Å; L176-I380 HydrophobicContact CD2-CB 4.48Å; L176-I380 HydrophobicContact CD2-CD1 4.38Å; L176-I380 HydrophobicContact CD2-CG2 4.3Å; V347-I380 HydrophobicContact CG1-CB 3.94Å; V347-I380 HydrophobicContact CG1-CG1 4.01Å; V347-I380 HydrophobicContact CG1-CG2 3.74Å; A351-I380 HydrophobicContact CB-CG1 3.81Å; M376-I380 WeakPolarHBondContact O-CG1 3.34Å; M376-I380 PolarHBondContact O-N 3.44Å; R377-I380 WeakPolarHBondContact O-CB 3.46Å; R377-I380 PolarHBondContact O-N 2.85Å; A378-I380 VanDerWaalsContact C-N 3.34Å; A378-I380 PolarHBondContact O-N 3.47Å; I380-G384 PolarHBondContact O-N 3.05Å
381	F	93.2	Very high	93.9	Very high	106 Å²	106	48.4 Å²	48.4	47%	0.465	24%	0.239	S	C	.	.	H	α-helix	trans	-63.6	-45.2	178.8	-78.9	-76.7	0	0	0	113.3	L172 L176 R377 A378 S379 A385	L172-F381 HydrophobicContact CD1-CD1 4.47Å; L176-F381 HydrophobicContact CD1-CD2 4.45Å; L176-F381 HydrophobicContact CD1-CE1 4.15Å; L176-F381 HydrophobicContact CD1-CE2 3.42Å; L176-F381 VanDerWaalsContact CD1-CE2 3.42Å; L176-F381 HydrophobicContact CD1-CZ 3.24Å; L176-F381 HydrophobicContact CD2-CD2 4.14Å; L176-F381 HydrophobicContact CD2-CE2 3.64Å; L176-F381 HydrophobicContact CD2-CZ 4.35Å; L176-F381 HydrophobicContact CG-CE2 4.12Å; L176-F381 HydrophobicContact CG-CZ 4.35Å; R377-F381 WeakPolarHBondContact O-CD2 3.33Å; A378-F381 PolarHBondContact O-N 2.89Å; S379-F381 VanDerWaalsContact C-N 3.28Å; S379-F381 PolarHBondContact O-N 3.39Å; F381-A385 VanDerWaalsContact O-CB 3.28Å; F381-A385 WeakPolarHBondContact O-CB 3.45Å; F381-A385 PolarHBondContact O-N 2.92Å
382	V	95.2	Very high	94	Very high	103 Å²	103	47.3 Å²	47.3	62%	0.624	24%	0.235	S	C	*	.	H	α-helix	trans	-65	-45.8	-178.1	176.2	0	0	0	0	111	A378 S379 A385 F386	A378-V382 PolarHBondContact O-N 3Å; S379-V382 PolarHBondContact O-N 3.5Å; V382-A385 PolarHBondContact O-N 2.9Å; V382-F386 WeakPolarHBondContact O-CB 3.38Å; V382-F386 PolarHBondContact O-N 3.23Å
383	I	95.3	Very high	94.1	Very high	12 Å²	12	50.3 Å²	50.3	6%	0.062	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-44.1	-179.9	-65.6	166.4	0	0	0	109.9	L134 V138 V347 A350 A351 S379 A385 F386 A387	L134-I383 HydrophobicContact CD1-CD1 4.05Å; L134-I383 HydrophobicContact CD1-CG1 4.04Å; V138-I383 HydrophobicContact CG2-CG2 4.07Å; V347-I383 HydrophobicContact CG1-CB 4.44Å; V347-I383 HydrophobicContact CG1-CG2 4.35Å; A350-I383 HydrophobicContact CB-CD1 3.69Å; A350-I383 HydrophobicContact CB-CG2 4.2Å; A351-I383 HydrophobicContact CB-CD1 4.42Å; S379-I383 VanDerWaalsContact O-CB 3.31Å; S379-I383 WeakPolarHBondContact O-CB 3.3Å; S379-I383 WeakPolarHBondContact O-CD1 3.41Å; S379-I383 WeakPolarHBondContact O-CG1 3.46Å; S379-I383 PolarHBondContact O-N 3.15Å; I383-A385 PolarHBondContact O-N 3Å; I383-F386 PolarHBondContact O-N 2.94Å; I383-A387 WeakPolarHBondContact O-CB 2.93Å; I383-A387 PolarHBondContact O-N 2.73Å
384	G	95.3	Very high	94.3	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-44.2	175.2	0	0	0	0	0	113.5	I380 A387 C388	I380-G384 PolarHBondContact O-N 3.05Å; G384-A387 PolarHBondContact O-N 3.24Å; G384-C388 WeakPolarHBondContact O-CB 3.46Å; G384-C388 PolarHBondContact O-N 2.95Å
385	A	95.7	Very high	94.1	Very high	60 Å²	60	45.9 Å²	45.9	50%	0.496	24%	0.241	S	C	.	.	H	α-helix	trans	-63.6	-41.9	176.5	0	0	0	0	0	111.7	F381 V382 I383 C388 W389	F381-A385 VanDerWaalsContact O-CB 3.28Å; F381-A385 WeakPolarHBondContact O-CB 3.45Å; F381-A385 PolarHBondContact O-N 2.92Å; V382-A385 PolarHBondContact O-N 2.9Å; I383-A385 PolarHBondContact O-N 3Å; A385-C388 PolarHBondContact O-N 3.43Å; A385-W389 PolarHBondContact O-N 3.35Å
386	F	96.5	Very high	94.1	Very high	87 Å²	87	46.1 Å²	46.1	38%	0.382	25%	0.245	S	C	.	.	H	α-helix	trans	-67.5	-42.5	177.7	-171.6	-129.8	0	0	0	112.3	V138 V382 I383 W389 L390	V138-F386 HydrophobicContact CB-CD1 4.23Å; V138-F386 HydrophobicContact CG1-CD1 3.35Å; V138-F386 HydrophobicContact CG1-CE1 3.72Å; V138-F386 HydrophobicContact CG1-CG 4.2Å; V138-F386 HydrophobicContact CG2-CD1 3.9Å; V138-F386 HydrophobicContact CG2-CE1 4.43Å; V382-F386 WeakPolarHBondContact O-CB 3.38Å; V382-F386 PolarHBondContact O-N 3.23Å; I383-F386 PolarHBondContact O-N 2.94Å; F386-W389 AromaticContact CD2-CE3 3.62Å; F386-W389 HydrophobicContact CD2-CE3 3.62Å; F386-W389 HydrophobicContact CD2-CZ3 4.05Å; F386-W389 AromaticContact CE2-CE3 3.41Å; F386-W389 HydrophobicContact CE2-CE3 3.41Å; F386-W389 VanDerWaalsContact CE2-CE3 3.41Å; F386-W389 AromaticContact CE2-CZ3 3.32Å; F386-W389 HydrophobicContact CE2-CZ3 3.32Å; F386-W389 HydrophobicContact CZ-CE3 4.4Å; F386-W389 HydrophobicContact CZ-CZ3 4.07Å; F386-W389 PolarHBondContact O-N 2.99Å; F386-L390 HydrophobicContact CE1-CD1 4.37Å; F386-L390 HydrophobicContact CZ-CD1 4.45Å; F386-L390 PolarHBondContact O-N 3.28Å
387	A	97.5	Very high	94.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-39	174.2	0	0	0	0	0	112.2	V138 T141 A142 L145 I383 G384 L390 G391	V138-A387 HydrophobicContact CG1-CB 4.18Å; T141-A387 HydrophobicContact CG2-CB 3.41Å; T141-A387 VanDerWaalsContact CG2-CB 3.41Å; A142-A387 WeakPolarHBondContact CA-O 3.42Å; A142-A387 HydrophobicContact CB-CB 4.33Å; A142-A387 VanDerWaalsContact CB-O 3.22Å; A142-A387 WeakPolarHBondContact CB-O 3.37Å; L145-A387 HydrophobicContact CD1-CB 4.21Å; I383-A387 WeakPolarHBondContact O-CB 2.93Å; I383-A387 PolarHBondContact O-N 2.73Å; G384-A387 PolarHBondContact O-N 3.24Å; A387-L390 PolarHBondContact O-N 3.24Å; A387-G391 PolarHBondContact O-N 3.48Å
388	C	97.2	Very high	94.6	Very high	13 Å²	13	41.3 Å²	41.3	9%	0.088	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-45.8	173.9	-178	0	0	0	0	111.1	L145 A168 G384 A385 L390 G391 I392	L145-C388 HydrophobicContact CD1-CB 4.12Å; A168-C388 HydrophobicContact CB-CB 3.92Å; G384-C388 WeakPolarHBondContact O-CB 3.46Å; G384-C388 PolarHBondContact O-N 2.95Å; A385-C388 PolarHBondContact O-N 3.43Å; C388-L390 PolarHBondContact O-N 2.97Å; C388-G391 PolarHBondContact O-N 3.22Å; C388-I392 VanDerWaalsContact O-CG1 3.31Å; C388-I392 WeakPolarHBondContact O-CG1 3.45Å; C388-I392 PolarHBondContact O-N 3.42Å
389	W	96.9	Very high	94.7	Very high	142 Å²	142	38.9 Å²	38.9	54%	0.538	21%	0.207	S	C	.	.	H	α-helix	trans	-58.9	-43.7	175.7	171.4	64.1	0	0	0	112.7	A385 F386 I392 S393	A385-W389 PolarHBondContact O-N 3.35Å; F386-W389 AromaticContact CD2-CE3 3.62Å; F386-W389 HydrophobicContact CD2-CE3 3.62Å; F386-W389 HydrophobicContact CD2-CZ3 4.05Å; F386-W389 AromaticContact CE2-CE3 3.41Å; F386-W389 HydrophobicContact CE2-CE3 3.41Å; F386-W389 VanDerWaalsContact CE2-CE3 3.41Å; F386-W389 AromaticContact CE2-CZ3 3.32Å; F386-W389 HydrophobicContact CE2-CZ3 3.32Å; F386-W389 HydrophobicContact CZ-CE3 4.4Å; F386-W389 HydrophobicContact CZ-CZ3 4.07Å; F386-W389 PolarHBondContact O-N 2.99Å; W389-I392 PolarHBondContact O-N 2.92Å; W389-S393 PolarHBondContact NE1-OG 2.9Å; W389-S393 VanDerWaalsContact O-CB 3.31Å; W389-S393 WeakPolarHBondContact O-CB 3.16Å; W389-S393 PolarHBondContact O-N 3.28Å; W389-S393 PolarHBondContact O-OG 2.93Å
390	L	96	Very high	94.8	Very high	15 Å²	15	38.4 Å²	38.4	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-66.7	-41	175.1	-72	-178.1	0	0	0	112.6	V138 F139 A142 F386 A387 C388 I392 S393 I394	V138-L390 HydrophobicContact CG1-CD1 3.6Å; F139-L390 HydrophobicContact CD1-CD1 3.9Å; F139-L390 HydrophobicContact CE1-CD1 3.8Å; A142-L390 HydrophobicContact CB-CB 3.78Å; F386-L390 HydrophobicContact CE1-CD1 4.37Å; F386-L390 HydrophobicContact CZ-CD1 4.45Å; F386-L390 PolarHBondContact O-N 3.28Å; A387-L390 PolarHBondContact O-N 3.24Å; C388-L390 PolarHBondContact O-N 2.97Å; L390-I392 PolarHBondContact O-N 3.01Å; L390-S393 PolarHBondContact O-N 3.33Å; L390-S393 VanDerWaalsContact O-N 3.1Å; L390-I394 HydrophobicContact CD2-CD1 4.33Å; L390-I394 PolarHBondContact O-N 3.21Å
391	G	96	Very high	95	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-29	177.2	0	0	0	0	0	113.3	I164 A387 C388	I164-G391 VanDerWaalsContact CD1-O 3.29Å; I164-G391 WeakPolarHBondContact CD1-O 3.42Å; A387-G391 PolarHBondContact O-N 3.48Å; C388-G391 PolarHBondContact O-N 3.22Å
392	I	95.4	Very high	95.1	Very high	47 Å²	47	34.4 Å²	34.4	24%	0.241	19%	0.186	C	C	.	.	H	α-helix	trans	-77.5	-38.4	172.6	-66.9	162.7	0	0	0	111	K161 I164 I165 C388 W389 L390	K161-I392 HydrophobicContact CG-CD1 4.18Å; K161-I392 HydrophobicContact CG-CG1 4.46Å; K161-I392 HydrophobicContact CG-CG2 4.11Å; I164-I392 HydrophobicContact CB-CG1 4.11Å; I164-I392 HydrophobicContact CD1-CG1 4.27Å; I164-I392 HydrophobicContact CG2-CG1 3.91Å; I165-I392 HydrophobicContact CD1-CD1 4.26Å; I165-I392 HydrophobicContact CG1-CD1 3.85Å; C388-I392 VanDerWaalsContact O-CG1 3.31Å; C388-I392 WeakPolarHBondContact O-CG1 3.45Å; C388-I392 PolarHBondContact O-N 3.42Å; W389-I392 PolarHBondContact O-N 2.92Å; L390-I392 PolarHBondContact O-N 3.01Å
393	S	93.6	Very high	95.1	Very high	68 Å²	68	29.8 Å²	29.8	48%	0.476	16%	0.158	S	C	.	.	H	α-helix	trans	-81.9	-25.1	-171	-58.4	0	0	0	0	113.1	W389 L390	W389-S393 PolarHBondContact NE1-OG 2.9Å; W389-S393 VanDerWaalsContact O-CB 3.31Å; W389-S393 WeakPolarHBondContact O-CB 3.16Å; W389-S393 PolarHBondContact O-N 3.28Å; W389-S393 PolarHBondContact O-OG 2.93Å; L390-S393 PolarHBondContact O-N 3.33Å; L390-S393 VanDerWaalsContact O-N 3.1Å
394	I	91.5	Very high	95.1	Very high	17 Å²	17	29.3 Å²	29.3	9%	0.087	16%	0.155	C	C	.	.			trans	-112.2	122.4	-178.8	-63.2	165.5	0	0	0	109.1	L390 L400 V448 L449	L390-I394 HydrophobicContact CD2-CD1 4.33Å; L390-I394 PolarHBondContact O-N 3.21Å; I394-L400 HydrophobicContact CB-CD1 4.13Å; I394-L400 HydrophobicContact CB-CD2 3.99Å; I394-L400 HydrophobicContact CB-CG 4.03Å; I394-L400 HydrophobicContact CD1-CD2 3.48Å; I394-L400 VanDerWaalsContact CD1-CD2 3.48Å; I394-L400 HydrophobicContact CD1-CG 4.4Å; I394-L400 HydrophobicContact CG1-CD2 4.31Å; I394-L400 HydrophobicContact CG2-CD1 4.16Å; I394-L400 HydrophobicContact CG2-CD2 4.02Å; I394-L400 HydrophobicContact CG2-CG 3.71Å; I394-V448 HydrophobicContact CG2-CG1 3.77Å; I394-L449 HydrophobicContact CD1-CD2 3.72Å
395	Q	87.7	Confident	95.2	Very high	83 Å²	83	29.2 Å²	29.2	39%	0.388	15%	0.154	S	C	.	.			trans	-82.4	-10.8	-171	-70	174	-7.6	0	0	114.5	P308 E309 K312	P308-Q395 HydrophobicContact CB-CB 4.46Å; E309-Q395 HydrophobicContact CG-CB 4.4Å; E309-Q395 HydrophobicContact CG-CG 3.92Å; E309-Q395 PolarHBondContact OE1-NE2 2.82Å; K312-Q395 WeakPolarHBondContact CD-O 3.42Å
396	S	93.4	Very high	95.3	Very high	32 Å²	32	26.6 Å²	26.6	22%	0.224	13%	0.132	C	C	.	.			trans	-105.5	123.3	179.8	-177.9	0	0	0	0	112.1	E72 Y398 G399 L400	E72-S396 VanDerWaalsContact OE1-CA 3.29Å; E72-S396 WeakPolarHBondContact OE1-CA 3.4Å; E72-S396 WeakPolarHBondContact OE1-CB 3.49Å; E72-S396 PolarHBondContact OE1-OG 2.88Å; S396-Y398 PolarHBondContact OG-N 3.48Å; S396-G399 PolarHBondContact OG-N 3.47Å; S396-L400 WeakPolarHBondContact O-CG 3.43Å; S396-L400 PolarHBondContact O-N 3.34Å
397	I	95.5	Very high	95.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69.8	-45.5	173.2	-63.9	164	0	0	0	108.5	N68 E72 A143 A147 A150 K312 L400 W401	N68-I397 HydrophobicContact CB-CD1 3.86Å; N68-I397 HydrophobicContact CB-CG2 4.44Å; E72-I397 WeakPolarHBondContact OE2-CA 3.09Å; E72-I397 VanDerWaalsContact OE2-CB 3.25Å; E72-I397 WeakPolarHBondContact OE2-CB 3.25Å; E72-I397 PolarHBondContact OE2-N 2.81Å; A143-I397 HydrophobicContact CB-CG2 4.28Å; A143-I397 WeakPolarHBondContact CB-O 3.25Å; A147-I397 HydrophobicContact CB-CD1 3.93Å; A147-I397 HydrophobicContact CB-CG1 4.47Å; A147-I397 HydrophobicContact CB-CG2 4.13Å; A150-I397 HydrophobicContact CB-CD1 4.27Å; K312-I397 HydrophobicContact CB-CD1 3.79Å; K312-I397 HydrophobicContact CB-CG1 4.15Å; K312-I397 HydrophobicContact CG-CD1 4.43Å; I397-L400 PolarHBondContact O-N 3.09Å; I397-W401 WeakPolarHBondContact O-CB 3.25Å; I397-W401 PolarHBondContact O-N 3.41Å
398	Y	95.7	Very high	95.4	Very high	13 Å²	13	23.9 Å²	23.9	5%	0.051	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-43.8	178	-169.7	-97.6	0	0	0	111.9	G69 E72 N73 W83 C84 Q85 A86 S396 L400 W401 Y402	G69-Y398 WeakPolarHBondContact O-CD2 3.14Å; E72-Y398 PolarHBondContact OE2-N 3.07Å; N73-Y398 HydrophobicContact CB-CD1 3.98Å; N73-Y398 HydrophobicContact CB-CD2 3.82Å; N73-Y398 HydrophobicContact CB-CE1 4.28Å; N73-Y398 HydrophobicContact CB-CE2 4.13Å; N73-Y398 HydrophobicContact CB-CG 3.72Å; N73-Y398 WeakPolarHBondContact OD1-CD1 3.27Å; N73-Y398 VanDerWaalsContact OD1-CE1 3.29Å; N73-Y398 WeakPolarHBondContact OD1-CE1 3.35Å; W83-Y398 PolarHBondContact O-OH 3.48Å; C84-Y398 WeakPolarHBondContact CA-OH 3.22Å; Q85-Y398 PolarHBondContact N-OH 3.42Å; A86-Y398 HydrophobicContact CB-CE2 3.78Å; A86-Y398 PolarHBondContact N-OH 3.28Å; A86-Y398 VanDerWaalsContact N-OH 3.11Å; S396-Y398 PolarHBondContact OG-N 3.48Å; Y398-L400 PolarHBondContact O-N 2.89Å; Y398-W401 AromaticContact CD2-CE3 3.92Å; Y398-W401 HydrophobicContact CD2-CE3 3.92Å; Y398-W401 HydrophobicContact CD2-CZ3 4.21Å; Y398-W401 HydrophobicContact CE2-CE3 4.04Å; Y398-W401 AromaticContact CE2-CZ3 4Å; Y398-W401 HydrophobicContact CE2-CZ3 4Å; Y398-W401 CarbonylContact O-C 3.53Å; Y398-W401 PolarHBondContact O-N 2.89Å; Y398-W401 VanDerWaalsContact O-N 3.16Å; Y398-Y402 VanDerWaalsContact O-CB 3.26Å; Y398-Y402 WeakPolarHBondContact O-CB 3.42Å; Y398-Y402 PolarHBondContact O-N 3.42Å
399	G	95	Very high	95.4	Very high	6 Å²	6	23.3 Å²	23.3	6%	0.062	12%	0.118	C	C	.	.	H	α-helix	trans	-59.3	-43.4	177.8	0	0	0	0	0	113.3	S396 Y402 L403	S396-G399 PolarHBondContact OG-N 3.47Å; G399-Y402 PolarHBondContact O-N 3.27Å; G399-L403 VanDerWaalsContact O-CB 3.27Å; G399-L403 WeakPolarHBondContact O-CB 3.25Å; G399-L403 PolarHBondContact O-N 3.4Å
400	L	95.8	Very high	95.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.8	-43.8	173.7	-76.9	167.4	0	0	0	112.1	F139 A142 A143 I394 S396 I397 Y398 Y402 L403 C404	F139-L400 HydrophobicContact CD1-CD2 3.97Å; A142-L400 HydrophobicContact CB-CD1 3.99Å; A142-L400 HydrophobicContact CB-CD2 3.98Å; A143-L400 HydrophobicContact CB-CB 3.61Å; I394-L400 HydrophobicContact CB-CD1 4.13Å; I394-L400 HydrophobicContact CB-CD2 3.99Å; I394-L400 HydrophobicContact CB-CG 4.03Å; I394-L400 HydrophobicContact CD1-CD2 3.48Å; I394-L400 VanDerWaalsContact CD1-CD2 3.48Å; I394-L400 HydrophobicContact CD1-CG 4.4Å; I394-L400 HydrophobicContact CG1-CD2 4.31Å; I394-L400 HydrophobicContact CG2-CD1 4.16Å; I394-L400 HydrophobicContact CG2-CD2 4.02Å; I394-L400 HydrophobicContact CG2-CG 3.71Å; S396-L400 WeakPolarHBondContact O-CG 3.43Å; S396-L400 PolarHBondContact O-N 3.34Å; I397-L400 PolarHBondContact O-N 3.09Å; Y398-L400 PolarHBondContact O-N 2.89Å; L400-Y402 VanDerWaalsContact C-N 3.3Å; L400-Y402 PolarHBondContact O-N 3.26Å; L400-L403 PolarHBondContact O-N 3.02Å; L400-C404 PolarHBondContact O-N 3.5Å
401	W	96.5	Very high	95.6	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-71.4	-25.2	178.9	-178.2	39.8	0	0	0	113.5	G65 Y66 A86 P87 Y90 W140 A143 I397 Y398 C404	G65-W401 VanDerWaalsContact C-CD2 3.44Å; G65-W401 VanDerWaalsContact O-CZ3 3.27Å; G65-W401 WeakPolarHBondContact O-CZ3 3.37Å; Y66-W401 VanDerWaalsContact CA-CH2 3.44Å; Y66-W401 AromaticContact CD2-CH2 3.42Å; Y66-W401 HydrophobicContact CD2-CH2 3.42Å; Y66-W401 VanDerWaalsContact CD2-CH2 3.42Å; Y66-W401 AromaticContact CD2-CZ2 3.32Å; Y66-W401 HydrophobicContact CD2-CZ2 3.32Å; Y66-W401 AromaticContact CE2-CH2 3.97Å; Y66-W401 HydrophobicContact CE2-CH2 3.97Å; Y66-W401 HydrophobicContact CE2-CZ2 4.04Å; Y66-W401 AromaticContact CG-CH2 3.79Å; Y66-W401 HydrophobicContact CG-CH2 3.79Å; Y66-W401 AromaticContact CG-CZ2 3.97Å; Y66-W401 HydrophobicContact CG-CZ2 3.97Å; A86-W401 HydrophobicContact CB-CD2 4.27Å; A86-W401 HydrophobicContact CB-CE3 3.75Å; A86-W401 HydrophobicContact CB-CH2 3.62Å; A86-W401 HydrophobicContact CB-CZ2 4.13Å; A86-W401 HydrophobicContact CB-CZ3 3.42Å; A86-W401 VanDerWaalsContact CB-CZ3 3.42Å; P87-W401 HydrophobicContact CG-CH2 3.93Å; P87-W401 HydrophobicContact CG-CZ3 4.13Å; Y90-W401 AromaticContact CD2-CE2 3.68Å; Y90-W401 HydrophobicContact CD2-CH2 4.14Å; Y90-W401 AromaticContact CD2-CZ2 3.34Å; Y90-W401 HydrophobicContact CD2-CZ2 3.34Å; Y90-W401 AromaticContact CD2-NE1 3.82Å; Y90-W401 HydrophobicContact CE2-CD2 4.2Å; Y90-W401 AromaticContact CE2-CE2 3.45Å; Y90-W401 VanDerWaalsContact CE2-CE2 3.45Å; Y90-W401 AromaticContact CE2-CZ2 3.63Å; Y90-W401 HydrophobicContact CE2-CZ2 3.63Å; Y90-W401 AromaticContact CE2-NE1 3.32Å; Y90-W401 VanDerWaalsContact CE2-NE1 3.32Å; Y90-W401 PolarHBondContact OH-O 2.62Å; W140-W401 AromaticContact CD1-CD1 3.44Å; W140-W401 VanDerWaalsContact CD1-CD1 3.44Å; W140-W401 AromaticContact NE1-CD1 3.69Å; W140-W401 AromaticContact NE1-NE1 3.8Å; A143-W401 HydrophobicContact CB-CB 3.92Å; I397-W401 WeakPolarHBondContact O-CB 3.25Å; I397-W401 PolarHBondContact O-N 3.41Å; Y398-W401 AromaticContact CD2-CE3 3.92Å; Y398-W401 HydrophobicContact CD2-CE3 3.92Å; Y398-W401 HydrophobicContact CD2-CZ3 4.21Å; Y398-W401 HydrophobicContact CE2-CE3 4.04Å; Y398-W401 AromaticContact CE2-CZ3 4Å; Y398-W401 HydrophobicContact CE2-CZ3 4Å; Y398-W401 CarbonylContact O-C 3.53Å; Y398-W401 PolarHBondContact O-N 2.89Å; Y398-W401 VanDerWaalsContact O-N 3.16Å; W401-C404 VanDerWaalsContact C-SG 3.58Å; W401-C404 PolarHBondContact O-SG 3.28Å
402	Y	94.6	Very high	95.7	Very high	23 Å²	23	16 Å²	16	9%	0.09	9%	0.089	C	C	.	.	H	α-helix	trans	-72	-49.2	170.6	164.9	-93.8	0	0	0	110.5	N236 M239 L240 Y398 G399 L400 C404 S405 K474	N236-Y402 HydrophobicContact CB-CE2 3.94Å; N236-Y402 PolarHBondContact OD1-OH 3.46Å; M239-Y402 HydrophobicContact CE-CD1 4.29Å; M239-Y402 HydrophobicContact CE-CD2 3.57Å; M239-Y402 HydrophobicContact CE-CE1 3.88Å; M239-Y402 HydrophobicContact CE-CE2 3.07Å; M239-Y402 HydrophobicContact CE-CG 4.14Å; L240-Y402 HydrophobicContact CD1-CD2 4.32Å; L240-Y402 HydrophobicContact CD2-CD2 4.12Å; L240-Y402 HydrophobicContact CG-CD2 4.41Å; Y398-Y402 VanDerWaalsContact O-CB 3.26Å; Y398-Y402 WeakPolarHBondContact O-CB 3.42Å; Y398-Y402 PolarHBondContact O-N 3.42Å; G399-Y402 PolarHBondContact O-N 3.27Å; L400-Y402 VanDerWaalsContact C-N 3.3Å; L400-Y402 PolarHBondContact O-N 3.26Å; Y402-C404 VanDerWaalsContact C-N 3.28Å; Y402-C404 PolarHBondContact O-N 2.97Å; Y402-S405 PolarHBondContact O-N 2.85Å; Y402-S405 PolarHBondContact O-OG 3.09Å; Y402-K474 WeakPolarHBondContact OH-CE 3.44Å
403	L	95.3	Very high	95.9	Very high	7 Å²	7	14.3 Å²	14.3	4%	0.037	8%	0.08	C	C	.	.	H	α-helix	trans	-64.9	-26.2	-173.2	-173.4	63.1	0	0	0	114.2	F139 G399 L400 S405 D406 E446 L449	F139-L403 HydrophobicContact CD1-CD2 3.74Å; F139-L403 HydrophobicContact CD1-CG 4.32Å; F139-L403 HydrophobicContact CD2-CD2 4.14Å; F139-L403 HydrophobicContact CD2-CG 3.94Å; F139-L403 HydrophobicContact CE1-CD2 3.45Å; F139-L403 VanDerWaalsContact CE1-CD2 3.45Å; F139-L403 HydrophobicContact CE1-CG 4.3Å; F139-L403 HydrophobicContact CE2-CD2 3.87Å; F139-L403 HydrophobicContact CE2-CG 3.9Å; F139-L403 HydrophobicContact CG-CB 4.47Å; F139-L403 HydrophobicContact CG-CD2 4.1Å; F139-L403 HydrophobicContact CG-CG 4.17Å; F139-L403 HydrophobicContact CZ-CD2 3.52Å; F139-L403 HydrophobicContact CZ-CG 4.1Å; G399-L403 VanDerWaalsContact O-CB 3.27Å; G399-L403 WeakPolarHBondContact O-CB 3.25Å; G399-L403 PolarHBondContact O-N 3.4Å; L400-L403 PolarHBondContact O-N 3.02Å; L403-S405 PolarHBondContact O-N 3.21Å; L403-S405 VanDerWaalsContact O-N 3.12Å; L403-D406 HydrophobicContact CD1-CB 4.07Å; L403-D406 VanDerWaalsContact O-CB 3.3Å; L403-D406 WeakPolarHBondContact O-CB 3.45Å; L403-D406 PolarHBondContact O-N 3.2Å; L403-E446 HydrophobicContact CD1-CG 3.88Å; L403-L449 HydrophobicContact CD2-CD1 3.88Å; L403-L449 HydrophobicContact CD2-CD2 3.62Å; L403-L449 HydrophobicContact CD2-CG 3.64Å
404	C	96.2	Very high	96.1	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.007	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.6	178	62.1	0	0	0	0	114.5	Y90 G136 F139 W140 W247 L400 W401 Y402 V408	Y90-C404 PolarHBondContact OH-SG 3.03Å; G136-C404 WeakPolarHBondContact CA-O 3.34Å; G136-C404 WeakPolarHBondContact O-CB 3.41Å; F139-C404 HydrophobicContact CB-CB 3.72Å; W140-C404 HydrophobicContact CB-CB 3.89Å; W247-C404 HydrophobicContact CH2-CB 3.94Å; W247-C404 WeakPolarHBondContact CH2-SG 3.29Å; W247-C404 HydrophobicContact CZ2-CB 4.29Å; L400-C404 PolarHBondContact O-N 3.5Å; W401-C404 VanDerWaalsContact C-SG 3.58Å; W401-C404 PolarHBondContact O-SG 3.28Å; Y402-C404 VanDerWaalsContact C-N 3.28Å; Y402-C404 PolarHBondContact O-N 2.97Å; C404-V408 VanDerWaalsContact O-CG2 3.32Å; C404-V408 WeakPolarHBondContact O-CG2 3.29Å
405	S	96.8	Very high	96.4	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-8.5	176.5	63.5	0	0	0	0	114.4	Y90 M239 Y402 L403 Y409	Y90-S405 WeakPolarHBondContact OH-CB 3.39Å; Y90-S405 PolarHBondContact OH-OG 3.24Å; M239-S405 WeakPolarHBondContact CE-OG 3.34Å; Y402-S405 PolarHBondContact O-N 2.85Å; Y402-S405 PolarHBondContact O-OG 3.09Å; L403-S405 PolarHBondContact O-N 3.21Å; L403-S405 VanDerWaalsContact O-N 3.12Å; S405-Y409 WeakPolarHBondContact O-CB 3.3Å; S405-Y409 PolarHBondContact O-N 3.48Å
406	D	97.5	Very high	96.9	Very high	4 Å²	4	6.4 Å²	6.4	2%	0.021	4%	0.035	C	C	.	.	H	α-helix	trans	-68.3	-67.7	-165.6	-167.4	-41.7	0	0	0	113.6	M239 L403 V408 Y409 V410 R441 K474	M239-D406 VanDerWaalsContact SD-CA 3.54Å; M239-D406 HydrophobicContact SD-CB 3.8Å; L403-D406 HydrophobicContact CD1-CB 4.07Å; L403-D406 VanDerWaalsContact O-CB 3.3Å; L403-D406 WeakPolarHBondContact O-CB 3.45Å; L403-D406 PolarHBondContact O-N 3.2Å; D406-V408 PolarHBondContact O-N 3.07Å; D406-Y409 WeakPolarHBondContact O-CB 3.49Å; D406-Y409 PolarHBondContact O-N 2.81Å; D406-Y409 VanDerWaalsContact O-N 3.11Å; D406-V410 WeakPolarHBondContact O-CG2 3.13Å; D406-V410 PolarHBondContact O-N 2.64Å; D406-R441 VanDerWaalsContact CG-NE 3.26Å; D406-R441 WeakPolarHBondContact OD1-CD 3.31Å; D406-R441 IonicContact OD1-CZ 2.77Å; D406-R441 IonicContact OD1-NE 3.95Å; D406-R441 PolarHBondContact OD1-NE 3.46Å; D406-R441 IonicContact OD1-NH2 2.99Å; D406-R441 IonicContact OD2-CZ 3.78Å; D406-R441 VanDerWaalsContact OD2-CZ 3.22Å; D406-R441 IonicContact OD2-NE 3.79Å; D406-R441 PolarHBondContact OD2-NE 2.86Å; D406-R441 IonicContact OD2-NH2 3.34Å; D406-R441 PolarHBondContact OD2-NH2 3.11Å; D406-K474 VanDerWaalsContact OD2-CE 3.29Å; D406-K474 WeakPolarHBondContact OD2-CE 3.26Å
407	L	97.3	Very high	97.1	Very high	28 Å²	28	6.8 Å²	6.8	15%	0.147	3%	0.034	C	C	.	.	H	α-helix	trans	-67.4	-23.9	177.9	-64.7	-178.9	0	0	0	112.1	P132 L135 I411 L438 R441	P132-L407 HydrophobicContact CB-CB 3.85Å; L135-L407 HydrophobicContact CD1-CD1 3.56Å; L407-I411 HydrophobicContact CD2-CD1 4.35Å; L407-I411 VanDerWaalsContact O-CB 3.3Å; L407-I411 WeakPolarHBondContact O-CB 3.46Å; L407-I411 PolarHBondContact O-N 3.46Å; L407-L438 HydrophobicContact CD1-CD1 4.47Å; L407-L438 HydrophobicContact CD2-CD1 4.05Å; L407-R441 HydrophobicContact CD2-CG 4.03Å
408	V	98.3	Very high	97.2	Very high	3 Å²	3	6.8 Å²	6.8	2%	0.018	3%	0.034	C	C	.	.	I	π-helix	trans	-65.6	-43.5	173.7	178.8	0	0	0	0	110	P132 G243 P246 C404 D406 L412 F413	P132-V408 WeakPolarHBondContact O-CG2 3.34Å; G243-V408 WeakPolarHBondContact O-CG1 3.26Å; P246-V408 HydrophobicContact CB-CG1 4.47Å; P246-V408 HydrophobicContact CG-CG1 3.55Å; C404-V408 VanDerWaalsContact O-CG2 3.32Å; C404-V408 WeakPolarHBondContact O-CG2 3.29Å; D406-V408 PolarHBondContact O-N 3.07Å; V408-L412 HydrophobicContact CG1-CB 4.5Å; V408-L412 HydrophobicContact CG1-CD1 4.33Å; V408-L412 HydrophobicContact CG2-CD1 4.37Å; V408-L412 CarbonylContact O-C 3.54Å; V408-L412 WeakPolarHBondContact O-CA 3.3Å; V408-L412 VanDerWaalsContact O-CB 3.3Å; V408-L412 WeakPolarHBondContact O-CB 3.26Å; V408-L412 PolarHBondContact O-N 3.17Å; V408-F413 PolarHBondContact O-N 3.45Å
409	Y	98.6	Very high	97.2	Very high	1 Å²	1	6.8 Å²	6.8	0%	0.004	4%	0.035	C	C	.	.	I	π-helix	trans	-68.1	-50.8	173.3	172.6	-128.3	0	0	0	112.3	M239 F242 S405 D406 I411 F413 P414 K474 T475 M478	M239-Y409 HydrophobicContact CB-CD1 3.58Å; M239-Y409 HydrophobicContact CB-CE1 3.96Å; M239-Y409 HydrophobicContact CB-CG 4.09Å; M239-Y409 HydrophobicContact CG-CD1 3.65Å; M239-Y409 HydrophobicContact CG-CG 3.96Å; F242-Y409 HydrophobicContact CB-CD2 3.6Å; F242-Y409 HydrophobicContact CB-CE2 3.62Å; F242-Y409 AromaticContact CD2-CE2 4Å; F242-Y409 HydrophobicContact CD2-CE2 4Å; F242-Y409 HydrophobicContact CG-CE2 4.28Å; S405-Y409 WeakPolarHBondContact O-CB 3.3Å; S405-Y409 PolarHBondContact O-N 3.48Å; D406-Y409 WeakPolarHBondContact O-CB 3.49Å; D406-Y409 PolarHBondContact O-N 2.81Å; D406-Y409 VanDerWaalsContact O-N 3.11Å; Y409-I411 PolarHBondContact O-N 3.49Å; Y409-F413 HydrophobicContact CD2-CD1 4.32Å; Y409-F413 HydrophobicContact CE2-CD1 4.37Å; Y409-F413 WeakPolarHBondContact O-CB 3.37Å; Y409-P414 VanDerWaalsContact O-CD 3.28Å; Y409-P414 WeakPolarHBondContact O-CD 3.44Å; Y409-K474 HydrophobicContact CD1-CB 4.19Å; Y409-K474 HydrophobicContact CE1-CB 4.07Å; Y409-T475 WeakPolarHBondContact OH-CB 3.18Å; Y409-T475 PolarHBondContact OH-OG1 3.04Å; Y409-M478 HydrophobicContact CD1-CB 4.4Å; Y409-M478 HydrophobicContact CD2-CG 4.03Å; Y409-M478 HydrophobicContact CE1-CB 4.04Å; Y409-M478 HydrophobicContact CE1-CG 4.46Å; Y409-M478 HydrophobicContact CE2-CB 4.17Å; Y409-M478 HydrophobicContact CE2-CE 3.83Å; Y409-M478 HydrophobicContact CE2-CG 3.69Å; Y409-M478 HydrophobicContact CE2-SD 4.45Å; Y409-M478 WeakPolarHBondContact O-CG 3.39Å; Y409-M478 WeakPolarHBondContact OH-CE 3.31Å
410	V	98.4	Very high	97.2	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.036	C	C	.	.	I	π-helix	trans	-66.2	-41.3	-173.8	172.9	0	0	0	0	111.9	D406 P414 R441 A477 S481	D406-V410 WeakPolarHBondContact O-CG2 3.13Å; D406-V410 PolarHBondContact O-N 2.64Å; V410-P414 WeakPolarHBondContact O-CG 3.45Å; V410-R441 HydrophobicContact CG1-CB 4.05Å; V410-R441 HydrophobicContact CG2-CB 4.32Å; V410-R441 HydrophobicContact CG2-CG 4.11Å; V410-A477 HydrophobicContact CG1-CB 3.63Å; V410-A477 HydrophobicContact CG2-CB 4.18Å; V410-S481 WeakPolarHBondContact O-CB 3.27Å; V410-S481 PolarHBondContact O-OG 3.3Å
411	I	98.4	Very high	97.1	Very high	2 Å²	2	10.2 Å²	10.2	1%	0.01	5%	0.048	C	C	.	.	I	π-helix	trans	-106.6	-54	-170.7	-57.1	176.5	0	0	0	111.1	L129 P132 L407 Y409 P414 Q415 Y434 L438	L129-I411 HydrophobicContact CD2-CG2 4.04Å; P132-I411 HydrophobicContact CB-CB 4.5Å; P132-I411 HydrophobicContact CB-CD1 4.45Å; P132-I411 HydrophobicContact CG-CB 4.37Å; P132-I411 HydrophobicContact CG-CG2 4.15Å; L407-I411 HydrophobicContact CD2-CD1 4.35Å; L407-I411 VanDerWaalsContact O-CB 3.3Å; L407-I411 WeakPolarHBondContact O-CB 3.46Å; L407-I411 PolarHBondContact O-N 3.46Å; Y409-I411 PolarHBondContact O-N 3.49Å; I411-P414 WeakPolarHBondContact O-CD 3.49Å; I411-P414 WeakPolarHBondContact O-CG 3.4Å; I411-Q415 WeakPolarHBondContact O-CB 3.09Å; I411-Q415 WeakPolarHBondContact O-CG 3.49Å; I411-Y434 HydrophobicContact CD1-CD2 4.48Å; I411-Y434 HydrophobicContact CD1-CE2 4.42Å; I411-Y434 HydrophobicContact CG2-CD2 3.59Å; I411-Y434 HydrophobicContact CG2-CE2 4.18Å; I411-Y434 HydrophobicContact CG2-CG 4.38Å; I411-L438 HydrophobicContact CD1-CB 3.99Å; I411-L438 HydrophobicContact CD1-CD1 4.06Å
412	L	98.3	Very high	97	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.053	C	C	.	.	I	π-helix	trans	-77	-37.2	-168.9	-67.2	178	0	0	0	113.6	L129 P132 A133 P246 V408 Q415 L416	L129-L412 HydrophobicContact CB-CD2 3.99Å; L129-L412 HydrophobicContact CD2-CD2 3.95Å; L129-L412 WeakPolarHBondContact O-CD2 3.18Å; P132-L412 HydrophobicContact CB-CD1 4.28Å; P132-L412 HydrophobicContact CB-CG 4.18Å; P132-L412 HydrophobicContact CG-CD1 4.17Å; P132-L412 HydrophobicContact CG-CD2 3.94Å; P132-L412 HydrophobicContact CG-CG 3.84Å; A133-L412 HydrophobicContact CB-CD1 3.67Å; P246-L412 HydrophobicContact CB-CB 3.87Å; P246-L412 HydrophobicContact CG-CB 3.85Å; V408-L412 HydrophobicContact CG1-CB 4.5Å; V408-L412 HydrophobicContact CG1-CD1 4.33Å; V408-L412 HydrophobicContact CG2-CD1 4.37Å; V408-L412 CarbonylContact O-C 3.54Å; V408-L412 WeakPolarHBondContact O-CA 3.3Å; V408-L412 VanDerWaalsContact O-CB 3.3Å; V408-L412 WeakPolarHBondContact O-CB 3.26Å; V408-L412 PolarHBondContact O-N 3.17Å; L412-Q415 CarbonylContact O-C 3.59Å; L412-Q415 PolarHBondContact O-N 3.08Å; L412-L416 WeakPolarHBondContact O-CB 3.49Å; L412-L416 PolarHBondContact O-N 2.87Å
413	F	98.6	Very high	96.8	Very high	13 Å²	13	19.3 Å²	19.3	6%	0.057	8%	0.084	C	C	.	.	H	α-helix	trans	-59.8	-53	-179.5	177.8	-112	0	0	0	113.3	F101 F242 I245 P246 V408 Y409 Q415 L416 I417 M478	F101-F413 HydrophobicContact CZ-CE2 4.2Å; F242-F413 HydrophobicContact CB-CD1 3.81Å; F242-F413 HydrophobicContact CB-CD2 4.04Å; F242-F413 HydrophobicContact CB-CE1 3.71Å; F242-F413 HydrophobicContact CB-CE2 3.97Å; F242-F413 HydrophobicContact CB-CG 3.96Å; F242-F413 HydrophobicContact CB-CZ 3.78Å; F242-F413 AromaticContact CD1-CE1 3.87Å; F242-F413 HydrophobicContact CD1-CE1 3.87Å; F242-F413 AromaticContact CD1-CE2 3.76Å; F242-F413 HydrophobicContact CD1-CE2 3.76Å; F242-F413 AromaticContact CD1-CZ 3.28Å; F242-F413 HydrophobicContact CD1-CZ 3.28Å; F242-F413 HydrophobicContact CD2-CE1 4.36Å; F242-F413 AromaticContact CE1-CZ 3.97Å; F242-F413 HydrophobicContact CE1-CZ 3.97Å; F242-F413 HydrophobicContact CG-CD1 4.34Å; F242-F413 AromaticContact CG-CE1 3.73Å; F242-F413 HydrophobicContact CG-CE1 3.73Å; F242-F413 HydrophobicContact CG-CE2 4.19Å; F242-F413 AromaticContact CG-CZ 3.64Å; F242-F413 HydrophobicContact CG-CZ 3.64Å; F242-F413 WeakPolarHBondContact O-CD2 3.37Å; I245-F413 HydrophobicContact CB-CD2 4.48Å; I245-F413 HydrophobicContact CD1-CD2 4.42Å; I245-F413 HydrophobicContact CD1-CE2 3.83Å; P246-F413 HydrophobicContact CG-CB 4.03Å; V408-F413 PolarHBondContact O-N 3.45Å; Y409-F413 HydrophobicContact CD2-CD1 4.32Å; Y409-F413 HydrophobicContact CE2-CD1 4.37Å; Y409-F413 WeakPolarHBondContact O-CB 3.37Å; F413-Q415 PolarHBondContact O-N 3.33Å; F413-L416 WeakPolarHBondContact O-CB 3.38Å; F413-L416 PolarHBondContact O-N 3.48Å; F413-L416 VanDerWaalsContact O-N 3.11Å; F413-I417 HydrophobicContact CD1-CD1 4.21Å; F413-I417 HydrophobicContact CE1-CD1 3.66Å; F413-I417 HydrophobicContact CE2-CD1 4.09Å; F413-I417 HydrophobicContact CE2-CG1 4.34Å; F413-I417 HydrophobicContact CZ-CD1 3.6Å; F413-I417 HydrophobicContact CZ-CG1 4.33Å; F413-I417 PolarHBondContact O-N 2.84Å; F413-I417 VanDerWaalsContact O-N 3.08Å; F413-M478 HydrophobicContact CD1-CG 4.32Å; F413-M478 HydrophobicContact CD1-SD 4.18Å; F413-M478 HydrophobicContact CE1-SD 4.49Å
414	P	98.4	Very high	96.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-33.7	178.2	24.6	-34.2	0	0	0	112	Y409 V410 I411 I417 C418 M478 F482	Y409-P414 VanDerWaalsContact O-CD 3.28Å; Y409-P414 WeakPolarHBondContact O-CD 3.44Å; V410-P414 WeakPolarHBondContact O-CG 3.45Å; I411-P414 WeakPolarHBondContact O-CD 3.49Å; I411-P414 WeakPolarHBondContact O-CG 3.4Å; P414-I417 PolarHBondContact O-N 2.94Å; P414-C418 WeakPolarHBondContact O-CB 3.37Å; P414-C418 PolarHBondContact O-N 3.35Å; P414-C418 PolarHBondContact O-SG 3.42Å; P414-M478 HydrophobicContact CG-CG 4.3Å; P414-F482 HydrophobicContact CB-CB 3.67Å; P414-F482 HydrophobicContact CB-CD2 3.82Å; P414-F482 HydrophobicContact CB-CG 4.19Å
415	Q	98.1	Very high	96.6	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.009	10%	0.095	C	C	.	.	H	α-helix	trans	-67	-39.2	175	-63.7	-91.5	12	0	0	111.6	F117 Y121 L129 I411 L412 F413 C418 V419 S430 S433	F117-Q415 HydrophobicContact CD1-CB 4.14Å; F117-Q415 HydrophobicContact CE1-CB 3.56Å; Y121-Q415 VanDerWaalsContact CE2-OE1 3.23Å; L129-Q415 HydrophobicContact CD2-CG 4Å; I411-Q415 WeakPolarHBondContact O-CB 3.09Å; I411-Q415 WeakPolarHBondContact O-CG 3.49Å; L412-Q415 CarbonylContact O-C 3.59Å; L412-Q415 PolarHBondContact O-N 3.08Å; F413-Q415 PolarHBondContact O-N 3.33Å; Q415-C418 WeakPolarHBondContact O-CB 3.11Å; Q415-C418 PolarHBondContact O-N 2.92Å; Q415-C418 VanDerWaalsContact O-N 3.17Å; Q415-V419 WeakPolarHBondContact O-CG1 3.07Å; Q415-V419 WeakPolarHBondContact O-CG2 3.34Å; Q415-V419 PolarHBondContact O-N 3.01Å; Q415-S430 VanDerWaalsContact CD-OG 3.29Å; Q415-S430 PolarHBondContact NE2-O 3.32Å; Q415-S430 PolarHBondContact NE2-OG 3.46Å; Q415-S430 PolarHBondContact OE1-OG 3.4Å; Q415-S433 PolarHBondContact NE2-OG 3.42Å
416	L	98	Very high	96.6	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.7	-45.4	176.9	-176.6	62	0	0	0	110.7	F101 F117 I245 P246 F251 L412 F413 C418 V419 L420	F101-L416 HydrophobicContact CD1-CD2 3.66Å; F101-L416 HydrophobicContact CD1-CG 3.96Å; F101-L416 HydrophobicContact CE1-CD2 3.74Å; F101-L416 HydrophobicContact CE1-CG 3.84Å; F101-L416 HydrophobicContact CG-CD2 4.46Å; F117-L416 HydrophobicContact CE1-CB 4.43Å; F117-L416 HydrophobicContact CE2-CD1 3.87Å; F117-L416 HydrophobicContact CZ-CB 3.83Å; F117-L416 HydrophobicContact CZ-CD1 3.82Å; F117-L416 HydrophobicContact CZ-CG 4.42Å; I245-L416 HydrophobicContact CG2-CD2 4Å; P246-L416 HydrophobicContact CB-CB 4.27Å; P246-L416 HydrophobicContact CB-CD2 3.79Å; F251-L416 HydrophobicContact CE2-CD2 4.09Å; F251-L416 HydrophobicContact CZ-CD2 4.22Å; L412-L416 WeakPolarHBondContact O-CB 3.49Å; L412-L416 PolarHBondContact O-N 2.87Å; F413-L416 WeakPolarHBondContact O-CB 3.38Å; F413-L416 PolarHBondContact O-N 3.48Å; F413-L416 VanDerWaalsContact O-N 3.11Å; L416-C418 VanDerWaalsContact C-N 3.31Å; L416-C418 PolarHBondContact O-N 2.97Å; L416-V419 HydrophobicContact CD1-CG2 4.26Å; L416-V419 VanDerWaalsContact O-CG2 3.27Å; L416-V419 WeakPolarHBondContact O-CG2 3.5Å; L416-V419 PolarHBondContact O-N 3.38Å; L416-L420 HydrophobicContact CD1-CD1 3.8Å; L416-L420 HydrophobicContact CD1-CG 4.22Å; L416-L420 HydrophobicContact CG-CD1 4.13Å; L416-L420 WeakPolarHBondContact O-CG 3.42Å; L416-L420 PolarHBondContact O-N 3.43Å
417	I	98	Very high	96.5	Very high	40 Å²	40	22.1 Å²	22.1	21%	0.205	10%	0.097	C	C	.	.	H	α-helix	trans	-57.7	-48.6	173.2	-64.2	170.9	0	0	0	109.6	F101 F413 P414 V419 L420 Y421 F482	F101-I417 HydrophobicContact CZ-CG1 4.29Å; F413-I417 HydrophobicContact CD1-CD1 4.21Å; F413-I417 HydrophobicContact CE1-CD1 3.66Å; F413-I417 HydrophobicContact CE2-CD1 4.09Å; F413-I417 HydrophobicContact CE2-CG1 4.34Å; F413-I417 HydrophobicContact CZ-CD1 3.6Å; F413-I417 HydrophobicContact CZ-CG1 4.33Å; F413-I417 PolarHBondContact O-N 2.84Å; F413-I417 VanDerWaalsContact O-N 3.08Å; P414-I417 PolarHBondContact O-N 2.94Å; I417-V419 PolarHBondContact O-N 2.69Å; I417-L420 PolarHBondContact O-N 2.93Å; I417-Y421 HydrophobicContact CG2-CD2 4.33Å; I417-Y421 PolarHBondContact O-N 2.98Å; I417-F482 HydrophobicContact CB-CE2 4.11Å; I417-F482 HydrophobicContact CG2-CE2 3.69Å; I417-F482 HydrophobicContact CG2-CZ 4.07Å
418	C	97.6	Very high	96.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-42.2	-178.3	-71.7	0	0	0	0	112.8	K120 Y121 P414 Q415 L416 V422 S425 S485	K120-C418 PolarHBondContact NZ-O 2.97Å; Y121-C418 VanDerWaalsContact OH-CB 3.31Å; Y121-C418 WeakPolarHBondContact OH-CB 3.47Å; P414-C418 WeakPolarHBondContact O-CB 3.37Å; P414-C418 PolarHBondContact O-N 3.35Å; P414-C418 PolarHBondContact O-SG 3.42Å; Q415-C418 WeakPolarHBondContact O-CB 3.11Å; Q415-C418 PolarHBondContact O-N 2.92Å; Q415-C418 VanDerWaalsContact O-N 3.17Å; L416-C418 VanDerWaalsContact C-N 3.31Å; L416-C418 PolarHBondContact O-N 2.97Å; C418-V422 HydrophobicContact CB-CB 4.46Å; C418-V422 WeakPolarHBondContact O-CB 3.32Å; C418-V422 PolarHBondContact O-N 3.26Å; C418-V422 VanDerWaalsContact O-O 3.1Å; C418-S425 PolarHBondContact O-OG 3.12Å; C418-S485 PolarHBondContact SG-OG 3.47Å
419	V	95.5	Very high	96.5	Very high	12 Å²	12	22.2 Å²	22.2	7%	0.073	10%	0.095	C	C	.	.	H	α-helix	trans	-69.8	-35.7	-177.9	-64.9	0	0	0	0	112.1	P116 F117 K120 Y121 Q415 L416 I417	P116-V419 HydrophobicContact CB-CB 4.39Å; P116-V419 HydrophobicContact CB-CG2 3.92Å; P116-V419 HydrophobicContact CG-CG2 4.37Å; F117-V419 HydrophobicContact CD1-CG1 3.84Å; F117-V419 HydrophobicContact CD1-CG2 4.19Å; F117-V419 HydrophobicContact CD2-CG2 4.43Å; F117-V419 HydrophobicContact CE1-CG1 4.44Å; F117-V419 HydrophobicContact CE1-CG2 4.19Å; F117-V419 HydrophobicContact CE2-CG2 4.43Å; F117-V419 HydrophobicContact CG-CG1 4.21Å; F117-V419 HydrophobicContact CG-CG2 4.36Å; F117-V419 HydrophobicContact CZ-CG2 4.34Å; K120-V419 HydrophobicContact CB-CG1 4.28Å; K120-V419 HydrophobicContact CD-CB 4.02Å; K120-V419 HydrophobicContact CD-CG1 4.07Å; K120-V419 PolarHBondContact NZ-O 2.67Å; Y121-V419 HydrophobicContact CD2-CG1 3.86Å; Y121-V419 HydrophobicContact CE1-CG1 4.01Å; Y121-V419 HydrophobicContact CE2-CG1 3.15Å; Y121-V419 WeakPolarHBondContact OH-CG1 3.47Å; Q415-V419 WeakPolarHBondContact O-CG1 3.07Å; Q415-V419 WeakPolarHBondContact O-CG2 3.34Å; Q415-V419 PolarHBondContact O-N 3.01Å; L416-V419 HydrophobicContact CD1-CG2 4.26Å; L416-V419 VanDerWaalsContact O-CG2 3.27Å; L416-V419 WeakPolarHBondContact O-CG2 3.5Å; L416-V419 PolarHBondContact O-N 3.38Å; I417-V419 PolarHBondContact O-N 2.69Å
420	L	94.2	Very high	96.5	Very high	16 Å²	16	22.2 Å²	22.2	8%	0.084	10%	0.095	C	C	.	.	H	α-helix	trans	-86.7	-39.2	-176	-64.9	179.6	0	0	0	114.2	F101 M105 Y110 P116 L416 I417	F101-L420 HydrophobicContact CD1-CD1 3.63Å; F101-L420 HydrophobicContact CE1-CD1 4.18Å; M105-L420 HydrophobicContact CG-CD1 4.3Å; M105-L420 HydrophobicContact SD-CD1 4.05Å; M105-L420 HydrophobicContact SD-CD2 3.89Å; Y110-L420 HydrophobicContact CE2-CD2 4.31Å; P116-L420 HydrophobicContact CB-CD2 4.11Å; L416-L420 HydrophobicContact CD1-CD1 3.8Å; L416-L420 HydrophobicContact CD1-CG 4.22Å; L416-L420 HydrophobicContact CG-CD1 4.13Å; L416-L420 WeakPolarHBondContact O-CG 3.42Å; L416-L420 PolarHBondContact O-N 3.43Å; I417-L420 PolarHBondContact O-N 2.93Å
421	Y	94.9	Very high	96.5	Very high	63 Å²	63	24.1 Å²	24.1	25%	0.247	11%	0.105	C	C	.	.	H	α-helix	trans	-116.3	-26.3	-168.6	-54.6	-75.8	0	0	0	114.1	F100 F101 I417 R423 M558	F100-Y421 VanDerWaalsContact C-OH 3.27Å; F100-Y421 PolarHBondContact O-OH 3.23Å; F101-Y421 HydrophobicContact CD1-CE2 4.22Å; F101-Y421 AromaticContact CE1-CE2 3.8Å; F101-Y421 HydrophobicContact CE1-CE2 3.8Å; F101-Y421 HydrophobicContact CZ-CE2 4.35Å; I417-Y421 HydrophobicContact CG2-CD2 4.33Å; I417-Y421 PolarHBondContact O-N 2.98Å; Y421-R423 PolarHBondContact O-N 3.43Å; Y421-M558 HydrophobicContact CD1-CE 4.42Å
422	V	94.6	Very high	96.5	Very high	18 Å²	18	26.1 Å²	26.1	11%	0.109	12%	0.119	C	C	.	.			trans	-92.5	99.1	-178.9	-176.5	0	0	0	0	110.5	K120 C418 F424 S425 V486	K120-V422 PolarHBondContact NZ-O 3.08Å; C418-V422 HydrophobicContact CB-CB 4.46Å; C418-V422 WeakPolarHBondContact O-CB 3.32Å; C418-V422 PolarHBondContact O-N 3.26Å; C418-V422 VanDerWaalsContact O-O 3.1Å; V422-F424 VanDerWaalsContact C-N 3.32Å; V422-F424 HydrophobicContact CG1-CD1 4.15Å; V422-F424 HydrophobicContact CG1-CD2 3.9Å; V422-F424 HydrophobicContact CG1-CE1 3.81Å; V422-F424 HydrophobicContact CG1-CE2 3.53Å; V422-F424 HydrophobicContact CG1-CG 4.2Å; V422-F424 HydrophobicContact CG1-CZ 3.49Å; V422-F424 VanDerWaalsContact CG1-CZ 3.49Å; V422-F424 PolarHBondContact O-N 3.17Å; V422-S425 PolarHBondContact O-N 3.2Å; V422-S425 VanDerWaalsContact O-N 3.14Å; V422-S425 PolarHBondContact O-OG 3.45Å; V422-V486 HydrophobicContact CG2-CG2 4.47Å
423	R	89.9	Confident	96.5	Very high	196 Å²	196	26.2 Å²	26.2	74%	0.74	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-37.3	-171.8	-175.8	177.2	177	168.4	0	114.7	Y421	Y421-R423 PolarHBondContact O-N 3.43Å
424	F	92.4	Very high	96.5	Very high	60 Å²	60	26.4 Å²	26.4	26%	0.263	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.8	-177.2	57.2	-100.1	0	0	0	113.7	V422 N426 V486 Y490 D493	V422-F424 VanDerWaalsContact C-N 3.32Å; V422-F424 HydrophobicContact CG1-CD1 4.15Å; V422-F424 HydrophobicContact CG1-CD2 3.9Å; V422-F424 HydrophobicContact CG1-CE1 3.81Å; V422-F424 HydrophobicContact CG1-CE2 3.53Å; V422-F424 HydrophobicContact CG1-CG 4.2Å; V422-F424 HydrophobicContact CG1-CZ 3.49Å; V422-F424 VanDerWaalsContact CG1-CZ 3.49Å; V422-F424 PolarHBondContact O-N 3.17Å; F424-N426 PolarHBondContact O-N 3.41Å; F424-N426 PolarHBondContact O-ND2 2.91Å; F424-V486 HydrophobicContact CE2-CG1 4.02Å; F424-V486 HydrophobicContact CZ-CG1 3.96Å; F424-Y490 HydrophobicContact CD2-CD2 4.44Å; F424-Y490 HydrophobicContact CE1-CD2 4.47Å; F424-Y490 HydrophobicContact CE2-CD2 4.28Å; F424-Y490 HydrophobicContact CZ-CD2 4.29Å; F424-D493 HydrophobicContact CB-CB 4.05Å
425	S	95.2	Very high	96.5	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.144	C	C	.	.			trans	-61	140.5	178.4	66.9	0	0	0	0	111.9	K120 Y121 C418 V422 S489	K120-S425 WeakPolarHBondContact CD-OG 3.39Å; K120-S425 WeakPolarHBondContact CE-O 3.35Å; K120-S425 WeakPolarHBondContact CE-OG 3.36Å; K120-S425 PolarHBondContact NZ-OG 3.49Å; Y121-S425 PolarHBondContact OH-OG 2.86Å; C418-S425 PolarHBondContact O-OG 3.12Å; V422-S425 PolarHBondContact O-N 3.2Å; V422-S425 VanDerWaalsContact O-N 3.14Å; V422-S425 PolarHBondContact O-OG 3.45Å; S425-S489 WeakPolarHBondContact CA-OG 3.23Å
426	N	95.4	Very high	96.5	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.021	16%	0.16	C	C	.	.			trans	-148.3	175.4	-173	63.9	58.8	0	0	0	112.1	F424 Y428 G429 S430 S489 T492 C510 Y511	F424-N426 PolarHBondContact O-N 3.41Å; F424-N426 PolarHBondContact O-ND2 2.91Å; N426-Y428 VanDerWaalsContact C-N 3.29Å; N426-Y428 PolarHBondContact O-N 3.37Å; N426-Y428 WeakPolarHBondContact OD1-CB 3.18Å; N426-Y428 PolarHBondContact OD1-N 3.15Å; N426-Y428 VanDerWaalsContact OD1-N 3.09Å; N426-G429 PolarHBondContact O-N 3.02Å; N426-G429 PolarHBondContact OD1-N 3.18Å; N426-S430 PolarHBondContact O-N 3.42Å; N426-S489 PolarHBondContact N-OG 3.42Å; N426-S489 VanDerWaalsContact ND2-CA 3.32Å; N426-S489 WeakPolarHBondContact ND2-CA 3.33Å; N426-S489 PolarHBondContact ND2-O 3.44Å; N426-T492 PolarHBondContact ND2-OG1 3.23Å; N426-T492 PolarHBondContact OD1-OG1 2.84Å; N426-C510 HydrophobicContact CB-CB 4.43Å; N426-Y511 PolarHBondContact ND2-OH 3.16Å
427	T	97	Very high	96.5	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.043	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-31	-173.6	-49.3	0	0	0	0	113.5	Y121 M125 S430 L431 F508	Y121-T427 WeakPolarHBondContact CA-OG1 3.32Å; Y121-T427 PolarHBondContact O-OG1 2.82Å; M125-T427 HydrophobicContact CB-CG2 3.92Å; M125-T427 HydrophobicContact CG-CG2 4.14Å; M125-T427 HydrophobicContact SD-CG2 4.46Å; T427-S430 PolarHBondContact O-N 3.09Å; T427-L431 WeakPolarHBondContact O-CB 3.4Å; T427-L431 PolarHBondContact O-N 3.23Å; T427-F508 HydrophobicContact CG2-CB 4.12Å; T427-F508 HydrophobicContact CG2-CD1 4.16Å; T427-F508 HydrophobicContact CG2-CD2 4.14Å; T427-F508 HydrophobicContact CG2-CG 3.88Å
428	Y	97.6	Very high	96.5	Very high	33 Å²	33	34.2 Å²	34.2	13%	0.129	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-50.4	177.8	-65.9	-87.2	0	0	0	111.1	N426 S430 L431 C432 T492 F496 D506 I507 F508	N426-Y428 VanDerWaalsContact C-N 3.29Å; N426-Y428 PolarHBondContact O-N 3.37Å; N426-Y428 WeakPolarHBondContact OD1-CB 3.18Å; N426-Y428 PolarHBondContact OD1-N 3.15Å; N426-Y428 VanDerWaalsContact OD1-N 3.09Å; Y428-S430 VanDerWaalsContact C-N 3.3Å; Y428-S430 PolarHBondContact O-N 3.24Å; Y428-L431 PolarHBondContact O-N 2.99Å; Y428-C432 PolarHBondContact O-N 3.42Å; Y428-C432 VanDerWaalsContact O-N 3.07Å; Y428-C432 PolarHBondContact O-SG 2.99Å; Y428-C432 VanDerWaalsContact O-SG 3.4Å; Y428-T492 HydrophobicContact CD2-CG2 4.26Å; Y428-T492 HydrophobicContact CG-CG2 3.99Å; Y428-F496 HydrophobicContact CD2-CE2 4.32Å; Y428-F496 AromaticContact CE2-CE2 3.67Å; Y428-F496 HydrophobicContact CE2-CE2 3.67Å; Y428-F496 HydrophobicContact CE2-CZ 4.25Å; Y428-F496 AromaticContact CZ-CE2 3.96Å; Y428-D506 WeakPolarHBondContact OH-CA 3.45Å; Y428-D506 PolarHBondContact OH-OD1 3.28Å; Y428-I507 PolarHBondContact OH-N 3.24Å; Y428-F508 AromaticContact CD1-CD2 3.5Å; Y428-F508 HydrophobicContact CD1-CD2 3.5Å; Y428-F508 AromaticContact CD1-CE2 3.59Å; Y428-F508 HydrophobicContact CD1-CE2 3.59Å; Y428-F508 AromaticContact CD2-CD2 3.98Å; Y428-F508 HydrophobicContact CD2-CD2 3.98Å; Y428-F508 AromaticContact CE1-CD2 3.35Å; Y428-F508 HydrophobicContact CE1-CD2 3.35Å; Y428-F508 AromaticContact CE1-CE2 3.63Å; Y428-F508 HydrophobicContact CE1-CE2 3.63Å; Y428-F508 HydrophobicContact CE1-CG 4.44Å; Y428-F508 HydrophobicContact CE2-CB 4.19Å; Y428-F508 AromaticContact CE2-CD2 3.83Å; Y428-F508 HydrophobicContact CE2-CD2 3.83Å; Y428-F508 AromaticContact CG-CD2 3.82Å; Y428-F508 HydrophobicContact CG-CD2 3.82Å; Y428-F508 HydrophobicContact CG-CE2 4.21Å; Y428-F508 AromaticContact CZ-CD2 3.52Å; Y428-F508 PolarHBondContact OH-N 3.36Å
429	G	98.1	Very high	96.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-39	175.5	0	0	0	0	0	112.1	N426 S433	N426-G429 PolarHBondContact O-N 3.02Å; N426-G429 PolarHBondContact OD1-N 3.18Å; G429-S433 VanDerWaalsContact O-CB 3.31Å; G429-S433 WeakPolarHBondContact O-CB 3.35Å; G429-S433 PolarHBondContact O-N 3.44Å; G429-S433 PolarHBondContact O-OG 2.89Å
430	S	98.3	Very high	96.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-46.3	176.5	-171	0	0	0	0	112.7	Y121 Q415 N426 T427 Y428 S433 Y434	Y121-S430 VanDerWaalsContact CD2-OG 3.22Å; Y121-S430 WeakPolarHBondContact CD2-OG 3.31Å; Y121-S430 WeakPolarHBondContact CE2-OG 3.5Å; Q415-S430 VanDerWaalsContact CD-OG 3.29Å; Q415-S430 PolarHBondContact NE2-O 3.32Å; Q415-S430 PolarHBondContact NE2-OG 3.46Å; Q415-S430 PolarHBondContact OE1-OG 3.4Å; N426-S430 PolarHBondContact O-N 3.42Å; T427-S430 PolarHBondContact O-N 3.09Å; Y428-S430 VanDerWaalsContact C-N 3.3Å; Y428-S430 PolarHBondContact O-N 3.24Å; S430-S433 WeakPolarHBondContact CA-OG 3.42Å; S430-S433 PolarHBondContact O-OG 3.44Å; S430-Y434 WeakPolarHBondContact O-CB 3.45Å; S430-Y434 PolarHBondContact O-N 3.47Å
431	L	98.5	Very high	96.8	Very high	41 Å²	41	40 Å²	40	22%	0.215	19%	0.185	C	C	.	.	H	α-helix	trans	-67.6	-46.4	-179.7	-179.5	61.4	0	0	0	112	M125 L128 T427 Y428 S433 Y434 L435 F508	M125-L431 HydrophobicContact CE-CD1 4.49Å; M125-L431 HydrophobicContact SD-CB 3.94Å; M125-L431 HydrophobicContact SD-CD1 4.13Å; L128-L431 HydrophobicContact CD1-CD1 3.98Å; T427-L431 WeakPolarHBondContact O-CB 3.4Å; T427-L431 PolarHBondContact O-N 3.23Å; Y428-L431 PolarHBondContact O-N 2.99Å; L431-S433 PolarHBondContact O-N 3.27Å; L431-Y434 WeakPolarHBondContact O-CB 3.42Å; L431-Y434 PolarHBondContact O-N 3.41Å; L431-L435 HydrophobicContact CD1-CD1 4.25Å; L431-L435 HydrophobicContact CD1-CG 4.32Å; L431-L435 HydrophobicContact CG-CD1 4.21Å; L431-L435 WeakPolarHBondContact O-CG 3.45Å; L431-L435 PolarHBondContact O-N 3.28Å; L431-F508 HydrophobicContact CD2-CE1 4.48Å; L431-F508 HydrophobicContact CD2-CE2 4.13Å; L431-F508 HydrophobicContact CD2-CZ 3.59Å
432	C	98.5	Very high	96.8	Very high	44 Å²	44	41.1 Å²	41.1	30%	0.297	20%	0.195	S	C	.	.	H	α-helix	trans	-64.5	-41.2	-180	-68.3	0	0	0	0	112	Y428 L435 I436 V484 I488	Y428-C432 PolarHBondContact O-N 3.42Å; Y428-C432 VanDerWaalsContact O-N 3.07Å; Y428-C432 PolarHBondContact O-SG 2.99Å; Y428-C432 VanDerWaalsContact O-SG 3.4Å; C432-L435 PolarHBondContact O-N 3.49Å; C432-I436 WeakPolarHBondContact O-CB 3.25Å; C432-I436 WeakPolarHBondContact O-CG1 3.35Å; C432-I436 PolarHBondContact O-N 2.87Å; C432-V484 HydrophobicContact CB-CG1 3.85Å; C432-I488 HydrophobicContact CB-CD1 3.3Å
433	S	98.4	Very high	96.9	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-65.5	-39	175.4	52.9	0	0	0	0	112.7	Q415 G429 S430 L431 G437 S481	Q415-S433 PolarHBondContact NE2-OG 3.42Å; G429-S433 VanDerWaalsContact O-CB 3.31Å; G429-S433 WeakPolarHBondContact O-CB 3.35Å; G429-S433 PolarHBondContact O-N 3.44Å; G429-S433 PolarHBondContact O-OG 2.89Å; S430-S433 WeakPolarHBondContact CA-OG 3.42Å; S430-S433 PolarHBondContact O-OG 3.44Å; L431-S433 PolarHBondContact O-N 3.27Å; S433-G437 WeakPolarHBondContact O-CA 3.38Å; S433-G437 PolarHBondContact O-N 2.92Å; S433-S481 WeakPolarHBondContact CB-O 3.29Å
434	Y	98.6	Very high	97.2	Very high	18 Å²	18	31.6 Å²	31.6	7%	0.071	16%	0.159	C	C	.	.	H	α-helix	trans	-57.5	-51.6	172.9	179.5	-81	0	0	0	111.4	M125 L128 L129 P132 I411 S430 L431 L438	M125-Y434 HydrophobicContact CE-CD2 4.3Å; M125-Y434 HydrophobicContact CE-CG 4.22Å; L128-Y434 HydrophobicContact CB-CE2 4.42Å; L128-Y434 WeakPolarHBondContact O-CE2 3.26Å; L129-Y434 HydrophobicContact CD2-CD2 3.97Å; P132-Y434 HydrophobicContact CG-CE2 4.27Å; I411-Y434 HydrophobicContact CD1-CD2 4.48Å; I411-Y434 HydrophobicContact CD1-CE2 4.42Å; I411-Y434 HydrophobicContact CG2-CD2 3.59Å; I411-Y434 HydrophobicContact CG2-CE2 4.18Å; I411-Y434 HydrophobicContact CG2-CG 4.38Å; S430-Y434 WeakPolarHBondContact O-CB 3.45Å; S430-Y434 PolarHBondContact O-N 3.47Å; L431-Y434 WeakPolarHBondContact O-CB 3.42Å; L431-Y434 PolarHBondContact O-N 3.41Å; Y434-L438 HydrophobicContact CE1-CD2 4Å; Y434-L438 WeakPolarHBondContact O-CB 3.21Å; Y434-L438 PolarHBondContact O-N 2.93Å
435	L	98.5	Very high	97.2	Very high	97 Å²	97	29.1 Å²	29.1	51%	0.508	15%	0.15	S	C	.	.	H	α-helix	trans	-65.7	-46.1	-176.5	-68	173.9	0	0	0	112	L431 C432 F439	L431-L435 HydrophobicContact CD1-CD1 4.25Å; L431-L435 HydrophobicContact CD1-CG 4.32Å; L431-L435 HydrophobicContact CG-CD1 4.21Å; L431-L435 WeakPolarHBondContact O-CG 3.45Å; L431-L435 PolarHBondContact O-N 3.28Å; C432-L435 PolarHBondContact O-N 3.49Å; L435-F439 VanDerWaalsContact O-CB 3.26Å; L435-F439 WeakPolarHBondContact O-CB 3.18Å; L435-F439 PolarHBondContact O-N 3.04Å
436	I	98.2	Very high	97.1	Very high	68 Å²	68	29.8 Å²	29.8	35%	0.349	15%	0.153	S	C	.	.	H	α-helix	trans	-69	-45	-179.3	-66.2	178	0	0	0	110.5	C432 L438 F439 V440 I480 V484	C432-I436 WeakPolarHBondContact O-CB 3.25Å; C432-I436 WeakPolarHBondContact O-CG1 3.35Å; C432-I436 PolarHBondContact O-N 2.87Å; I436-L438 PolarHBondContact O-N 3.25Å; I436-F439 PolarHBondContact O-N 3.49Å; I436-V440 HydrophobicContact CG2-CG2 4.22Å; I436-V440 VanDerWaalsContact O-CG2 3.31Å; I436-V440 WeakPolarHBondContact O-CG2 3.48Å; I436-V440 PolarHBondContact O-N 3.28Å; I436-I480 HydrophobicContact CG2-CG2 3.45Å; I436-I480 VanDerWaalsContact CG2-CG2 3.45Å; I436-V484 HydrophobicContact CD1-CG1 3.92Å; I436-V484 HydrophobicContact CD1-CG2 3.92Å; I436-V484 HydrophobicContact CG2-CG2 4.45Å
437	G	98.1	Very high	96.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.1	-47.2	177.8	0	0	0	0	0	112.9	S433 R441 S481	S433-G437 WeakPolarHBondContact O-CA 3.38Å; S433-G437 PolarHBondContact O-N 2.92Å; G437-R441 WeakPolarHBondContact O-CB 3.5Å; G437-R441 PolarHBondContact O-N 2.79Å; G437-S481 WeakPolarHBondContact CA-OG 3.36Å
438	L	97.7	Very high	96.6	Very high	41 Å²	41	32.5 Å²	32.5	22%	0.215	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-44.9	176.4	-175.2	64.1	0	0	0	111.4	L407 I411 Y434 I436 R441 L442	L407-L438 HydrophobicContact CD1-CD1 4.47Å; L407-L438 HydrophobicContact CD2-CD1 4.05Å; I411-L438 HydrophobicContact CD1-CB 3.99Å; I411-L438 HydrophobicContact CD1-CD1 4.06Å; Y434-L438 HydrophobicContact CE1-CD2 4Å; Y434-L438 WeakPolarHBondContact O-CB 3.21Å; Y434-L438 PolarHBondContact O-N 2.93Å; I436-L438 PolarHBondContact O-N 3.25Å; L438-R441 PolarHBondContact O-N 3.13Å; L438-L442 HydrophobicContact CD1-CD1 3.76Å; L438-L442 HydrophobicContact CD1-CD2 4.43Å; L438-L442 HydrophobicContact CD1-CG 3.86Å; L438-L442 HydrophobicContact CD2-CD1 4.41Å; L438-L442 HydrophobicContact CG-CD1 3.75Å; L438-L442 HydrophobicContact CG-CG 4.2Å; L438-L442 WeakPolarHBondContact O-CB 3.12Å; L438-L442 VanDerWaalsContact O-CG 3.28Å; L438-L442 WeakPolarHBondContact O-CG 3.1Å; L438-L442 PolarHBondContact O-N 2.89Å
439	F	97.9	Very high	96.3	Very high	125 Å²	125	34.2 Å²	34.2	55%	0.548	18%	0.182	S	C	.	.	H	α-helix	trans	-61.1	-51.4	178.9	177.5	-95.2	0	0	0	112	L435 I436 R441 T443 I455	L435-F439 VanDerWaalsContact O-CB 3.26Å; L435-F439 WeakPolarHBondContact O-CB 3.18Å; L435-F439 PolarHBondContact O-N 3.04Å; I436-F439 PolarHBondContact O-N 3.49Å; F439-R441 VanDerWaalsContact C-N 3.32Å; F439-R441 PolarHBondContact O-N 3.11Å; F439-T443 HydrophobicContact CD2-CG2 4.27Å; F439-T443 HydrophobicContact CE1-CG2 4.36Å; F439-T443 HydrophobicContact CE2-CG2 3.97Å; F439-T443 HydrophobicContact CZ-CG2 4.02Å; F439-T443 WeakPolarHBondContact O-CB 3.4Å; F439-T443 VanDerWaalsContact O-CG2 3.27Å; F439-T443 WeakPolarHBondContact O-CG2 3.06Å; F439-T443 PolarHBondContact O-N 2.77Å; F439-T443 VanDerWaalsContact O-N 3.09Å; F439-T443 PolarHBondContact O-OG1 2.93Å; F439-I455 HydrophobicContact CE1-CD1 4.46Å
440	V	97.4	Very high	95.9	Very high	15 Å²	15	42.9 Å²	42.9	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-59.2	-46.5	179.2	175.5	0	0	0	0	109.8	I436 T443 S444 F476 A477	I436-V440 HydrophobicContact CG2-CG2 4.22Å; I436-V440 VanDerWaalsContact O-CG2 3.31Å; I436-V440 WeakPolarHBondContact O-CG2 3.48Å; I436-V440 PolarHBondContact O-N 3.28Å; V440-T443 PolarHBondContact O-OG1 3.45Å; V440-S444 PolarHBondContact O-N 3.21Å; V440-S444 PolarHBondContact O-OG 3.38Å; V440-F476 HydrophobicContact CG1-CD1 3.97Å; V440-F476 HydrophobicContact CG1-CE1 4.23Å; V440-A477 HydrophobicContact CB-CB 4.13Å; V440-A477 HydrophobicContact CG1-CB 3.76Å
441	R	96.8	Very high	95.6	Very high	10 Å²	10	46.4 Å²	46.4	4%	0.038	24%	0.238	C	C	.	.	H	α-helix	trans	-68.3	-45.2	-177.6	178.1	59.6	-166.2	101.1	-7.7	113.5	D406 L407 V410 G437 L438 F439 T443 S444 G445 E446 A477	D406-R441 VanDerWaalsContact CG-NE 3.26Å; D406-R441 WeakPolarHBondContact OD1-CD 3.31Å; D406-R441 IonicContact OD1-CZ 2.77Å; D406-R441 IonicContact OD1-NE 3.95Å; D406-R441 PolarHBondContact OD1-NE 3.46Å; D406-R441 IonicContact OD1-NH2 2.99Å; D406-R441 IonicContact OD2-CZ 3.78Å; D406-R441 VanDerWaalsContact OD2-CZ 3.22Å; D406-R441 IonicContact OD2-NE 3.79Å; D406-R441 PolarHBondContact OD2-NE 2.86Å; D406-R441 IonicContact OD2-NH2 3.34Å; D406-R441 PolarHBondContact OD2-NH2 3.11Å; L407-R441 HydrophobicContact CD2-CG 4.03Å; V410-R441 HydrophobicContact CG1-CB 4.05Å; V410-R441 HydrophobicContact CG2-CB 4.32Å; V410-R441 HydrophobicContact CG2-CG 4.11Å; G437-R441 WeakPolarHBondContact O-CB 3.5Å; G437-R441 PolarHBondContact O-N 2.79Å; L438-R441 PolarHBondContact O-N 3.13Å; F439-R441 VanDerWaalsContact C-N 3.32Å; F439-R441 PolarHBondContact O-N 3.11Å; R441-T443 VanDerWaalsContact C-N 3.29Å; R441-T443 PolarHBondContact O-N 3.01Å; R441-S444 WeakPolarHBondContact O-CB 3.36Å; R441-S444 PolarHBondContact O-N 3.04Å; R441-G445 PolarHBondContact NH1-O 3.22Å; R441-E446 IonicContact NH2-OE2 3.71Å; R441-E446 PolarHBondContact NH2-OE2 2.9Å; R441-A477 HydrophobicContact CB-CB 4.19Å
442	L	95.8	Very high	95.3	Very high	85 Å²	85	51.7 Å²	51.7	45%	0.445	26%	0.255	S	S	.	.	H	α-helix	trans	-64.2	-37.3	-179.4	-73.4	179.3	0	0	0	111.7	L438 S444 G445 L451	L438-L442 HydrophobicContact CD1-CD1 3.76Å; L438-L442 HydrophobicContact CD1-CD2 4.43Å; L438-L442 HydrophobicContact CD1-CG 3.86Å; L438-L442 HydrophobicContact CD2-CD1 4.41Å; L438-L442 HydrophobicContact CG-CD1 3.75Å; L438-L442 HydrophobicContact CG-CG 4.2Å; L438-L442 WeakPolarHBondContact O-CB 3.12Å; L438-L442 VanDerWaalsContact O-CG 3.28Å; L438-L442 WeakPolarHBondContact O-CG 3.1Å; L438-L442 PolarHBondContact O-N 2.89Å; L442-S444 VanDerWaalsContact C-N 3.26Å; L442-S444 PolarHBondContact O-N 3.44Å; L442-G445 PolarHBondContact O-N 3.4Å; L442-L451 HydrophobicContact CD2-CD2 4.47Å
443	T	96.5	Very high	95.1	Very high	12 Å²	12	50.7 Å²	50.7	7%	0.074	25%	0.248	C	C	.	.	H	α-helix	trans	-73	-17.2	179.1	54.9	0	0	0	0	113.4	F439 V440 R441 G445 P453 L454 I455	F439-T443 HydrophobicContact CD2-CG2 4.27Å; F439-T443 HydrophobicContact CE1-CG2 4.36Å; F439-T443 HydrophobicContact CE2-CG2 3.97Å; F439-T443 HydrophobicContact CZ-CG2 4.02Å; F439-T443 WeakPolarHBondContact O-CB 3.4Å; F439-T443 VanDerWaalsContact O-CG2 3.27Å; F439-T443 WeakPolarHBondContact O-CG2 3.06Å; F439-T443 PolarHBondContact O-N 2.77Å; F439-T443 VanDerWaalsContact O-N 3.09Å; F439-T443 PolarHBondContact O-OG1 2.93Å; V440-T443 PolarHBondContact O-OG1 3.45Å; R441-T443 VanDerWaalsContact C-N 3.29Å; R441-T443 PolarHBondContact O-N 3.01Å; T443-G445 VanDerWaalsContact C-N 3.34Å; T443-P453 CarbonylContact O-C 3.53Å; T443-P453 WeakPolarHBondContact O-CA 3.36Å; T443-L454 HydrophobicContact CG2-CB 4.25Å; T443-L454 HydrophobicContact CG2-CD2 3.95Å; T443-L454 PolarHBondContact O-N 3Å; T443-I455 HydrophobicContact CG2-CD1 4.49Å; T443-I455 PolarHBondContact O-N 3.36Å; T443-I455 WeakPolarHBondContact OG1-CD1 3.43Å
444	S	95.3	Very high	94.9	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.021	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-14.2	173.9	-55.6	0	0	0	0	114.9	V440 R441 L442 P453 Q469 C473	V440-S444 PolarHBondContact O-N 3.21Å; V440-S444 PolarHBondContact O-OG 3.38Å; R441-S444 WeakPolarHBondContact O-CB 3.36Å; R441-S444 PolarHBondContact O-N 3.04Å; L442-S444 VanDerWaalsContact C-N 3.26Å; L442-S444 PolarHBondContact O-N 3.44Å; S444-P453 WeakPolarHBondContact O-CB 3.3Å; S444-Q469 WeakPolarHBondContact O-CG 3.49Å; S444-Q469 PolarHBondContact O-NE2 3.49Å; S444-Q469 VanDerWaalsContact O-NE2 3.07Å; S444-C473 WeakPolarHBondContact OG-CB 3.29Å
445	G	93.8	Very high	94.7	Very high	7 Å²	7	59.6 Å²	59.6	7%	0.072	30%	0.295	C	S	.	.			trans	77.9	165.9	-179.8	0	0	0	0	0	115.5	R441 L442 T443 L451	R441-G445 PolarHBondContact NH1-O 3.22Å; L442-G445 PolarHBondContact O-N 3.4Å; T443-G445 VanDerWaalsContact C-N 3.34Å; G445-L451 CarbonylContact C-O 3.58Å; G445-L451 WeakPolarHBondContact CA-O 3.3Å
446	E	93.7	Very high	94.5	Very high	15 Å²	15	59.2 Å²	59.2	7%	0.07	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-155.1	117	178.7	179.8	50.2	-123.3	0	0	110.8	L403 R441 V448 L449 K450 L451 K474	L403-E446 HydrophobicContact CD1-CG 3.88Å; R441-E446 IonicContact NH2-OE2 3.71Å; R441-E446 PolarHBondContact NH2-OE2 2.9Å; E446-V448 HydrophobicContact CG-CB 4.48Å; E446-V448 PolarHBondContact OE1-N 3.36Å; E446-L449 HydrophobicContact CB-CB 4.39Å; E446-L449 HydrophobicContact CG-CB 4.23Å; E446-L449 HydrophobicContact CG-CD1 4.34Å; E446-L449 HydrophobicContact CG-CG 4.05Å; E446-L449 PolarHBondContact O-N 3.03Å; E446-K450 PolarHBondContact O-N 2.77Å; E446-K450 VanDerWaalsContact O-N 3.15Å; E446-L451 PolarHBondContact N-O 3.46Å; E446-L451 PolarHBondContact O-N 3.46Å; E446-K474 IonicContact OE2-NZ 2.92Å
447	S	91	Very high	94.3	Very high	26 Å²	26	57.5 Å²	57.5	18%	0.182	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-37.5	-173.6	60.6	0	0	0	0	112.6	L449 K450 D466 F467	S447-L449 PolarHBondContact O-N 3.3Å; S447-K450 WeakPolarHBondContact O-CA 3.24Å; S447-K450 PolarHBondContact O-N 3.48Å; S447-D466 PolarHBondContact OG-OD1 2.63Å; S447-F467 WeakPolarHBondContact CB-O 3.44Å
448	V	89.7	Confident	93.9	Very high	41 Å²	41	61.3 Å²	61.3	25%	0.248	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.2	178.1	179.5	0	0	0	0	111.6	I394 E446	I394-V448 HydrophobicContact CG2-CG1 3.77Å; E446-V448 HydrophobicContact CG-CB 4.48Å; E446-V448 PolarHBondContact OE1-N 3.36Å
449	L	90.7	Very high	93.5	Very high	70 Å²	70	67.6 Å²	67.6	37%	0.366	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	1.1	176	-62.8	-175.7	0	0	0	113.6	F139 I394 L403 E446 S447 L451	F139-L449 HydrophobicContact CE1-CD2 4Å; F139-L449 HydrophobicContact CZ-CD1 4.22Å; F139-L449 HydrophobicContact CZ-CD2 4.26Å; I394-L449 HydrophobicContact CD1-CD2 3.72Å; L403-L449 HydrophobicContact CD2-CD1 3.88Å; L403-L449 HydrophobicContact CD2-CD2 3.62Å; L403-L449 HydrophobicContact CD2-CG 3.64Å; E446-L449 HydrophobicContact CB-CB 4.39Å; E446-L449 HydrophobicContact CG-CB 4.23Å; E446-L449 HydrophobicContact CG-CD1 4.34Å; E446-L449 HydrophobicContact CG-CG 4.05Å; E446-L449 PolarHBondContact O-N 3.03Å; S447-L449 PolarHBondContact O-N 3.3Å; L449-L451 HydrophobicContact CB-CB 4.39Å; L449-L451 PolarHBondContact O-N 3.39Å; L449-L451 VanDerWaalsContact O-N 3.17Å
450	K	89.7	Confident	93.3	Very high	182 Å²	182	63.8 Å²	63.8	79%	0.791	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	28.6	-172.5	-56.3	-179.2	179.2	179.6	0	113.1	E446 S447 R452	E446-K450 PolarHBondContact O-N 2.77Å; E446-K450 VanDerWaalsContact O-N 3.15Å; S447-K450 WeakPolarHBondContact O-CA 3.24Å; S447-K450 PolarHBondContact O-N 3.48Å; K450-R452 PolarHBondContact O-N 2.86Å
451	L	92.1	Very high	93	Very high	73 Å²	73	64.6 Å²	64.6	38%	0.382	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-88.6	100.3	179.3	-177.6	69	0	0	0	109	L442 G445 E446 L449 F467	L442-L451 HydrophobicContact CD2-CD2 4.47Å; G445-L451 CarbonylContact C-O 3.58Å; G445-L451 WeakPolarHBondContact CA-O 3.3Å; E446-L451 PolarHBondContact N-O 3.46Å; E446-L451 PolarHBondContact O-N 3.46Å; L449-L451 HydrophobicContact CB-CB 4.39Å; L449-L451 PolarHBondContact O-N 3.39Å; L449-L451 VanDerWaalsContact O-N 3.17Å; L451-F467 WeakPolarHBondContact O-CE2 3.47Å; L451-F467 VanDerWaalsContact O-CZ 3.25Å; L451-F467 WeakPolarHBondContact O-CZ 3.39Å
452	R	92.3	Very high	92.7	Very high	152 Å²	152	69 Å²	69	57%	0.574	35%	0.345	S	S	*	.			trans	-64.3	145.9	178.6	-75.2	-172.3	172	-117.6	-4.6	111.8	K450 D462 F467	K450-R452 PolarHBondContact O-N 2.86Å; R452-D462 IonicContact NH1-OD1 3.14Å; R452-F467 HydrophobicContact CG-CE1 4.23Å; R452-F467 HydrophobicContact CG-CZ 4.27Å
453	P	94.1	Very high	92.3	Very high	23 Å²	23	68.3 Å²	68.3	15%	0.149	34%	0.342	C	S	.	.			trans	-65.6	137.8	176.9	27.1	-34.3	0	0	0	111.6	T443 S444 V456 F460 Q469	T443-P453 CarbonylContact O-C 3.53Å; T443-P453 WeakPolarHBondContact O-CA 3.36Å; S444-P453 WeakPolarHBondContact O-CB 3.3Å; P453-V456 HydrophobicContact CG-CG2 4.35Å; P453-F460 HydrophobicContact CG-CD2 4.47Å; P453-F460 HydrophobicContact CG-CE1 4.33Å; P453-F460 HydrophobicContact CG-CE2 3.77Å; P453-F460 HydrophobicContact CG-CZ 3.68Å; P453-Q469 VanDerWaalsContact CB-NE2 3.32Å
454	L	95.2	Very high	91.4	Very high	142 Å²	142	72.4 Å²	72.4	74%	0.743	37%	0.369	S	S	*	.	S	Bend	trans	-86.6	-38.6	164.8	-179.4	64.7	0	0	0	110.7	T443	T443-L454 HydrophobicContact CG2-CB 4.25Å; T443-L454 HydrophobicContact CG2-CD2 3.95Å; T443-L454 PolarHBondContact O-N 3Å
455	I	94.3	Very high	90.5	Very high	64 Å²	64	79.3 Å²	79.3	33%	0.328	41%	0.405	S	S	.	.	S	Bend	trans	-104.1	112.4	174.8	-60.6	176.9	0	0	0	107.7	F439 T443 Y457 Q469	F439-I455 HydrophobicContact CE1-CD1 4.46Å; T443-I455 HydrophobicContact CG2-CD1 4.49Å; T443-I455 PolarHBondContact O-N 3.36Å; T443-I455 WeakPolarHBondContact OG1-CD1 3.43Å; I455-Y457 HydrophobicContact CB-CE2 4.11Å; I455-Y457 HydrophobicContact CG2-CD2 4.06Å; I455-Y457 HydrophobicContact CG2-CE1 4.41Å; I455-Y457 HydrophobicContact CG2-CE2 3.61Å; I455-Q469 PolarHBondContact O-NE2 3.28Å
456	V	94.4	Very high	90.1	Very high	89 Å²	89	82.7 Å²	82.7	54%	0.539	42%	0.422	S	S	.	.			trans	-89.1	114.9	175.5	-177.9	0	0	0	0	108.1	P453 F460	P453-V456 HydrophobicContact CG-CG2 4.35Å; V456-F460 HydrophobicContact CG1-CB 3.38Å; V456-F460 HydrophobicContact CG1-CD1 3.61Å; V456-F460 HydrophobicContact CG1-CG 3.64Å; V456-F460 HydrophobicContact CG2-CD1 4.48Å
457	Y	93.9	Very high	90	Very high	33 Å²	33	82.7 Å²	82.7	13%	0.129	42%	0.422	C	S	.	.			trans	-85.7	164.2	177	-71.5	-92.5	0	0	0	110.4	I455 Y459 F460 F471 C473 F476	I455-Y457 HydrophobicContact CB-CE2 4.11Å; I455-Y457 HydrophobicContact CG2-CD2 4.06Å; I455-Y457 HydrophobicContact CG2-CE1 4.41Å; I455-Y457 HydrophobicContact CG2-CE2 3.61Å; Y457-Y459 PolarHBondContact O-N 3.2Å; Y457-F460 PolarHBondContact O-N 2.89Å; Y457-F471 AromaticContact CD1-CD1 3.37Å; Y457-F471 HydrophobicContact CD1-CD1 3.37Å; Y457-F471 AromaticContact CD1-CE1 3.55Å; Y457-F471 HydrophobicContact CD1-CE1 3.55Å; Y457-F471 AromaticContact CD1-CG 3.91Å; Y457-F471 HydrophobicContact CD1-CG 3.91Å; Y457-F471 HydrophobicContact CD1-CZ 4.22Å; Y457-F471 HydrophobicContact CD2-CD1 4.36Å; Y457-F471 AromaticContact CE1-CD1 3.94Å; Y457-F471 HydrophobicContact CE1-CD1 3.94Å; Y457-F471 AromaticContact CE1-CE1 3.69Å; Y457-F471 HydrophobicContact CE1-CE1 3.69Å; Y457-F471 HydrophobicContact CE1-CZ 4.41Å; Y457-F471 HydrophobicContact CG-CB 4.23Å; Y457-F471 AromaticContact CG-CD1 3.61Å; Y457-F471 HydrophobicContact CG-CD1 3.61Å; Y457-F471 HydrophobicContact CG-CE1 4.24Å; Y457-F471 HydrophobicContact CG-CG 4.04Å; Y457-C473 WeakPolarHBondContact CD2-SG 3.4Å; Y457-F476 HydrophobicContact CE1-CD1 4.38Å; Y457-F476 HydrophobicContact CE1-CE1 4.17Å
458	P	90.4	Very high	90.1	Very high	80 Å²	80	83.4 Å²	83.4	52%	0.519	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	141.8	176.8	-27.4	36	0	0	0	112.3	F460	P458-F460 VanDerWaalsContact C-N 3.31Å; P458-F460 PolarHBondContact O-N 3.31Å
459	Y	88.8	Confident	90.3	Very high	173 Å²	173	82 Å²	82	68%	0.678	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	28.6	-180	-44.4	-78.6	0	0	0	114.9	Y457 V461 R470	Y457-Y459 PolarHBondContact O-N 3.2Å; Y459-V461 PolarHBondContact O-N 3.2Å; Y459-R470 WeakPolarHBondContact O-CB 3.32Å; Y459-R470 WeakPolarHBondContact O-CD 3.46Å; Y459-R470 WeakPolarHBondContact O-CG 3.43Å
460	F	92.7	Very high	90.5	Very high	45 Å²	45	81.6 Å²	81.6	20%	0.197	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	134.3	169.1	175.2	-120.5	0	0	0	111.7	P453 V456 Y457 P458 D462 F467 Y468 Q469	P453-F460 HydrophobicContact CG-CD2 4.47Å; P453-F460 HydrophobicContact CG-CE1 4.33Å; P453-F460 HydrophobicContact CG-CE2 3.77Å; P453-F460 HydrophobicContact CG-CZ 3.68Å; V456-F460 HydrophobicContact CG1-CB 3.38Å; V456-F460 HydrophobicContact CG1-CD1 3.61Å; V456-F460 HydrophobicContact CG1-CG 3.64Å; V456-F460 HydrophobicContact CG2-CD1 4.48Å; Y457-F460 PolarHBondContact O-N 2.89Å; P458-F460 VanDerWaalsContact C-N 3.31Å; P458-F460 PolarHBondContact O-N 3.31Å; F460-D462 HydrophobicContact CD1-CB 3.99Å; F460-D462 HydrophobicContact CE1-CB 3.45Å; F460-D462 VanDerWaalsContact CE1-CB 3.45Å; F460-D462 HydrophobicContact CZ-CB 4.12Å; F460-F467 HydrophobicContact CE2-CB 3.91Å; F460-F467 HydrophobicContact CE2-CD2 4.07Å; F460-F467 HydrophobicContact CE2-CG 4.43Å; F460-F467 HydrophobicContact CZ-CB 3.81Å; F460-F467 HydrophobicContact CZ-CD2 4.26Å; F460-F467 HydrophobicContact CZ-CG 4.33Å; F460-Y468 VanDerWaalsContact CD2-O 3.26Å; F460-Y468 WeakPolarHBondContact CD2-O 3.28Å; F460-Q469 HydrophobicContact CD2-CG 4.28Å
461	V	92.1	Very high	90.8	Very high	32 Å²	32	75.7 Å²	75.7	19%	0.194	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	108	174.1	-179.8	0	0	0	0	107.5	Y459 D463 F467 Y468 R470	Y459-V461 PolarHBondContact O-N 3.2Å; V461-D463 PolarHBondContact O-N 2.61Å; V461-F467 VanDerWaalsContact O-CA 3.24Å; V461-F467 WeakPolarHBondContact O-CA 3.49Å; V461-F467 WeakPolarHBondContact O-CB 3.2Å; V461-Y468 HydrophobicContact CB-CD1 4.15Å; V461-Y468 HydrophobicContact CB-CE1 3.84Å; V461-Y468 HydrophobicContact CG1-CD1 4.4Å; V461-Y468 HydrophobicContact CG1-CE1 3.85Å; V461-Y468 HydrophobicContact CG2-CE1 4.08Å; V461-Y468 HydrophobicContact CG2-CE2 4.1Å; V461-Y468 PolarHBondContact N-O 2.59Å; V461-Y468 PolarHBondContact O-N 2.84Å; V461-R470 HydrophobicContact CG2-CG 4.18Å
462	D	90.6	Very high	91	Very high	102 Å²	102	73.7 Å²	73.7	55%	0.545	37%	0.371	S	S	.	.			trans	-92.9	74.4	179	-163.9	8.9	0	0	0	110.2	R452 F460	R452-D462 IonicContact NH1-OD1 3.14Å; F460-D462 HydrophobicContact CD1-CB 3.99Å; F460-D462 HydrophobicContact CE1-CB 3.45Å; F460-D462 VanDerWaalsContact CE1-CB 3.45Å; F460-D462 HydrophobicContact CZ-CB 4.12Å
463	D	86.2	Confident	91.2	Very high	70 Å²	70	66.7 Å²	66.7	37%	0.374	35%	0.345	S	S	.	.			trans	-91	131	167.4	-168.9	-58.8	0	0	0	109.4	V461 N465 D466 F467	V461-D463 PolarHBondContact O-N 2.61Å; D463-N465 PolarHBondContact O-N 2.91Å; D463-N465 VanDerWaalsContact O-N 3.15Å; D463-N465 PolarHBondContact OD1-N 3.18Å; D463-D466 PolarHBondContact OD1-N 3.34Å; D463-F467 WeakPolarHBondContact O-CB 3.4Å; D463-F467 PolarHBondContact O-N 3.15Å
464	P	78.5	Confident	91.4	Very high	98 Å²	98	66.1 Å²	66.1	64%	0.636	34%	0.34	S	S	*	.	S	Bend	trans	-53.9	-32	177.4	-26.3	33.8	0	0	0	114.9
465	N	75.9	Confident	91.5	Very high	148 Å²	148	60.4 Å²	60.4	79%	0.791	31%	0.311	S	S	*	.	S	Bend	trans	-101.8	-31.1	-173.8	-63.3	-45.7	0	0	0	113	D463	D463-N465 PolarHBondContact O-N 2.91Å; D463-N465 VanDerWaalsContact O-N 3.15Å; D463-N465 PolarHBondContact OD1-N 3.18Å
466	D	85.3	Confident	91.7	Very high	79 Å²	79	60.8 Å²	60.8	42%	0.422	31%	0.311	S	S	.	.	S	Bend	trans	-146.3	65.2	-177.3	-164.6	23.9	0	0	0	112.7	S447 D463 Y468	S447-D466 PolarHBondContact OG-OD1 2.63Å; D463-D466 PolarHBondContact OD1-N 3.34Å; D466-Y468 WeakPolarHBondContact O-CD1 3.26Å
467	F	92.4	Very high	91.9	Very high	14 Å²	14	56.6 Å²	56.6	6%	0.061	29%	0.285	C	S	.	.			trans	-71.6	142.4	175.4	63.1	-89.9	0	0	0	111.8	S447 L451 R452 F460 V461 D463	S447-F467 WeakPolarHBondContact CB-O 3.44Å; L451-F467 WeakPolarHBondContact O-CE2 3.47Å; L451-F467 VanDerWaalsContact O-CZ 3.25Å; L451-F467 WeakPolarHBondContact O-CZ 3.39Å; R452-F467 HydrophobicContact CG-CE1 4.23Å; R452-F467 HydrophobicContact CG-CZ 4.27Å; F460-F467 HydrophobicContact CE2-CB 3.91Å; F460-F467 HydrophobicContact CE2-CD2 4.07Å; F460-F467 HydrophobicContact CE2-CG 4.43Å; F460-F467 HydrophobicContact CZ-CB 3.81Å; F460-F467 HydrophobicContact CZ-CD2 4.26Å; F460-F467 HydrophobicContact CZ-CG 4.33Å; V461-F467 VanDerWaalsContact O-CA 3.24Å; V461-F467 WeakPolarHBondContact O-CA 3.49Å; V461-F467 WeakPolarHBondContact O-CB 3.2Å; D463-F467 WeakPolarHBondContact O-CB 3.4Å; D463-F467 PolarHBondContact O-N 3.15Å
468	Y	93.8	Very high	92.1	Very high	41 Å²	41	55.9 Å²	55.9	16%	0.161	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	159	174.7	65	-82.7	0	0	0	112.7	D229 F232 F460 V461 D466 R470	D229-Y468 VanDerWaalsContact OD1-CE2 3.3Å; D229-Y468 WeakPolarHBondContact OD1-CE2 3.44Å; D229-Y468 PolarHBondContact OD1-OH 2.8Å; D229-Y468 PolarHBondContact OD2-OH 3.07Å; D229-Y468 VanDerWaalsContact OD2-OH 3.14Å; F232-Y468 AromaticContact CD1-CD2 3.74Å; F232-Y468 HydrophobicContact CD1-CD2 3.74Å; F232-Y468 AromaticContact CD1-CE2 3.95Å; F232-Y468 HydrophobicContact CD1-CE2 3.95Å; F232-Y468 HydrophobicContact CD2-CD2 4.07Å; F232-Y468 AromaticContact CE1-CD2 3.85Å; F232-Y468 HydrophobicContact CE1-CD2 3.85Å; F232-Y468 HydrophobicContact CE1-CE2 4.3Å; F232-Y468 HydrophobicContact CE1-CG 4.24Å; F232-Y468 HydrophobicContact CE2-CD2 4.16Å; F232-Y468 HydrophobicContact CE2-CG 4.46Å; F232-Y468 AromaticContact CG-CD2 3.86Å; F232-Y468 HydrophobicContact CG-CD2 3.86Å; F232-Y468 HydrophobicContact CG-CE2 4.28Å; F232-Y468 HydrophobicContact CZ-CD2 4.05Å; F232-Y468 HydrophobicContact CZ-CG 4.18Å; F460-Y468 VanDerWaalsContact CD2-O 3.26Å; F460-Y468 WeakPolarHBondContact CD2-O 3.28Å; V461-Y468 HydrophobicContact CB-CD1 4.15Å; V461-Y468 HydrophobicContact CB-CE1 3.84Å; V461-Y468 HydrophobicContact CG1-CD1 4.4Å; V461-Y468 HydrophobicContact CG1-CE1 3.85Å; V461-Y468 HydrophobicContact CG2-CE1 4.08Å; V461-Y468 HydrophobicContact CG2-CE2 4.1Å; V461-Y468 PolarHBondContact N-O 2.59Å; V461-Y468 PolarHBondContact O-N 2.84Å; D466-Y468 WeakPolarHBondContact O-CD1 3.26Å; Y468-R470 HydrophobicContact CD2-CG 4.41Å; Y468-R470 HydrophobicContact CE2-CG 3.83Å
469	Q	93.6	Very high	92.5	Very high	13 Å²	13	56 Å²	56	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	114.1	179.5	-56.4	-94.7	17.3	0	0	108.6	F232 S444 P453 I455 F460 F471 C473	F232-Q469 WeakPolarHBondContact CD2-O 3.36Å; S444-Q469 WeakPolarHBondContact O-CG 3.49Å; S444-Q469 PolarHBondContact O-NE2 3.49Å; S444-Q469 VanDerWaalsContact O-NE2 3.07Å; P453-Q469 VanDerWaalsContact CB-NE2 3.32Å; I455-Q469 PolarHBondContact O-NE2 3.28Å; F460-Q469 HydrophobicContact CD2-CG 4.28Å; Q469-F471 PolarHBondContact O-N 2.91Å; Q469-C473 WeakPolarHBondContact CB-SG 3.33Å
470	R	94.8	Very high	92.9	Very high	60 Å²	60	49.8 Å²	49.8	23%	0.226	26%	0.257	C	S	.	.	S	Bend	trans	-65.7	-29.6	172.8	-74.6	177.8	173.8	151.7	1.6	112.5	M228 D229 F231 Y459 V461 Y468	M228-R470 WeakPolarHBondContact O-CD 3.32Å; D229-R470 WeakPolarHBondContact OD1-CG 3.32Å; D229-R470 IonicContact OD1-CZ 3.6Å; D229-R470 IonicContact OD1-NE 2.65Å; D229-R470 PolarHBondContact OD1-NE 3.06Å; D229-R470 IonicContact OD1-NH2 3.57Å; F231-R470 WeakPolarHBondContact CB-O 3.28Å; Y459-R470 WeakPolarHBondContact O-CB 3.32Å; Y459-R470 WeakPolarHBondContact O-CD 3.46Å; Y459-R470 WeakPolarHBondContact O-CG 3.43Å; V461-R470 HydrophobicContact CG2-CG 4.18Å; Y468-R470 HydrophobicContact CD2-CG 4.41Å; Y468-R470 HydrophobicContact CE2-CG 3.83Å
471	F	95.9	Very high	93.2	Very high	59 Å²	59	47.7 Å²	47.7	26%	0.259	25%	0.248	S	C	.	.	S	Bend	trans	-61.8	133.2	168.6	-178.2	-95.9	0	0	0	109.9	Y457 Q469 C473 F476	Y457-F471 AromaticContact CD1-CD1 3.37Å; Y457-F471 HydrophobicContact CD1-CD1 3.37Å; Y457-F471 AromaticContact CD1-CE1 3.55Å; Y457-F471 HydrophobicContact CD1-CE1 3.55Å; Y457-F471 AromaticContact CD1-CG 3.91Å; Y457-F471 HydrophobicContact CD1-CG 3.91Å; Y457-F471 HydrophobicContact CD1-CZ 4.22Å; Y457-F471 HydrophobicContact CD2-CD1 4.36Å; Y457-F471 AromaticContact CE1-CD1 3.94Å; Y457-F471 HydrophobicContact CE1-CD1 3.94Å; Y457-F471 AromaticContact CE1-CE1 3.69Å; Y457-F471 HydrophobicContact CE1-CE1 3.69Å; Y457-F471 HydrophobicContact CE1-CZ 4.41Å; Y457-F471 HydrophobicContact CG-CB 4.23Å; Y457-F471 AromaticContact CG-CD1 3.61Å; Y457-F471 HydrophobicContact CG-CD1 3.61Å; Y457-F471 HydrophobicContact CG-CE1 4.24Å; Y457-F471 HydrophobicContact CG-CG 4.04Å; Q469-F471 PolarHBondContact O-N 2.91Å; F471-C473 PolarHBondContact O-N 2.9Å; F471-C473 PolarHBondContact O-SG 3.15Å; F471-F476 HydrophobicContact CE1-CB 3.74Å; F471-F476 AromaticContact CE1-CD1 3.89Å; F471-F476 HydrophobicContact CE1-CD1 3.89Å; F471-F476 HydrophobicContact CE1-CD2 4.25Å; F471-F476 AromaticContact CE1-CG 3.71Å; F471-F476 HydrophobicContact CE1-CG 3.71Å; F471-F476 HydrophobicContact CZ-CB 4.16Å; F471-F476 HydrophobicContact CZ-CD1 4.35Å; F471-F476 AromaticContact CZ-CD2 3.97Å; F471-F476 HydrophobicContact CZ-CD2 3.97Å; F471-F476 HydrophobicContact CZ-CE2 4.4Å; F471-F476 AromaticContact CZ-CG 3.91Å; F471-F476 HydrophobicContact CZ-CG 3.91Å
472	P	96.4	Very high	93.5	Very high	31 Å²	31	49.1 Å²	49.1	20%	0.201	25%	0.252	C	S	.	.			trans	-74.1	69.5	-173.6	32.2	-37.2	0	0	0	111.8	D235 K474 T475 F476	D235-P472 HydrophobicContact CB-CB 3.74Å; D235-P472 VanDerWaalsContact CG-CA 3.5Å; D235-P472 VanDerWaalsContact OD2-CA 3.31Å; D235-P472 WeakPolarHBondContact OD2-CA 3.38Å; P472-K474 VanDerWaalsContact C-N 3.28Å; P472-K474 PolarHBondContact O-N 3.01Å; P472-T475 PolarHBondContact O-N 3.32Å; P472-F476 VanDerWaalsContact O-CB 3.29Å; P472-F476 WeakPolarHBondContact O-CB 3.24Å; P472-F476 PolarHBondContact O-N 3.43Å
473	C	96.3	Very high	93.9	Very high	4 Å²	4	48.9 Å²	48.9	3%	0.027	25%	0.25	C	C	.	.	H	α-helix	trans	-60.5	-35.6	-171.1	-67	0	0	0	0	112.5	D235 S444 Y457 Q469 F471 A477	D235-C473 PolarHBondContact OD2-N 3.36Å; S444-C473 WeakPolarHBondContact OG-CB 3.29Å; Y457-C473 WeakPolarHBondContact CD2-SG 3.4Å; Q469-C473 WeakPolarHBondContact CB-SG 3.33Å; F471-C473 PolarHBondContact O-N 2.9Å; F471-C473 PolarHBondContact O-SG 3.15Å; C473-A477 VanDerWaalsContact O-CB 3.28Å; C473-A477 WeakPolarHBondContact O-CB 3.3Å; C473-A477 PolarHBondContact O-N 2.77Å
474	K	97.5	Very high	94.5	Very high	12 Å²	12	46.6 Å²	46.6	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-72.1	-47.8	-175.6	-60.3	166	165.4	69.7	0	110.1	D235 M239 Y402 D406 Y409 E446 P472 F476 A477 M478	D235-K474 WeakPolarHBondContact OD2-CB 3.42Å; D235-K474 PolarHBondContact OD2-N 3.34Å; M239-K474 HydrophobicContact CB-CD 4.39Å; M239-K474 HydrophobicContact CG-CD 4.4Å; M239-K474 HydrophobicContact SD-CD 3.59Å; M239-K474 VanDerWaalsContact SD-CD 3.59Å; Y402-K474 WeakPolarHBondContact OH-CE 3.44Å; D406-K474 VanDerWaalsContact OD2-CE 3.29Å; D406-K474 WeakPolarHBondContact OD2-CE 3.26Å; Y409-K474 HydrophobicContact CD1-CB 4.19Å; Y409-K474 HydrophobicContact CE1-CB 4.07Å; E446-K474 IonicContact OE2-NZ 2.92Å; P472-K474 VanDerWaalsContact C-N 3.28Å; P472-K474 PolarHBondContact O-N 3.01Å; K474-F476 VanDerWaalsContact C-N 3.34Å; K474-A477 PolarHBondContact O-N 3.4Å; K474-M478 WeakPolarHBondContact O-CB 3.22Å; K474-M478 PolarHBondContact O-N 2.94Å
475	T	98.2	Very high	95.4	Very high	21 Å²	21	42 Å²	42	13%	0.129	21%	0.208	C	C	.	.	H	α-helix	trans	-65	-39.6	175.7	-63.5	0	0	0	0	110.8	D235 L238 Y409 P472 M478 L479	D235-T475 WeakPolarHBondContact OD1-CA 3.42Å; D235-T475 WeakPolarHBondContact OD1-CB 3.08Å; D235-T475 PolarHBondContact OD1-N 3.17Å; D235-T475 PolarHBondContact OD1-OG1 3.27Å; L238-T475 HydrophobicContact CD1-CG2 4.19Å; Y409-T475 WeakPolarHBondContact OH-CB 3.18Å; Y409-T475 PolarHBondContact OH-OG1 3.04Å; P472-T475 PolarHBondContact O-N 3.32Å; T475-M478 HydrophobicContact CG2-CE 4.47Å; T475-M478 PolarHBondContact O-N 3.11Å; T475-L479 HydrophobicContact CG2-CD1 3.95Å; T475-L479 HydrophobicContact CG2-CG 4.26Å; T475-L479 WeakPolarHBondContact O-CB 3.47Å; T475-L479 VanDerWaalsContact O-CG 3.25Å; T475-L479 WeakPolarHBondContact O-CG 3.34Å; T475-L479 PolarHBondContact O-N 2.97Å
476	F	97.9	Very high	96.5	Very high	73 Å²	73	36.6 Å²	36.6	32%	0.32	18%	0.18	S	C	.	.	H	α-helix	trans	-59.7	-48.2	172.6	-179.1	-111.2	0	0	0	112.1	V440 Y457 F471 P472 K474 M478 L479 I480	V440-F476 HydrophobicContact CG1-CD1 3.97Å; V440-F476 HydrophobicContact CG1-CE1 4.23Å; Y457-F476 HydrophobicContact CE1-CD1 4.38Å; Y457-F476 HydrophobicContact CE1-CE1 4.17Å; F471-F476 HydrophobicContact CE1-CB 3.74Å; F471-F476 AromaticContact CE1-CD1 3.89Å; F471-F476 HydrophobicContact CE1-CD1 3.89Å; F471-F476 HydrophobicContact CE1-CD2 4.25Å; F471-F476 AromaticContact CE1-CG 3.71Å; F471-F476 HydrophobicContact CE1-CG 3.71Å; F471-F476 HydrophobicContact CZ-CB 4.16Å; F471-F476 HydrophobicContact CZ-CD1 4.35Å; F471-F476 AromaticContact CZ-CD2 3.97Å; F471-F476 HydrophobicContact CZ-CD2 3.97Å; F471-F476 HydrophobicContact CZ-CE2 4.4Å; F471-F476 AromaticContact CZ-CG 3.91Å; F471-F476 HydrophobicContact CZ-CG 3.91Å; P472-F476 VanDerWaalsContact O-CB 3.29Å; P472-F476 WeakPolarHBondContact O-CB 3.24Å; P472-F476 PolarHBondContact O-N 3.43Å; K474-F476 VanDerWaalsContact C-N 3.34Å; F476-M478 VanDerWaalsContact C-N 3.35Å; F476-M478 PolarHBondContact O-N 3.03Å; F476-L479 PolarHBondContact O-N 2.84Å; F476-I480 HydrophobicContact CD1-CD1 3.88Å; F476-I480 HydrophobicContact CD2-CD1 4.2Å; F476-I480 HydrophobicContact CE1-CD1 3.33Å; F476-I480 HydrophobicContact CE2-CD1 3.69Å; F476-I480 HydrophobicContact CE2-CG1 4.28Å; F476-I480 HydrophobicContact CG-CD1 4.3Å; F476-I480 HydrophobicContact CZ-CD1 3.25Å; F476-I480 HydrophobicContact CZ-CG1 4.3Å; F476-I480 WeakPolarHBondContact O-CB 3.14Å; F476-I480 WeakPolarHBondContact O-CG1 3.24Å; F476-I480 PolarHBondContact O-N 2.96Å
477	A	98.3	Very high	97.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-41.4	176.9	0	0	0	0	0	112.1	V410 V440 R441 C473 K474 S481	V410-A477 HydrophobicContact CG1-CB 3.63Å; V410-A477 HydrophobicContact CG2-CB 4.18Å; V440-A477 HydrophobicContact CB-CB 4.13Å; V440-A477 HydrophobicContact CG1-CB 3.76Å; R441-A477 HydrophobicContact CB-CB 4.19Å; C473-A477 VanDerWaalsContact O-CB 3.28Å; C473-A477 WeakPolarHBondContact O-CB 3.3Å; C473-A477 PolarHBondContact O-N 2.77Å; K474-A477 PolarHBondContact O-N 3.4Å; A477-S481 WeakPolarHBondContact O-CB 3.2Å; A477-S481 PolarHBondContact O-N 2.92Å; A477-S481 PolarHBondContact O-OG 3.34Å
478	M	98.4	Very high	97.4	Very high	18 Å²	18	37.4 Å²	37.4	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-48.4	176.2	-177.2	-79.4	-66.9	0	0	111.5	Y409 F413 P414 K474 T475 F476 S481 F482	Y409-M478 HydrophobicContact CD1-CB 4.4Å; Y409-M478 HydrophobicContact CD2-CG 4.03Å; Y409-M478 HydrophobicContact CE1-CB 4.04Å; Y409-M478 HydrophobicContact CE1-CG 4.46Å; Y409-M478 HydrophobicContact CE2-CB 4.17Å; Y409-M478 HydrophobicContact CE2-CE 3.83Å; Y409-M478 HydrophobicContact CE2-CG 3.69Å; Y409-M478 HydrophobicContact CE2-SD 4.45Å; Y409-M478 WeakPolarHBondContact O-CG 3.39Å; Y409-M478 WeakPolarHBondContact OH-CE 3.31Å; F413-M478 HydrophobicContact CD1-CG 4.32Å; F413-M478 HydrophobicContact CD1-SD 4.18Å; F413-M478 HydrophobicContact CE1-SD 4.49Å; P414-M478 HydrophobicContact CG-CG 4.3Å; K474-M478 WeakPolarHBondContact O-CB 3.22Å; K474-M478 PolarHBondContact O-N 2.94Å; T475-M478 HydrophobicContact CG2-CE 4.47Å; T475-M478 PolarHBondContact O-N 3.11Å; F476-M478 VanDerWaalsContact C-N 3.35Å; F476-M478 PolarHBondContact O-N 3.03Å; M478-S481 WeakPolarHBondContact O-CB 3.41Å; M478-S481 PolarHBondContact O-N 2.98Å; M478-F482 PolarHBondContact O-N 2.95Å
479	L	98.6	Very high	97.6	Very high	83 Å²	83	35.5 Å²	35.5	44%	0.435	18%	0.182	S	C	.	.	H	α-helix	trans	-63.3	-44	179.5	-73.2	173.2	0	0	0	111.6	T475 F476 S481 F482 I483	T475-L479 HydrophobicContact CG2-CD1 3.95Å; T475-L479 HydrophobicContact CG2-CG 4.26Å; T475-L479 WeakPolarHBondContact O-CB 3.47Å; T475-L479 VanDerWaalsContact O-CG 3.25Å; T475-L479 WeakPolarHBondContact O-CG 3.34Å; T475-L479 PolarHBondContact O-N 2.97Å; F476-L479 PolarHBondContact O-N 2.84Å; L479-S481 VanDerWaalsContact C-N 3.32Å; L479-S481 PolarHBondContact O-N 3.12Å; L479-F482 WeakPolarHBondContact O-CB 3.42Å; L479-F482 PolarHBondContact O-N 2.94Å; L479-I483 WeakPolarHBondContact O-CB 3.46Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.37Å; L479-I483 PolarHBondContact O-N 2.85Å
480	I	98.1	Very high	97.7	Very high	42 Å²	42	40.9 Å²	40.9	22%	0.215	20%	0.203	C	C	.	.	H	α-helix	trans	-59.6	-45.9	173.8	-74.2	179.3	0	0	0	110.3	I436 F476 F482 I483 V484	I436-I480 HydrophobicContact CG2-CG2 3.45Å; I436-I480 VanDerWaalsContact CG2-CG2 3.45Å; F476-I480 HydrophobicContact CD1-CD1 3.88Å; F476-I480 HydrophobicContact CD2-CD1 4.2Å; F476-I480 HydrophobicContact CE1-CD1 3.33Å; F476-I480 HydrophobicContact CE2-CD1 3.69Å; F476-I480 HydrophobicContact CE2-CG1 4.28Å; F476-I480 HydrophobicContact CG-CD1 4.3Å; F476-I480 HydrophobicContact CZ-CD1 3.25Å; F476-I480 HydrophobicContact CZ-CG1 4.3Å; F476-I480 WeakPolarHBondContact O-CB 3.14Å; F476-I480 WeakPolarHBondContact O-CG1 3.24Å; F476-I480 PolarHBondContact O-N 2.96Å; I480-F482 VanDerWaalsContact C-N 3.28Å; I480-F482 PolarHBondContact O-N 3.08Å; I480-I483 PolarHBondContact O-N 3.45Å; I480-V484 HydrophobicContact CG2-CG2 3.97Å; I480-V484 VanDerWaalsContact O-CB 3.26Å; I480-V484 WeakPolarHBondContact O-CB 3.28Å; I480-V484 WeakPolarHBondContact O-CG2 3.46Å; I480-V484 PolarHBondContact O-N 3.43Å
481	S	98.3	Very high	97.9	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.014	22%	0.219	C	C	.	.	H	α-helix	trans	-58.2	-43.2	177.8	-58.8	0	0	0	0	111.3	V410 S433 G437 A477 M478 L479 S485	V410-S481 WeakPolarHBondContact O-CB 3.27Å; V410-S481 PolarHBondContact O-OG 3.3Å; S433-S481 WeakPolarHBondContact CB-O 3.29Å; G437-S481 WeakPolarHBondContact CA-OG 3.36Å; A477-S481 WeakPolarHBondContact O-CB 3.2Å; A477-S481 PolarHBondContact O-N 2.92Å; A477-S481 PolarHBondContact O-OG 3.34Å; M478-S481 WeakPolarHBondContact O-CB 3.41Å; M478-S481 PolarHBondContact O-N 2.98Å; L479-S481 VanDerWaalsContact C-N 3.32Å; L479-S481 PolarHBondContact O-N 3.12Å; S481-S485 VanDerWaalsContact O-CB 3.26Å; S481-S485 WeakPolarHBondContact O-CB 3.24Å; S481-S485 PolarHBondContact O-N 2.92Å
482	F	98.6	Very high	97.8	Very high	61 Å²	61	41.4 Å²	41.4	27%	0.268	21%	0.212	S	C	.	.	H	α-helix	trans	-63.1	-51.7	176.3	-171.7	-120.6	0	0	0	112.3	P414 I417 M478 L479 I480 V484 S485 V486	P414-F482 HydrophobicContact CB-CB 3.67Å; P414-F482 HydrophobicContact CB-CD2 3.82Å; P414-F482 HydrophobicContact CB-CG 4.19Å; I417-F482 HydrophobicContact CB-CE2 4.11Å; I417-F482 HydrophobicContact CG2-CE2 3.69Å; I417-F482 HydrophobicContact CG2-CZ 4.07Å; M478-F482 PolarHBondContact O-N 2.95Å; L479-F482 WeakPolarHBondContact O-CB 3.42Å; L479-F482 PolarHBondContact O-N 2.94Å; I480-F482 VanDerWaalsContact C-N 3.28Å; I480-F482 PolarHBondContact O-N 3.08Å; F482-V484 PolarHBondContact O-N 3.01Å; F482-S485 WeakPolarHBondContact O-CB 3.38Å; F482-S485 PolarHBondContact O-N 3.3Å; F482-V486 HydrophobicContact CD2-CG2 4.34Å; F482-V486 HydrophobicContact CE1-CG2 4.4Å; F482-V486 HydrophobicContact CE2-CG2 3.99Å; F482-V486 HydrophobicContact CZ-CG2 4.03Å; F482-V486 WeakPolarHBondContact O-CG2 3.38Å; F482-V486 PolarHBondContact O-N 3.44Å
483	I	98.7	Very high	97.7	Very high	97 Å²	97	40.8 Å²	40.8	50%	0.497	21%	0.207	S	C	.	.	H	α-helix	trans	-60	-49.1	-178.9	-68.7	165.6	0	0	0	110.2	L479 I480 S485 V486 C487	L479-I483 WeakPolarHBondContact O-CB 3.46Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.37Å; L479-I483 PolarHBondContact O-N 2.85Å; I480-I483 PolarHBondContact O-N 3.45Å; I483-S485 VanDerWaalsContact C-N 3.31Å; I483-S485 PolarHBondContact O-N 2.99Å; I483-V486 PolarHBondContact O-N 2.83Å; I483-C487 VanDerWaalsContact O-CB 3.3Å; I483-C487 WeakPolarHBondContact O-CB 3.28Å; I483-C487 PolarHBondContact O-N 3.23Å; I483-C487 PolarHBondContact O-SG 2.79Å
484	V	98.7	Very high	97.6	Very high	23 Å²	23	44.6 Å²	44.6	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-58.1	-45.4	177.3	168.5	0	0	0	0	110.8	C432 I436 I480 F482 V486 I488	C432-V484 HydrophobicContact CB-CG1 3.85Å; I436-V484 HydrophobicContact CD1-CG1 3.92Å; I436-V484 HydrophobicContact CD1-CG2 3.92Å; I436-V484 HydrophobicContact CG2-CG2 4.45Å; I480-V484 HydrophobicContact CG2-CG2 3.97Å; I480-V484 VanDerWaalsContact O-CB 3.26Å; I480-V484 WeakPolarHBondContact O-CB 3.28Å; I480-V484 WeakPolarHBondContact O-CG2 3.46Å; I480-V484 PolarHBondContact O-N 3.43Å; F482-V484 PolarHBondContact O-N 3.01Å; V484-V486 PolarHBondContact O-N 3.48Å; V484-I488 HydrophobicContact CG1-CD1 3.63Å; V484-I488 HydrophobicContact CG1-CG1 4.4Å; V484-I488 WeakPolarHBondContact O-CB 3.47Å; V484-I488 WeakPolarHBondContact O-CG1 3.47Å; V484-I488 PolarHBondContact O-N 3.28Å
485	S	98.4	Very high	97.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59	-48.2	179.4	-173.1	0	0	0	0	111.3	C418 S481 F482 I483 S489	C418-S485 PolarHBondContact SG-OG 3.47Å; S481-S485 VanDerWaalsContact O-CB 3.26Å; S481-S485 WeakPolarHBondContact O-CB 3.24Å; S481-S485 PolarHBondContact O-N 2.92Å; F482-S485 WeakPolarHBondContact O-CB 3.38Å; F482-S485 PolarHBondContact O-N 3.3Å; I483-S485 VanDerWaalsContact C-N 3.31Å; I483-S485 PolarHBondContact O-N 2.99Å; S485-S489 WeakPolarHBondContact O-CB 3.48Å; S485-S489 PolarHBondContact O-N 2.74Å; S485-S489 VanDerWaalsContact O-N 3.08Å; S485-S489 PolarHBondContact O-OG 3.4Å
486	V	98.4	Very high	97.1	Very high	35 Å²	35	48 Å²	48	21%	0.212	24%	0.237	C	C	.	.	H	α-helix	trans	-67.8	-51.8	-179.4	174.3	0	0	0	0	111.1	V422 F424 F482 I483 V484 S489 Y490	V422-V486 HydrophobicContact CG2-CG2 4.47Å; F424-V486 HydrophobicContact CE2-CG1 4.02Å; F424-V486 HydrophobicContact CZ-CG1 3.96Å; F482-V486 HydrophobicContact CD2-CG2 4.34Å; F482-V486 HydrophobicContact CE1-CG2 4.4Å; F482-V486 HydrophobicContact CE2-CG2 3.99Å; F482-V486 HydrophobicContact CZ-CG2 4.03Å; F482-V486 WeakPolarHBondContact O-CG2 3.38Å; F482-V486 PolarHBondContact O-N 3.44Å; I483-V486 PolarHBondContact O-N 2.83Å; V484-V486 PolarHBondContact O-N 3.48Å; V486-S489 PolarHBondContact O-N 2.77Å; V486-Y490 VanDerWaalsContact O-CB 3.3Å; V486-Y490 WeakPolarHBondContact O-CB 3.39Å; V486-Y490 PolarHBondContact O-N 3.26Å
487	C	98.5	Very high	96.7	Very high	63 Å²	63	49.4 Å²	49.4	43%	0.426	24%	0.24	S	C	.	.	H	α-helix	trans	-62.4	-49.4	-176.2	-70.2	0	0	0	0	112.2	I483 S489 Y490 I491	I483-C487 VanDerWaalsContact O-CB 3.3Å; I483-C487 WeakPolarHBondContact O-CB 3.28Å; I483-C487 PolarHBondContact O-N 3.23Å; I483-C487 PolarHBondContact O-SG 2.79Å; C487-S489 VanDerWaalsContact C-N 3.34Å; C487-S489 PolarHBondContact O-N 2.8Å; C487-Y490 PolarHBondContact O-N 3.1Å; C487-I491 VanDerWaalsContact O-CG1 3.27Å; C487-I491 WeakPolarHBondContact O-CG1 3.33Å; C487-I491 PolarHBondContact O-N 3.42Å
488	I	98.4	Very high	96.3	Very high	48 Å²	48	52.6 Å²	52.6	25%	0.246	27%	0.267	C	S	.	.	H	α-helix	trans	-68.4	-38.4	-179.7	-66.4	177.8	0	0	0	110.5	C432 V484 Y490 I491 T492	C432-I488 HydrophobicContact CB-CD1 3.3Å; V484-I488 HydrophobicContact CG1-CD1 3.63Å; V484-I488 HydrophobicContact CG1-CG1 4.4Å; V484-I488 WeakPolarHBondContact O-CB 3.47Å; V484-I488 WeakPolarHBondContact O-CG1 3.47Å; V484-I488 PolarHBondContact O-N 3.28Å; I488-Y490 VanDerWaalsContact C-N 3.32Å; I488-Y490 PolarHBondContact O-N 3.14Å; I488-I491 PolarHBondContact O-N 2.95Å; I488-T492 HydrophobicContact CG2-CG2 4.3Å; I488-T492 WeakPolarHBondContact O-CB 3.36Å; I488-T492 WeakPolarHBondContact O-CG2 3.43Å; I488-T492 PolarHBondContact O-N 3.39Å; I488-T492 PolarHBondContact O-OG1 3.48Å
489	S	97.6	Very high	95.8	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-42.9	174.5	-66.6	0	0	0	0	111.8	S425 N426 S485 V486 C487 T492 D493	S425-S489 WeakPolarHBondContact CA-OG 3.23Å; N426-S489 PolarHBondContact N-OG 3.42Å; N426-S489 VanDerWaalsContact ND2-CA 3.32Å; N426-S489 WeakPolarHBondContact ND2-CA 3.33Å; N426-S489 PolarHBondContact ND2-O 3.44Å; S485-S489 WeakPolarHBondContact O-CB 3.48Å; S485-S489 PolarHBondContact O-N 2.74Å; S485-S489 VanDerWaalsContact O-N 3.08Å; S485-S489 PolarHBondContact O-OG 3.4Å; V486-S489 PolarHBondContact O-N 2.77Å; C487-S489 VanDerWaalsContact C-N 3.34Å; C487-S489 PolarHBondContact O-N 2.8Å; S489-T492 WeakPolarHBondContact CA-OG1 3.44Å; S489-T492 PolarHBondContact O-OG1 2.92Å; S489-T492 VanDerWaalsContact O-OG1 3.05Å; S489-D493 WeakPolarHBondContact O-CB 3.31Å; S489-D493 PolarHBondContact O-N 3.33Å
490	Y	96.5	Very high	95.1	Very high	127 Å²	127	52.8 Å²	52.8	50%	0.498	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-48.5	178.5	-178.6	-107.3	0	0	0	112.2	F424 V486 C487 I488 T492 D493 I494	F424-Y490 HydrophobicContact CD2-CD2 4.44Å; F424-Y490 HydrophobicContact CE1-CD2 4.47Å; F424-Y490 HydrophobicContact CE2-CD2 4.28Å; F424-Y490 HydrophobicContact CZ-CD2 4.29Å; V486-Y490 VanDerWaalsContact O-CB 3.3Å; V486-Y490 WeakPolarHBondContact O-CB 3.39Å; V486-Y490 PolarHBondContact O-N 3.26Å; C487-Y490 PolarHBondContact O-N 3.1Å; I488-Y490 VanDerWaalsContact C-N 3.32Å; I488-Y490 PolarHBondContact O-N 3.14Å; Y490-T492 VanDerWaalsContact C-N 3.33Å; Y490-T492 PolarHBondContact O-N 3.04Å; Y490-D493 PolarHBondContact O-N 3.49Å; Y490-I494 HydrophobicContact CD1-CD1 3.94Å; Y490-I494 HydrophobicContact CD2-CD1 4.32Å; Y490-I494 HydrophobicContact CE1-CD1 3.36Å; Y490-I494 HydrophobicContact CE2-CD1 3.78Å; Y490-I494 HydrophobicContact CE2-CG1 4.38Å; Y490-I494 HydrophobicContact CG-CD1 4.4Å; Y490-I494 WeakPolarHBondContact O-CG1 3.29Å; Y490-I494 PolarHBondContact O-N 2.78Å; Y490-I494 WeakPolarHBondContact OH-CD1 3.42Å
491	I	97.4	Very high	94.6	Very high	110 Å²	110	58.2 Å²	58.2	56%	0.564	29%	0.294	S	S	*	.	H	α-helix	trans	-58.7	-46.7	178.4	-69.4	165.6	0	0	0	110.4	C487 I488 Y495	C487-I491 VanDerWaalsContact O-CG1 3.27Å; C487-I491 WeakPolarHBondContact O-CG1 3.33Å; C487-I491 PolarHBondContact O-N 3.42Å; I488-I491 PolarHBondContact O-N 2.95Å; I491-Y495 VanDerWaalsContact O-CB 3.24Å; I491-Y495 WeakPolarHBondContact O-CB 3.16Å; I491-Y495 PolarHBondContact O-N 2.62Å
492	T	95.6	Very high	94.2	Very high	20 Å²	20	61.9 Å²	61.9	12%	0.123	31%	0.308	C	S	.	.	H	α-helix	trans	-69.8	-38	179.7	52.2	0	0	0	0	112.3	N426 Y428 I488 S489 Y490 Y495 F496	N426-T492 PolarHBondContact ND2-OG1 3.23Å; N426-T492 PolarHBondContact OD1-OG1 2.84Å; Y428-T492 HydrophobicContact CD2-CG2 4.26Å; Y428-T492 HydrophobicContact CG-CG2 3.99Å; I488-T492 HydrophobicContact CG2-CG2 4.3Å; I488-T492 WeakPolarHBondContact O-CB 3.36Å; I488-T492 WeakPolarHBondContact O-CG2 3.43Å; I488-T492 PolarHBondContact O-N 3.39Å; I488-T492 PolarHBondContact O-OG1 3.48Å; S489-T492 WeakPolarHBondContact CA-OG1 3.44Å; S489-T492 PolarHBondContact O-OG1 2.92Å; S489-T492 VanDerWaalsContact O-OG1 3.05Å; Y490-T492 VanDerWaalsContact C-N 3.33Å; Y490-T492 PolarHBondContact O-N 3.04Å; T492-Y495 PolarHBondContact O-N 3.2Å; T492-F496 WeakPolarHBondContact O-CD2 3.41Å; T492-F496 PolarHBondContact O-N 3.18Å
493	D	93.2	Very high	93.7	Very high	18 Å²	18	60.7 Å²	60.7	10%	0.096	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-46.7	176	-171.9	75.4	0	0	0	111.5	F424 S489 Y490 R497 Y511	F424-D493 HydrophobicContact CB-CB 4.05Å; S489-D493 WeakPolarHBondContact O-CB 3.31Å; S489-D493 PolarHBondContact O-N 3.33Å; Y490-D493 PolarHBondContact O-N 3.49Å; D493-R497 WeakPolarHBondContact O-CB 3.25Å; D493-R497 WeakPolarHBondContact O-CD 3.31Å; D493-R497 WeakPolarHBondContact O-CG 3.11Å; D493-R497 PolarHBondContact O-N 3.37Å; D493-R497 IonicContact OD1-CZ 2.71Å; D493-R497 IonicContact OD1-NE 3.93Å; D493-R497 PolarHBondContact OD1-NE 2.93Å; D493-R497 IonicContact OD1-NH2 3.58Å; D493-R497 VanDerWaalsContact OD2-CD 3.28Å; D493-R497 WeakPolarHBondContact OD2-CD 3.48Å; D493-R497 IonicContact OD2-NE 3.57Å; D493-R497 PolarHBondContact OD2-NE 3.33Å; D493-R497 VanDerWaalsContact OD2-NE 3.07Å; D493-Y511 WeakPolarHBondContact CA-OH 3.27Å; D493-Y511 WeakPolarHBondContact CB-OH 3.42Å; D493-Y511 PolarHBondContact N-OH 3.2Å; D493-Y511 VanDerWaalsContact OD1-CE1 3.31Å; D493-Y511 WeakPolarHBondContact OD1-CE1 3.36Å; D493-Y511 PolarHBondContact OD1-OH 2.94Å
494	I	93.6	Very high	93.3	Very high	83 Å²	83	63.5 Å²	63.5	43%	0.426	31%	0.312	S	S	.	.	H	α-helix	trans	-60.9	-48.3	172.9	-70.4	177	0	0	0	110.8	Y490 F496 R497 A498	Y490-I494 HydrophobicContact CD1-CD1 3.94Å; Y490-I494 HydrophobicContact CD2-CD1 4.32Å; Y490-I494 HydrophobicContact CE1-CD1 3.36Å; Y490-I494 HydrophobicContact CE2-CD1 3.78Å; Y490-I494 HydrophobicContact CE2-CG1 4.38Å; Y490-I494 HydrophobicContact CG-CD1 4.4Å; Y490-I494 WeakPolarHBondContact O-CG1 3.29Å; Y490-I494 PolarHBondContact O-N 2.78Å; Y490-I494 WeakPolarHBondContact OH-CD1 3.42Å; I494-F496 PolarHBondContact O-N 2.91Å; I494-R497 PolarHBondContact O-N 3Å; I494-A498 WeakPolarHBondContact O-CB 3.46Å; I494-A498 PolarHBondContact O-N 2.95Å
495	Y	93.5	Very high	92.9	Very high	98 Å²	98	68.5 Å²	68.5	38%	0.384	33%	0.33	S	S	.	.	H	α-helix	trans	-58.2	-47.5	-175.6	179.4	-97.1	0	0	0	112	I491 T492 R502	I491-Y495 VanDerWaalsContact O-CB 3.24Å; I491-Y495 WeakPolarHBondContact O-CB 3.16Å; I491-Y495 PolarHBondContact O-N 2.62Å; T492-Y495 PolarHBondContact O-N 3.2Å; Y495-R502 HydrophobicContact CE1-CB 4.12Å; Y495-R502 HydrophobicContact CE1-CG 4.39Å; Y495-R502 WeakPolarHBondContact O-CD 3.43Å; Y495-R502 PolarHBondContact O-NH1 3.39Å
496	F	93.3	Very high	92.6	Very high	8 Å²	8	69 Å²	69	4%	0.035	33%	0.332	C	S	.	.	H	α-helix	trans	-79.8	-27.2	-177.8	-71.9	-62.8	0	0	0	113.7	Y428 T492 I494 R502 L503 D506 Y511 I523	Y428-F496 HydrophobicContact CD2-CE2 4.32Å; Y428-F496 AromaticContact CE2-CE2 3.67Å; Y428-F496 HydrophobicContact CE2-CE2 3.67Å; Y428-F496 HydrophobicContact CE2-CZ 4.25Å; Y428-F496 AromaticContact CZ-CE2 3.96Å; T492-F496 WeakPolarHBondContact O-CD2 3.41Å; T492-F496 PolarHBondContact O-N 3.18Å; I494-F496 PolarHBondContact O-N 2.91Å; F496-R502 HydrophobicContact CD1-CB 4.39Å; F496-R502 WeakPolarHBondContact CE1-O 3.12Å; F496-L503 HydrophobicContact CB-CD2 4.45Å; F496-D506 HydrophobicContact CD1-CB 4.05Å; F496-D506 HydrophobicContact CE1-CB 3.68Å; F496-D506 HydrophobicContact CZ-CB 3.99Å; F496-Y511 HydrophobicContact CB-CD2 3.52Å; F496-Y511 HydrophobicContact CB-CE2 3.76Å; F496-Y511 HydrophobicContact CB-CG 4.01Å; F496-Y511 AromaticContact CD2-CD2 3.67Å; F496-Y511 HydrophobicContact CD2-CD2 3.67Å; F496-Y511 AromaticContact CD2-CE2 3.39Å; F496-Y511 HydrophobicContact CD2-CE2 3.39Å; F496-Y511 HydrophobicContact CE2-CE2 4.28Å; F496-Y511 AromaticContact CG-CD2 3.7Å; F496-Y511 HydrophobicContact CG-CD2 3.7Å; F496-Y511 AromaticContact CG-CE2 3.86Å; F496-Y511 HydrophobicContact CG-CE2 3.86Å; F496-I523 WeakPolarHBondContact O-CD1 3.45Å
497	R	89.1	Confident	92.3	Very high	101 Å²	101	73.8 Å²	73.8	38%	0.381	36%	0.356	S	S	.	.	H	α-helix	trans	-78.7	-22.1	176.5	-72.7	174.4	178.9	-92	-4.5	113.9	D493 I494 I523 N525	D493-R497 WeakPolarHBondContact O-CB 3.25Å; D493-R497 WeakPolarHBondContact O-CD 3.31Å; D493-R497 WeakPolarHBondContact O-CG 3.11Å; D493-R497 PolarHBondContact O-N 3.37Å; D493-R497 IonicContact OD1-CZ 2.71Å; D493-R497 IonicContact OD1-NE 3.93Å; D493-R497 PolarHBondContact OD1-NE 2.93Å; D493-R497 IonicContact OD1-NH2 3.58Å; D493-R497 VanDerWaalsContact OD2-CD 3.28Å; D493-R497 WeakPolarHBondContact OD2-CD 3.48Å; D493-R497 IonicContact OD2-NE 3.57Å; D493-R497 PolarHBondContact OD2-NE 3.33Å; D493-R497 VanDerWaalsContact OD2-NE 3.07Å; I494-R497 PolarHBondContact O-N 3Å; R497-I523 HydrophobicContact CG-CB 4.47Å; R497-I523 HydrophobicContact CG-CG2 4.33Å; R497-I523 PolarHBondContact NH1-O 3.47Å; R497-N525 PolarHBondContact NH2-OD1 3.11Å
498	A	89.9	Confident	91.9	Very high	68 Å²	68	74.7 Å²	74.7	56%	0.562	35%	0.352	S	S	*	.	H	α-helix	trans	-67.6	-33.4	-176.8	0	0	0	0	0	113.8	I494	I494-A498 WeakPolarHBondContact O-CB 3.46Å; I494-A498 PolarHBondContact O-N 2.95Å
499	D	87	Confident	91.5	Very high	63 Å²	63	80 Å²	80	34%	0.337	37%	0.369	S	S	.	.			trans	-153.5	126.7	-178.7	178.3	4.5	0	0	0	110.5	K501 R502	D499-K501 PolarHBondContact O-N 2.9Å; D499-K501 WeakPolarHBondContact OD1-CB 3.37Å; D499-K501 PolarHBondContact OD1-N 3.46Å; D499-R502 HydrophobicContact CB-CG 4.05Å; D499-R502 VanDerWaalsContact O-CB 3.27Å; D499-R502 WeakPolarHBondContact O-CB 3.35Å; D499-R502 PolarHBondContact O-N 3.25Å
500	S	84.4	Confident	90.9	Very high	42 Å²	42	80.3 Å²	80.3	29%	0.294	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-68.3	-22.9	-177.2	89.2	0	0	0	0	113.3	R502 L503 E513	S500-R502 PolarHBondContact O-N 3.37Å; S500-R502 VanDerWaalsContact O-N 3.13Å; S500-L503 VanDerWaalsContact O-CB 3.3Å; S500-L503 WeakPolarHBondContact O-CB 3.49Å; S500-L503 WeakPolarHBondContact O-CG 3.11Å; S500-L503 PolarHBondContact O-N 2.86Å; S500-E513 WeakPolarHBondContact CB-OE1 3.28Å; S500-E513 PolarHBondContact OG-OE1 3.18Å
501	K	87.6	Confident	90.5	Very high	156 Å²	156	74.7 Å²	74.7	68%	0.678	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-61.2	-21	171.3	-64	177.1	-179.4	175.5	0	112.5	D499 L503 K504	D499-K501 PolarHBondContact O-N 2.9Å; D499-K501 WeakPolarHBondContact OD1-CB 3.37Å; D499-K501 PolarHBondContact OD1-N 3.46Å; K501-L503 VanDerWaalsContact C-N 3.32Å; K501-K504 WeakPolarHBondContact O-CD 3.44Å; K501-K504 VanDerWaalsContact O-CG 3.3Å; K501-K504 WeakPolarHBondContact O-CG 3.45Å
502	R	89.6	Confident	89.9	Confident	79 Å²	79	75.5 Å²	75.5	30%	0.298	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-78.1	-15.3	178	-61.5	174.2	179.4	-173.2	-0.6	113.1	Y495 F496 D499 S500 K504 Y505	Y495-R502 HydrophobicContact CE1-CB 4.12Å; Y495-R502 HydrophobicContact CE1-CG 4.39Å; Y495-R502 WeakPolarHBondContact O-CD 3.43Å; Y495-R502 PolarHBondContact O-NH1 3.39Å; F496-R502 HydrophobicContact CD1-CB 4.39Å; F496-R502 WeakPolarHBondContact CE1-O 3.12Å; D499-R502 HydrophobicContact CB-CG 4.05Å; D499-R502 VanDerWaalsContact O-CB 3.27Å; D499-R502 WeakPolarHBondContact O-CB 3.35Å; D499-R502 PolarHBondContact O-N 3.25Å; S500-R502 PolarHBondContact O-N 3.37Å; S500-R502 VanDerWaalsContact O-N 3.13Å; R502-K504 PolarHBondContact O-N 2.93Å; R502-K504 VanDerWaalsContact O-N 3.1Å; R502-Y505 WeakPolarHBondContact O-CB 3.23Å; R502-Y505 PolarHBondContact O-N 3.41Å
503	L	88.7	Confident	89.3	Confident	35 Å²	35	78.6 Å²	78.6	18%	0.183	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-61.9	-19.7	178.4	-64.8	176.2	0	0	0	113.1	F496 S500 K501 Y505 D506 Y511 E513 I523	F496-L503 HydrophobicContact CB-CD2 4.45Å; S500-L503 VanDerWaalsContact O-CB 3.3Å; S500-L503 WeakPolarHBondContact O-CB 3.49Å; S500-L503 WeakPolarHBondContact O-CG 3.11Å; S500-L503 PolarHBondContact O-N 2.86Å; K501-L503 VanDerWaalsContact C-N 3.32Å; L503-Y505 PolarHBondContact O-N 3.46Å; L503-D506 WeakPolarHBondContact O-CB 3.19Å; L503-D506 PolarHBondContact O-N 3.11Å; L503-D506 VanDerWaalsContact O-N 3.08Å; L503-Y511 HydrophobicContact CD2-CG 4.48Å; L503-E513 HydrophobicContact CD1-CG 3.66Å; L503-I523 HydrophobicContact CD1-CD1 4.4Å; L503-I523 HydrophobicContact CD1-CG1 4.48Å; L503-I523 HydrophobicContact CD2-CG2 4.12Å
504	K	89.1	Confident	88.5	Confident	156 Å²	156	83.4 Å²	83.4	68%	0.678	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-62.6	-22.1	170.6	73.5	-170.6	-180	171	0	113.4	K501 R502	K501-K504 WeakPolarHBondContact O-CD 3.44Å; K501-K504 VanDerWaalsContact O-CG 3.3Å; K501-K504 WeakPolarHBondContact O-CG 3.45Å; R502-K504 PolarHBondContact O-N 2.93Å; R502-K504 VanDerWaalsContact O-N 3.1Å
505	Y	91.2	Very high	87.4	Confident	129 Å²	129	87.1 Å²	87.1	51%	0.506	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-94.6	0	176	-53.8	-66.4	0	0	0	112.9	R502 L503 I507	R502-Y505 WeakPolarHBondContact O-CB 3.23Å; R502-Y505 PolarHBondContact O-N 3.41Å; L503-Y505 PolarHBondContact O-N 3.46Å; Y505-I507 VanDerWaalsContact C-N 3.29Å; Y505-I507 PolarHBondContact O-N 3.35Å
506	D	91.8	Very high	86	Confident	10 Å²	10	84.2 Å²	84.2	5%	0.053	39%	0.388	C	S	.	.			trans	-79.1	77.4	177.5	-175.7	9.3	0	0	0	110.7	Y428 F496 L503 F508 R509 C510 Y511	Y428-D506 WeakPolarHBondContact OH-CA 3.45Å; Y428-D506 PolarHBondContact OH-OD1 3.28Å; F496-D506 HydrophobicContact CD1-CB 4.05Å; F496-D506 HydrophobicContact CE1-CB 3.68Å; F496-D506 HydrophobicContact CZ-CB 3.99Å; L503-D506 WeakPolarHBondContact O-CB 3.19Å; L503-D506 PolarHBondContact O-N 3.11Å; L503-D506 VanDerWaalsContact O-N 3.08Å; D506-F508 VanDerWaalsContact C-N 3.29Å; D506-F508 PolarHBondContact O-N 3.08Å; D506-R509 VanDerWaalsContact CG-CA 3.45Å; D506-R509 PolarHBondContact O-N 2.98Å; D506-R509 WeakPolarHBondContact OD1-CA 3.45Å; D506-R509 PolarHBondContact OD1-N 3.18Å; D506-R509 VanDerWaalsContact OD2-CA 3.25Å; D506-R509 WeakPolarHBondContact OD2-CA 3.35Å; D506-C510 VanDerWaalsContact CG-N 3.31Å; D506-C510 PolarHBondContact OD1-N 2.73Å; D506-C510 PolarHBondContact OD2-N 3Å; D506-Y511 WeakPolarHBondContact OD2-CD2 3.46Å; D506-Y511 PolarHBondContact OD2-N 3.16Å
507	I	92.2	Very high	84.6	Confident	136 Å²	136	93.6 Å²	93.6	70%	0.697	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-44.7	178.9	-60.5	170.8	0	0	0	111.7	Y428 Y505 R509	Y428-I507 PolarHBondContact OH-N 3.24Å; Y505-I507 VanDerWaalsContact C-N 3.29Å; Y505-I507 PolarHBondContact O-N 3.35Å; I507-R509 VanDerWaalsContact C-N 3.27Å; I507-R509 PolarHBondContact O-N 2.89Å
508	F	91	Very high	83.8	Confident	82 Å²	82	94.8 Å²	94.8	36%	0.36	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-3.4	-179.3	-63.2	-54.8	0	0	0	113.4	T427 Y428 L431 D506 C510	T427-F508 HydrophobicContact CG2-CB 4.12Å; T427-F508 HydrophobicContact CG2-CD1 4.16Å; T427-F508 HydrophobicContact CG2-CD2 4.14Å; T427-F508 HydrophobicContact CG2-CG 3.88Å; Y428-F508 AromaticContact CD1-CD2 3.5Å; Y428-F508 HydrophobicContact CD1-CD2 3.5Å; Y428-F508 AromaticContact CD1-CE2 3.59Å; Y428-F508 HydrophobicContact CD1-CE2 3.59Å; Y428-F508 AromaticContact CD2-CD2 3.98Å; Y428-F508 HydrophobicContact CD2-CD2 3.98Å; Y428-F508 AromaticContact CE1-CD2 3.35Å; Y428-F508 HydrophobicContact CE1-CD2 3.35Å; Y428-F508 AromaticContact CE1-CE2 3.63Å; Y428-F508 HydrophobicContact CE1-CE2 3.63Å; Y428-F508 HydrophobicContact CE1-CG 4.44Å; Y428-F508 HydrophobicContact CE2-CB 4.19Å; Y428-F508 AromaticContact CE2-CD2 3.83Å; Y428-F508 HydrophobicContact CE2-CD2 3.83Å; Y428-F508 AromaticContact CG-CD2 3.82Å; Y428-F508 HydrophobicContact CG-CD2 3.82Å; Y428-F508 HydrophobicContact CG-CE2 4.21Å; Y428-F508 AromaticContact CZ-CD2 3.52Å; Y428-F508 PolarHBondContact OH-N 3.36Å; L431-F508 HydrophobicContact CD2-CE1 4.48Å; L431-F508 HydrophobicContact CD2-CE2 4.13Å; L431-F508 HydrophobicContact CD2-CZ 3.59Å; D506-F508 VanDerWaalsContact C-N 3.29Å; D506-F508 PolarHBondContact O-N 3.08Å; F508-C510 PolarHBondContact O-N 3.32Å
509	R	88.2	Confident	82.6	Confident	160 Å²	160	94.1 Å²	94.1	60%	0.604	45%	0.453	S	S	*	.			trans	54.3	40.1	178.8	-55.7	177.8	174.7	-176.1	-4.4	112	D506 I507 Y511 R526	D506-R509 VanDerWaalsContact CG-CA 3.45Å; D506-R509 PolarHBondContact O-N 2.98Å; D506-R509 WeakPolarHBondContact OD1-CA 3.45Å; D506-R509 PolarHBondContact OD1-N 3.18Å; D506-R509 VanDerWaalsContact OD2-CA 3.25Å; D506-R509 WeakPolarHBondContact OD2-CA 3.35Å; I507-R509 VanDerWaalsContact C-N 3.27Å; I507-R509 PolarHBondContact O-N 2.89Å; R509-Y511 PolarHBondContact O-N 3.4Å; R509-R526 WeakPolarHBondContact O-CD 3.33Å; R509-R526 PolarHBondContact O-NE 2.7Å
510	C	86.4	Confident	81.8	Confident	5 Å²	5	93.5 Å²	93.5	3%	0.034	45%	0.454	C	S	.	.			trans	-64.1	-26.9	179.1	-66.7	0	0	0	0	112.4	N426 D506 F508 N525 R526	N426-C510 HydrophobicContact CB-CB 4.43Å; D506-C510 VanDerWaalsContact CG-N 3.31Å; D506-C510 PolarHBondContact OD1-N 2.73Å; D506-C510 PolarHBondContact OD2-N 3Å; F508-C510 PolarHBondContact O-N 3.32Å; C510-N525 CarbonylContact O-C 3.56Å; C510-N525 WeakPolarHBondContact O-CA 3.42Å; C510-R526 WeakPolarHBondContact O-CB 3.35Å; C510-R526 PolarHBondContact O-N 2.93Å
511	Y	87.6	Confident	81	Confident	9 Å²	9	96 Å²	96	4%	0.035	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	153.9	-170.8	-56.3	-79.2	0	0	0	112	N426 D493 F496 L503 D506 R509 I523 G524 N525	N426-Y511 PolarHBondContact ND2-OH 3.16Å; D493-Y511 WeakPolarHBondContact CA-OH 3.27Å; D493-Y511 WeakPolarHBondContact CB-OH 3.42Å; D493-Y511 PolarHBondContact N-OH 3.2Å; D493-Y511 VanDerWaalsContact OD1-CE1 3.31Å; D493-Y511 WeakPolarHBondContact OD1-CE1 3.36Å; D493-Y511 PolarHBondContact OD1-OH 2.94Å; F496-Y511 HydrophobicContact CB-CD2 3.52Å; F496-Y511 HydrophobicContact CB-CE2 3.76Å; F496-Y511 HydrophobicContact CB-CG 4.01Å; F496-Y511 AromaticContact CD2-CD2 3.67Å; F496-Y511 HydrophobicContact CD2-CD2 3.67Å; F496-Y511 AromaticContact CD2-CE2 3.39Å; F496-Y511 HydrophobicContact CD2-CE2 3.39Å; F496-Y511 HydrophobicContact CE2-CE2 4.28Å; F496-Y511 AromaticContact CG-CD2 3.7Å; F496-Y511 HydrophobicContact CG-CD2 3.7Å; F496-Y511 AromaticContact CG-CE2 3.86Å; F496-Y511 HydrophobicContact CG-CE2 3.86Å; L503-Y511 HydrophobicContact CD2-CG 4.48Å; D506-Y511 WeakPolarHBondContact OD2-CD2 3.46Å; D506-Y511 PolarHBondContact OD2-N 3.16Å; R509-Y511 PolarHBondContact O-N 3.4Å; Y511-I523 HydrophobicContact CD1-CG2 4.38Å; Y511-I523 HydrophobicContact CG-CG2 4.44Å; Y511-G524 WeakPolarHBondContact CA-O 3.48Å; Y511-N525 WeakPolarHBondContact CE1-OD1 3.27Å
512	K	85.2	Confident	80.5	Confident	127 Å²	127	97.1 Å²	97.1	55%	0.552	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147	143.1	173.8	-166.7	-179.9	176.3	-179.7	0	110.1	G524	K512-G524 PolarHBondContact N-O 3.46Å; K512-G524 PolarHBondContact O-N 3.28Å
513	E	81.8	Confident	79.8	Confident	86 Å²	86	94.3 Å²	94.3	40%	0.402	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	134.2	167.7	-66.9	-176.5	180	0	0	110.6	S500 L503 I521	S500-E513 WeakPolarHBondContact CB-OE1 3.28Å; S500-E513 PolarHBondContact OG-OE1 3.18Å; L503-E513 HydrophobicContact CD1-CG 3.66Å; E513-I521 HydrophobicContact CB-CG2 4.09Å; E513-I521 HydrophobicContact CG-CG2 4.1Å
514	R	76.9	Confident	79	Confident	119 Å²	119	93.3 Å²	93.3	45%	0.449	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121	170.9	-61.8	-172	-172.7	-169.4	4.1	108	R522 N525 N528	R514-R522 PolarHBondContact N-O 3.28Å; R514-R522 PolarHBondContact O-N 2.77Å; R514-N525 PolarHBondContact NH2-O 3.23Å; R514-N528 PolarHBondContact NH2-O 3.35Å
515	Q	70	Confident	78.4	Confident	161 Å²	161	86.4 Å²	86.4	75%	0.752	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	126	168.4	-78.4	176.3	-10.6	0	0	109	I521	Q515-I521 HydrophobicContact CG-CG1 3.97Å
516	S	65.6	Low	77.3	Confident	36 Å²	36	85.7 Å²	85.7	25%	0.252	42%	0.418	S	S	.	.			trans	-74.2	161.4	170.7	69	0	0	0	0	110.8	T518 G519 S520	S516-T518 PolarHBondContact O-N 3.4Å; S516-T518 VanDerWaalsContact O-N 3.1Å; S516-T518 PolarHBondContact OG-N 3Å; S516-T518 PolarHBondContact OG-OG1 2.6Å; S516-T518 VanDerWaalsContact OG-OG1 3.06Å; S516-G519 PolarHBondContact O-N 2.89Å; S516-S520 VanDerWaalsContact CB-O 3.31Å; S516-S520 WeakPolarHBondContact CB-O 3.47Å; S516-S520 PolarHBondContact N-O 3.2Å; S516-S520 WeakPolarHBondContact OG-CA 3.45Å; S516-S520 PolarHBondContact OG-N 3.24Å; S516-S520 PolarHBondContact OG-O 2.77Å; S516-S520 PolarHBondContact OG-OG 3.2Å
517	M	64	Low	75.9	Confident	205 Å²	205	88 Å²	88	100%	1.01	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.6	174.5	-80.2	-166.9	-73.4	0	0	113.5	G519	M517-G519 VanDerWaalsContact C-N 3.3Å
518	T	71.3	Confident	74.2	Confident	126 Å²	126	84.5 Å²	84.5	77%	0.773	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	8.5	177.3	59.6	0	0	0	0	113.1	S516 S520	S516-T518 PolarHBondContact O-N 3.4Å; S516-T518 VanDerWaalsContact O-N 3.1Å; S516-T518 PolarHBondContact OG-N 3Å; S516-T518 PolarHBondContact OG-OG1 2.6Å; S516-T518 VanDerWaalsContact OG-OG1 3.06Å; T518-S520 PolarHBondContact O-N 2.72Å
519	G	64.9	Low	71.9	Confident	55 Å²	55	90 Å²	90	57%	0.567	43%	0.429	S	S	*	.	S	Bend	trans	82	-12	-178.5	0	0	0	0	0	114.7	S516 M517 I521	S516-G519 PolarHBondContact O-N 2.89Å; M517-G519 VanDerWaalsContact C-N 3.3Å; G519-I521 PolarHBondContact O-N 3.08Å
520	S	71	Confident	69.3	Low	50 Å²	50	87.1 Å²	87.1	35%	0.35	43%	0.431	S	S	.	.			trans	-67.4	131.8	175.8	72.4	0	0	0	0	111.2	S516 T518	S516-S520 VanDerWaalsContact CB-O 3.31Å; S516-S520 WeakPolarHBondContact CB-O 3.47Å; S516-S520 PolarHBondContact N-O 3.2Å; S516-S520 WeakPolarHBondContact OG-CA 3.45Å; S516-S520 PolarHBondContact OG-N 3.24Å; S516-S520 PolarHBondContact OG-O 2.77Å; S516-S520 PolarHBondContact OG-OG 3.2Å; T518-S520 PolarHBondContact O-N 2.72Å
521	I	67	Low	66.9	Low	93 Å²	93	90.5 Å²	90.5	48%	0.477	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	126.3	174.8	-62	172.4	0	0	0	108.3	E513 Q515 G519	E513-I521 HydrophobicContact CB-CG2 4.09Å; E513-I521 HydrophobicContact CG-CG2 4.1Å; Q515-I521 HydrophobicContact CG-CG1 3.97Å; G519-I521 PolarHBondContact O-N 3.08Å
522	R	76.6	Confident	64.2	Low	180 Å²	180	94.6 Å²	94.6	68%	0.679	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.2	172.5	-69.3	-172.1	179	-171.6	-1.8	110.5	R514	R514-R522 PolarHBondContact N-O 3.28Å; R514-R522 PolarHBondContact O-N 2.77Å
523	I	74.8	Confident	61.4	Low	21 Å²	21	97.9 Å²	97.9	11%	0.108	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.5	173	-57.1	174.5	0	0	0	108.3	F496 R497 L503 Y511	F496-I523 WeakPolarHBondContact O-CD1 3.45Å; R497-I523 HydrophobicContact CG-CB 4.47Å; R497-I523 HydrophobicContact CG-CG2 4.33Å; R497-I523 PolarHBondContact NH1-O 3.47Å; L503-I523 HydrophobicContact CD1-CD1 4.4Å; L503-I523 HydrophobicContact CD1-CG1 4.48Å; L503-I523 HydrophobicContact CD2-CG2 4.12Å; Y511-I523 HydrophobicContact CD1-CG2 4.38Å; Y511-I523 HydrophobicContact CG-CG2 4.44Å
524	G	73.2	Confident	58.8	Low	14 Å²	14	98.8 Å²	98.8	14%	0.144	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	160	178.7	0	0	0	0	0	112	Y511 K512 R526	Y511-G524 WeakPolarHBondContact CA-O 3.48Å; K512-G524 PolarHBondContact N-O 3.46Å; K512-G524 PolarHBondContact O-N 3.28Å; G524-R526 PolarHBondContact O-N 2.93Å
525	N	74.8	Confident	56.4	Low	11 Å²	11	98.8 Å²	98.8	6%	0.059	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	131.8	176.7	-59.1	14.4	0	0	0	109	R497 C510 Y511 R514 F527 N528	R497-N525 PolarHBondContact NH2-OD1 3.11Å; C510-N525 CarbonylContact O-C 3.56Å; C510-N525 WeakPolarHBondContact O-CA 3.42Å; Y511-N525 WeakPolarHBondContact CE1-OD1 3.27Å; R514-N525 PolarHBondContact NH2-O 3.23Å; N525-F527 PolarHBondContact O-N 2.82Å; N525-N528 HydrophobicContact CB-CB 4.16Å
526	R	68	Low	54.2	Low	113 Å²	113	102.1 Å²	102.1	43%	0.426	52%	0.521	S	S	.	.	S	Bend	trans	-58	-40.1	174.3	175.8	-173.9	-81.9	-139.4	-7.9	110.9	R509 C510 G524	R509-R526 WeakPolarHBondContact O-CD 3.33Å; R509-R526 PolarHBondContact O-NE 2.7Å; C510-R526 WeakPolarHBondContact O-CB 3.35Å; C510-R526 PolarHBondContact O-N 2.93Å; G524-R526 PolarHBondContact O-N 2.93Å
527	F	63	Low	52.4	Low	58 Å²	58	108.2 Å²	108.2	25%	0.254	55%	0.55	S	S	.	*	S	Bend	trans	-93.3	-13.9	-165	-77.9	-54.7	0	0	0	114.6	N119 K120 N525 R529	N119-F527 WeakPolarHBondContact O-CB 3.44Å; N119-F527 WeakPolarHBondContact O-CD1 3.32Å; N119-F527 VanDerWaalsContact O-O 3.09Å; K120-F527 VanDerWaalsContact O-CB 3.28Å; K120-F527 WeakPolarHBondContact O-CB 3.49Å; K120-F527 WeakPolarHBondContact O-CD2 3.22Å; N525-F527 PolarHBondContact O-N 2.82Å; F527-R529 PolarHBondContact O-N 3.02Å
528	N	56.4	Low	50.7	Low	63 Å²	63	101.3 Å²	101.3	34%	0.337	52%	0.521	S	S	.	.			trans	-69.9	84.4	165.9	-95	-18.5	0	0	0	109	R514 N525	R514-N528 PolarHBondContact NH2-O 3.35Å; N525-N528 HydrophobicContact CB-CB 4.16Å
529	R	43.4	Very low	48.8	Very low	198 Å²	198	105.4 Å²	105.4	75%	0.747	52%	0.522	S	S	*	.			trans	-63.7	131.2	155.7	-71.4	-172.2	179.5	-168.4	1.6	106.6	F527 S531	F527-R529 PolarHBondContact O-N 3.02Å; R529-S531 PolarHBondContact O-N 3.11Å
530	P	34.2	Very low	47.2	Very low	99 Å²	99	113.6 Å²	113.6	64%	0.643	54%	0.542	S	S	*	.			trans	-67.5	92.6	169.7	28.2	-29	0	0	0	107.1
531	S	34.9	Very low	45.5	Very low	77 Å²	77	115.2 Å²	115.2	54%	0.538	57%	0.566	S	S	.	*			trans	-79.2	-9.9	171.6	51.1	0	0	0	0	112	L108 R529 K533	L108-S531 WeakPolarHBondContact CD2-OG 3.16Å; R529-S531 PolarHBondContact O-N 3.11Å; S531-K533 PolarHBondContact O-N 3Å
532	I	30.8	Very low	43.7	Very low	94 Å²	94	117.3 Å²	117.3	48%	0.482	57%	0.574	S	S	.	*	S	Bend	trans	-80.5	117	158.9	-54.7	175	0	0	0	104.3	T534	I532-T534 HydrophobicContact CB-CG2 4.39Å; I532-T534 HydrophobicContact CG2-CG2 4.26Å; I532-T534 PolarHBondContact O-N 3.46Å
533	K	26.9	Very low	41.3	Very low	197 Å²	197	118.6 Å²	118.6	86%	0.857	59%	0.585	S	S	*	*			trans	-53.4	85	153	-78.7	-178.8	176.5	179.2	0	105.6	S531 T535	S531-K533 PolarHBondContact O-N 3Å; K533-T535 PolarHBondContact O-N 3.43Å
534	T	27.8	Very low	39.1	Very low	104 Å²	104	124.2 Å²	124.2	64%	0.638	61%	0.614	S	S	*	*			trans	-64.3	99.3	170.6	40.7	0	0	0	0	103.9	I532 R536	I532-T534 HydrophobicContact CB-CG2 4.39Å; I532-T534 HydrophobicContact CG2-CG2 4.26Å; I532-T534 PolarHBondContact O-N 3.46Å; T534-R536 PolarHBondContact O-N 3.33Å; T534-R536 VanDerWaalsContact O-N 3.15Å
535	T	25.4	Very low	36.9	Very low	120 Å²	120	132 Å²	132	74%	0.736	65%	0.647	S	S	*	*			trans	-39.4	121.2	171.2	-35.5	0	0	0	0	106.7	K533 L537	K533-T535 PolarHBondContact O-N 3.43Å; T535-L537 PolarHBondContact O-N 3.45Å; T535-L537 VanDerWaalsContact O-N 3.1Å
536	R	25	Very low	34.6	Very low	231 Å²	231	139 Å²	139	87%	0.872	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-49.8	124.4	172.4	-87.3	-176.8	176.5	179.3	0.4	106.6	T534 P538	T534-R536 PolarHBondContact O-N 3.33Å; T534-R536 VanDerWaalsContact O-N 3.15Å; R536-P538 WeakPolarHBondContact O-CD 3.17Å; R536-P538 VanDerWaalsContact O-N 3.14Å
537	L	27.5	Very low	32.7	Very low	164 Å²	164	140.6 Å²	140.6	86%	0.859	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-55.8	119	163.5	-77	159.5	0	0	0	106.4	T535 R539	T535-L537 PolarHBondContact O-N 3.45Å; T535-L537 VanDerWaalsContact O-N 3.1Å; L537-R539 PolarHBondContact O-N 3.11Å
538	P	27.3	Very low	31.2	Very low	60 Å²	60	144 Å²	144	39%	0.39	72%	0.72	S	S	.	*	P	Polyproline II helix	trans	-60.7	138.9	-177.8	20.7	-28.2	0	0	0	109.2	R536 E542 L544	R536-P538 WeakPolarHBondContact O-CD 3.17Å; R536-P538 VanDerWaalsContact O-N 3.14Å; P538-E542 HydrophobicContact CB-CB 3.79Å; P538-L544 HydrophobicContact CG-CD1 4.47Å
539	R	31.9	Very low	30.1	Very low	212 Å²	212	147.6 Å²	147.6	80%	0.8	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-65.9	151.1	174.5	-73.7	-179.2	-179.1	176.9	-0.1	108.4	L537 G541 E542	L537-R539 PolarHBondContact O-N 3.11Å; R539-G541 PolarHBondContact O-N 3.45Å; R539-E542 PolarHBondContact O-N 3.05Å
540	K	31	Very low	29.6	Very low	226 Å²	226	144.4 Å²	144.4	98%	0.983	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.8	105.9	174.7	-132.1	-178.3	-177.1	-175.9	0	109
541	G	35.6	Very low	29.7	Very low	84 Å²	84	146 Å²	146	87%	0.866	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	123.4	-15.6	-178.2	0	0	0	0	0	116.8	R539	R539-G541 PolarHBondContact O-N 3.45Å
542	E	28.4	Very low	29.7	Very low	138 Å²	138	146.2 Å²	146.2	65%	0.645	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-94.4	129.4	177.7	-79.8	175.4	159.7	0	0	112.2	P538 R539	P538-E542 HydrophobicContact CB-CB 3.79Å; R539-E542 PolarHBondContact O-N 3.05Å
543	K	27.1	Very low	29.9	Very low	206 Å²	206	148.3 Å²	148.3	90%	0.896	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-70.4	140.3	-179.2	-78.4	-177.9	175.2	179.9	0	111.7	E545	K543-E545 PolarHBondContact O-N 3.01Å
544	L	29	Very low	30.6	Very low	139 Å²	139	142.9 Å²	142.9	73%	0.728	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-66	120	177.4	-122.3	88.9	0	0	0	111	P538	P538-L544 HydrophobicContact CG-CD1 4.47Å
545	E	26.5	Very low	31	Very low	178 Å²	178	143.5 Å²	143.5	83%	0.832	72%	0.72	S	S	*	*			trans	-87.3	113.1	156.1	-86.1	-175	158.1	0	0	108.4	K543 L547	K543-E545 PolarHBondContact O-N 3.01Å; E545-L547 PolarHBondContact O-N 2.96Å
546	I	26.9	Very low	31.6	Very low	158 Å²	158	144 Å²	144	81%	0.81	71%	0.714	S	S	*	*			trans	-72.8	116.1	-177.9	-59.6	170.3	0	0	0	108.2
547	L	29	Very low	32.5	Very low	147 Å²	147	136.6 Å²	136.6	77%	0.77	69%	0.694	S	S	*	*			trans	-113.7	104.3	179.1	-99.8	155.9	0	0	0	111	E545	E545-L547 PolarHBondContact O-N 2.96Å
548	N	29.8	Very low	32.9	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	67%	0.672	S	S	*	*			trans	26	127.2	158	-100.7	-8.9	0	0	0	121.7	N550	N548-N550 PolarHBondContact O-N 2.94Å
549	D	33.9	Very low	33.3	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-58.7	2	-175.2	-67.6	-42.4	0	0	0	118.3	M551 T552	D549-M551 PolarHBondContact O-N 3.39Å; D549-T552 PolarHBondContact O-N 3.24Å; D549-T552 PolarHBondContact O-OG1 2.86Å
550	N	33.2	Very low	33.5	Very low	131 Å²	131	129.7 Å²	129.7	70%	0.701	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-73.4	-10.6	-178.3	-77.8	-16.2	0	0	0	114	N548	N548-N550 PolarHBondContact O-N 2.94Å
551	M	35.5	Very low	33.8	Very low	132 Å²	132	122.5 Å²	122.5	65%	0.65	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-81.4	-23.3	176.1	-74.4	-171.7	63.2	0	0	113.5	D549 Q553 E554 L555	D549-M551 PolarHBondContact O-N 3.39Å; M551-Q553 VanDerWaalsContact C-N 3.31Å; M551-Q553 PolarHBondContact O-N 2.87Å; M551-E554 PolarHBondContact O-N 3.5Å; M551-L555 PolarHBondContact O-N 2.9Å
552	T	35.5	Very low	34	Very low	82 Å²	82	122.2 Å²	122.2	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-67	-35.8	-177.1	-31.5	0	0	0	0	111	D549 E554 L555 E556	D549-T552 PolarHBondContact O-N 3.24Å; D549-T552 PolarHBondContact O-OG1 2.86Å; T552-E554 PolarHBondContact O-N 2.71Å; T552-L555 PolarHBondContact O-N 3.4Å; T552-E556 PolarHBondContact O-N 3.46Å
553	Q	34.9	Very low	34.4	Very low	138 Å²	138	118.5 Å²	118.5	65%	0.645	61%	0.614	S	S	*	*	H	α-helix	trans	-67.5	-33.1	177	-124.1	175.4	5.4	0	0	113.5	M551 L555 T557	M551-Q553 VanDerWaalsContact C-N 3.31Å; M551-Q553 PolarHBondContact O-N 2.87Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; Q553-T557 PolarHBondContact O-N 2.94Å; Q553-T557 PolarHBondContact O-OG1 3.06Å
554	E	41.2	Very low	34.7	Very low	83 Å²	83	111.5 Å²	111.5	39%	0.388	60%	0.595	S	S	.	*	H	α-helix	trans	-68.6	-33.6	174.3	-79.6	-159.1	154.6	0	0	111.7	R104 M551 T552 M558	R104-E554 IonicContact NH1-OE1 3.76Å; R104-E554 PolarHBondContact NH1-OE1 3.31Å; R104-E554 IonicContact NH1-OE2 2.77Å; R104-E554 PolarHBondContact NH1-OE2 2.98Å; R104-E554 VanDerWaalsContact NH1-OE2 3.14Å; M551-E554 PolarHBondContact O-N 3.5Å; T552-E554 PolarHBondContact O-N 2.71Å; E554-M558 WeakPolarHBondContact O-CB 3.43Å; E554-M558 WeakPolarHBondContact O-CG 3.41Å; E554-M558 PolarHBondContact O-N 3.07Å
555	L	37.3	Very low	35.1	Very low	118 Å²	118	109.5 Å²	109.5	62%	0.618	58%	0.584	S	S	*	*	H	α-helix	trans	-71	-41.9	-179.1	-134.8	105.2	0	0	0	111.7	M551 T552 Q553 M558 L559	M551-L555 PolarHBondContact O-N 2.9Å; T552-L555 PolarHBondContact O-N 3.4Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; L555-M558 PolarHBondContact O-N 3.38Å; L555-L559 HydrophobicContact CD2-CD1 4.47Å; L555-L559 WeakPolarHBondContact O-CB 3.43Å; L555-L559 PolarHBondContact O-N 3.39Å
556	E	36.1	Very low	35.5	Very low	130 Å²	130	104.4 Å²	104.4	61%	0.607	57%	0.565	S	S	*	*	H	α-helix	trans	-63.9	-43.8	176.3	-71	-177.1	165.1	0	0	111.4	T552 M558 L559 V560	T552-E556 PolarHBondContact O-N 3.46Å; E556-M558 PolarHBondContact O-N 3.45Å; E556-L559 PolarHBondContact O-N 2.68Å; E556-V560 WeakPolarHBondContact O-CG2 3.32Å; E556-V560 PolarHBondContact O-N 3.17Å
557	T	44	Very low	35.8	Very low	76 Å²	76	101.3 Å²	101.3	47%	0.466	55%	0.553	S	S	.	*	H	α-helix	trans	-65.5	-38.9	178	-44.8	0	0	0	0	111.7	Q553 V560 I561	Q553-T557 PolarHBondContact O-N 2.94Å; Q553-T557 PolarHBondContact O-OG1 3.06Å; T557-V560 PolarHBondContact O-N 3.39Å; T557-I561 HydrophobicContact CG2-CD1 4.37Å; T557-I561 WeakPolarHBondContact O-CG1 3.32Å; T557-I561 PolarHBondContact O-N 3.03Å; T557-I561 VanDerWaalsContact O-N 3.16Å
558	M	37.1	Very low	36.1	Very low	79 Å²	79	99 Å²	99	39%	0.389	55%	0.546	S	S	.	.	H	α-helix	trans	-63.8	-39.6	173.7	-86.5	-89.5	165.8	0	0	112.3	Y421 E554 L555 E556 I561 T562	Y421-M558 HydrophobicContact CD1-CE 4.42Å; E554-M558 WeakPolarHBondContact O-CB 3.43Å; E554-M558 WeakPolarHBondContact O-CG 3.41Å; E554-M558 PolarHBondContact O-N 3.07Å; L555-M558 PolarHBondContact O-N 3.38Å; E556-M558 PolarHBondContact O-N 3.45Å; M558-I561 PolarHBondContact O-N 3.31Å; M558-T562 WeakPolarHBondContact O-CB 3.34Å; M558-T562 PolarHBondContact O-N 3.27Å; M558-T562 PolarHBondContact O-OG1 3.34Å
559	L	34.9	Very low	36.4	Very low	113 Å²	113	96.9 Å²	96.9	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-65.2	-40.2	177.1	-101.8	148.6	0	0	0	111.9	L555 E556 T562 S563	L555-L559 HydrophobicContact CD2-CD1 4.47Å; L555-L559 WeakPolarHBondContact O-CB 3.43Å; L555-L559 PolarHBondContact O-N 3.39Å; E556-L559 PolarHBondContact O-N 2.68Å; L559-T562 PolarHBondContact O-N 3.09Å; L559-S563 VanDerWaalsContact O-CB 3.23Å; L559-S563 WeakPolarHBondContact O-CB 3.39Å; L559-S563 PolarHBondContact O-N 2.88Å; L559-S563 PolarHBondContact O-OG 3.3Å
560	V	36.9	Very low	36.4	Very low	99 Å²	99	93.5 Å²	93.5	60%	0.6	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-41.3	177.2	175	0	0	0	0	111.8	E556 T557 S563 A564	E556-V560 WeakPolarHBondContact O-CG2 3.32Å; E556-V560 PolarHBondContact O-N 3.17Å; T557-V560 PolarHBondContact O-N 3.39Å; V560-S563 PolarHBondContact O-OG 3.41Å; V560-A564 WeakPolarHBondContact O-CB 3.28Å; V560-A564 PolarHBondContact O-N 2.91Å
561	I	37.8	Very low	36.4	Very low	75 Å²	75	92 Å²	92	39%	0.385	52%	0.517	S	S	.	.	H	α-helix	trans	-72.2	-40.1	178.7	-63.4	170.3	0	0	0	110.9	T557 M558 A564 I565	T557-I561 HydrophobicContact CG2-CD1 4.37Å; T557-I561 WeakPolarHBondContact O-CG1 3.32Å; T557-I561 PolarHBondContact O-N 3.03Å; T557-I561 VanDerWaalsContact O-N 3.16Å; M558-I561 PolarHBondContact O-N 3.31Å; I561-A564 PolarHBondContact O-N 3.25Å; I561-I565 HydrophobicContact CG2-CD1 3.92Å; I561-I565 VanDerWaalsContact O-CG1 3.29Å; I561-I565 WeakPolarHBondContact O-CG1 3.48Å; I561-I565 PolarHBondContact O-N 3.29Å; I561-I565 VanDerWaalsContact O-N 3.12Å
562	T	38.1	Very low	36.3	Very low	77 Å²	77	88.9 Å²	88.9	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-70.3	-37.1	179.6	-45.9	0	0	0	0	111.4	M558 L559 I565 T566	M558-T562 WeakPolarHBondContact O-CB 3.34Å; M558-T562 PolarHBondContact O-N 3.27Å; M558-T562 PolarHBondContact O-OG1 3.34Å; L559-T562 PolarHBondContact O-N 3.09Å; T562-I565 PolarHBondContact O-N 2.88Å; T562-T566 WeakPolarHBondContact O-CB 3.28Å; T562-T566 PolarHBondContact O-N 3.28Å; T562-T566 PolarHBondContact O-OG1 3.29Å
563	S	36.9	Very low	36.2	Very low	60 Å²	60	88.2 Å²	88.2	42%	0.42	51%	0.511	S	S	.	.	H	α-helix	trans	-68.4	-40.6	175.5	65.7	0	0	0	0	111.6	L559 V560 I565 T566 V567	L559-S563 VanDerWaalsContact O-CB 3.23Å; L559-S563 WeakPolarHBondContact O-CB 3.39Å; L559-S563 PolarHBondContact O-N 2.88Å; L559-S563 PolarHBondContact O-OG 3.3Å; V560-S563 PolarHBondContact O-OG 3.41Å; S563-I565 VanDerWaalsContact C-N 3.33Å; S563-I565 PolarHBondContact O-N 3.32Å; S563-T566 PolarHBondContact O-N 3.5Å; S563-V567 VanDerWaalsContact O-CG2 3.26Å; S563-V567 WeakPolarHBondContact O-CG2 3.49Å; S563-V567 PolarHBondContact O-N 3.16Å
564	A	34.6	Very low	36.1	Very low	59 Å²	59	87.1 Å²	87.1	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-59.6	-42	174.9	0	0	0	0	0	112.3	V560 I561 T568	V560-A564 WeakPolarHBondContact O-CB 3.28Å; V560-A564 PolarHBondContact O-N 2.91Å; I561-A564 PolarHBondContact O-N 3.25Å; A564-T568 PolarHBondContact O-N 3.11Å; A564-T568 PolarHBondContact O-OG1 2.89Å
565	I	36.3	Very low	35.6	Very low	98 Å²	98	87.5 Å²	87.5	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-71.2	-38.2	177.5	-65.4	167.7	0	0	0	111.4	I561 T562 S563 T568 T569	I561-I565 HydrophobicContact CG2-CD1 3.92Å; I561-I565 VanDerWaalsContact O-CG1 3.29Å; I561-I565 WeakPolarHBondContact O-CG1 3.48Å; I561-I565 PolarHBondContact O-N 3.29Å; I561-I565 VanDerWaalsContact O-N 3.12Å; T562-I565 PolarHBondContact O-N 2.88Å; S563-I565 VanDerWaalsContact C-N 3.33Å; S563-I565 PolarHBondContact O-N 3.32Å; I565-T568 PolarHBondContact O-N 3.24Å; I565-T568 PolarHBondContact O-OG1 2.87Å; I565-T569 PolarHBondContact O-N 3.25Å; I565-T569 PolarHBondContact O-OG1 2.6Å
566	T	35.4	Very low	35.4	Very low	71 Å²	71	89.2 Å²	89.2	44%	0.436	53%	0.531	S	S	.	.	H	α-helix	trans	-67.5	-42.4	180	-52.2	0	0	0	0	111	T562 S563 T568 T569 T570	T562-T566 WeakPolarHBondContact O-CB 3.28Å; T562-T566 PolarHBondContact O-N 3.28Å; T562-T566 PolarHBondContact O-OG1 3.29Å; S563-T566 PolarHBondContact O-N 3.5Å; T566-T568 VanDerWaalsContact C-N 3.3Å; T566-T568 PolarHBondContact O-N 2.9Å; T566-T569 PolarHBondContact O-N 3.03Å; T566-T569 PolarHBondContact O-OG1 2.99Å; T566-T570 PolarHBondContact O-N 3.14Å; T566-T570 PolarHBondContact O-OG1 3.47Å
567	V	34.5	Very low	35	Very low	93 Å²	93	87.3 Å²	87.3	56%	0.564	53%	0.533	S	S	*	.	H	α-helix	trans	-63.8	-32	179.7	173.1	0	0	0	0	112.6	S563 T571	S563-V567 VanDerWaalsContact O-CG2 3.26Å; S563-V567 WeakPolarHBondContact O-CG2 3.49Å; S563-V567 PolarHBondContact O-N 3.16Å; V567-T571 PolarHBondContact O-N 3.3Å; V567-T571 PolarHBondContact O-OG1 3.18Å
568	T	33.5	Very low	34.2	Very low	99 Å²	99	90.8 Å²	90.8	61%	0.607	55%	0.548	S	S	*	.	H	α-helix	trans	-72.9	-28.1	173.8	3.5	0	0	0	0	112.6	A564 I565 T566 T571	A564-T568 PolarHBondContact O-N 3.11Å; A564-T568 PolarHBondContact O-OG1 2.89Å; I565-T568 PolarHBondContact O-N 3.24Å; I565-T568 PolarHBondContact O-OG1 2.87Å; T566-T568 VanDerWaalsContact C-N 3.3Å; T566-T568 PolarHBondContact O-N 2.9Å; T568-T571 PolarHBondContact O-OG1 3.2Å
569	T	36.3	Very low	33.8	Very low	83 Å²	83	92.7 Å²	92.7	51%	0.509	56%	0.559	S	S	.	*	H	α-helix	trans	-85.3	-33.3	178.6	53.5	0	0	0	0	114.2	I565 T566 A572 S573	I565-T569 PolarHBondContact O-N 3.25Å; I565-T569 PolarHBondContact O-OG1 2.6Å; T566-T569 PolarHBondContact O-N 3.03Å; T566-T569 PolarHBondContact O-OG1 2.99Å; T569-A572 PolarHBondContact O-N 2.98Å; T569-S573 PolarHBondContact O-N 3.21Å; T569-S573 VanDerWaalsContact O-N 3.15Å
570	T	33.5	Very low	33.4	Very low	68 Å²	68	93.3 Å²	93.3	42%	0.417	57%	0.573	S	S	.	*	H	α-helix	trans	-74.3	-28.2	177	24.8	0	0	0	0	113.4	T566 A572 S573 N574	T566-T570 PolarHBondContact O-N 3.14Å; T566-T570 PolarHBondContact O-OG1 3.47Å; T570-A572 VanDerWaalsContact C-N 3.31Å; T570-S573 PolarHBondContact O-N 3.38Å; T570-S573 PolarHBondContact O-OG 2.86Å; T570-N574 PolarHBondContact O-N 3.26Å
571	T	33.7	Very low	33	Very low	98 Å²	98	96.3 Å²	96.3	60%	0.601	58%	0.581	S	S	*	*	H	α-helix	trans	-70.7	-28.7	172.7	44.8	0	0	0	0	112.2	V567 T568	V567-T571 PolarHBondContact O-N 3.3Å; V567-T571 PolarHBondContact O-OG1 3.18Å; T568-T571 PolarHBondContact O-OG1 3.2Å
572	A	34.8	Very low	32.5	Very low	68 Å²	68	101.9 Å²	101.9	56%	0.562	60%	0.602	S	S	*	*	H	α-helix	trans	-80.5	-25.2	173.8	0	0	0	0	0	113.9	T569 T570	T569-A572 PolarHBondContact O-N 2.98Å; T570-A572 VanDerWaalsContact C-N 3.31Å
573	S	33.4	Very low	32.1	Very low	67 Å²	67	104.1 Å²	104.1	47%	0.469	62%	0.618	S	S	.	*	H	α-helix	trans	-85.7	-25.7	179.6	66.3	0	0	0	0	114.1	T569 T570 S575	T569-S573 PolarHBondContact O-N 3.21Å; T569-S573 VanDerWaalsContact O-N 3.15Å; T570-S573 PolarHBondContact O-N 3.38Å; T570-S573 PolarHBondContact O-OG 2.86Å; S573-S575 VanDerWaalsContact C-N 3.34Å; S573-S575 PolarHBondContact O-N 2.69Å
574	N	31.6	Very low	31.6	Very low	116 Å²	116	110.3 Å²	110.3	62%	0.62	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-0.8	-175.9	-79.8	1.8	0	0	0	114.9	T570	T570-N574 PolarHBondContact O-N 3.26Å
575	S	31.6	Very low	31.4	Very low	91 Å²	91	116.6 Å²	116.6	64%	0.636	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-4.1	175.2	58.2	0	0	0	0	114.6	S573	S573-S575 VanDerWaalsContact C-N 3.34Å; S573-S575 PolarHBondContact O-N 2.69Å
576	N	31.9	Very low	30.7	Very low	153 Å²	153	120.9 Å²	120.9	82%	0.818	68%	0.682	S	S	*	*	S	Bend	trans	-116.2	19.2	-177	-84.8	-14.9	0	0	0	115.5
577	S	28.9	Very low	30.3	Very low	91 Å²	91	126 Å²	126	64%	0.636	70%	0.703	S	S	*	*			trans	-142.8	62.9	172.3	72.7	0	0	0	0	112.8
578	L	26.2	Very low	30	Very low	148 Å²	148	126.6 Å²	126.6	78%	0.775	71%	0.711	S	S	*	*			trans	-138.5	133.5	157	-95.4	112.6	0	0	0	109.8
579	N	28.1	Very low	29.6	Very low	119 Å²	119	127.9 Å²	127.9	64%	0.636	72%	0.719	S	S	*	*			trans	93.3	57.7	165.4	-54	-12.4	0	0	0	117.4	H581	N579-H581 PolarHBondContact O-N 3.18Å
580	S	27.1	Very low	29.3	Very low	127 Å²	127	131.4 Å²	131.4	89%	0.888	74%	0.735	S	S	*	*			trans	-74.1	79.1	138.5	60.4	0	0	0	0	109
581	H	28.3	Very low	28.9	Very low	162 Å²	162	136.7 Å²	136.7	75%	0.75	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-81.9	122.3	172.5	-97.9	-64.6	0	0	0	110.2	N579	N579-H581 PolarHBondContact O-N 3.18Å
582	K	27.8	Very low	28.7	Very low	192 Å²	192	137.7 Å²	137.7	84%	0.835	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-57.2	159.8	174.3	-84.4	177.8	173.1	179.9	0	112.8
583	P	29.5	Very low	28.4	Very low	124 Å²	124	143.2 Å²	143.2	81%	0.805	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-69	134.4	-171.5	-7.2	23.5	0	0	0	111.9	E585	P583-E585 PolarHBondContact O-N 3.11Å
584	M	26.7	Very low	28.5	Very low	190 Å²	190	145.9 Å²	145.9	94%	0.936	80%	0.798	S	S	*	*			trans	-63.9	113.3	170.3	-94.9	173.6	178	0	0	110.6
585	E	29.7	Very low	28.5	Very low	190 Å²	190	150.5 Å²	150.5	89%	0.888	81%	0.812	S	S	*	*			trans	-72.4	120.5	156.4	-77.9	179.3	153.1	0	0	108.7	P583 M587	P583-E585 PolarHBondContact O-N 3.11Å; E585-M587 PolarHBondContact O-N 2.68Å
586	M	23	Very low	28.5	Very low	189 Å²	189	155.6 Å²	155.6	93%	0.931	82%	0.823	S	S	*	*			trans	-74	111	169	-68.4	-177.9	-159.7	0	0	108.9
587	M	26.9	Very low	28.6	Very low	178 Å²	178	154.3 Å²	154.3	88%	0.877	82%	0.82	S	S	*	*			trans	-137	108.1	159.7	-92.9	-170.7	173	0	0	111.4	E585	E585-M587 PolarHBondContact O-N 2.68Å
588	S	27.8	Very low	28.8	Very low	106 Å²	106	157.4 Å²	157.4	74%	0.741	83%	0.83	S	S	*	*			trans	34.8	109.3	147.9	61	0	0	0	0	119.3	N590	S588-N590 PolarHBondContact O-N 2.92Å
589	V	24.8	Very low	29.4	Very low	126 Å²	126	157.9 Å²	157.9	76%	0.764	83%	0.833	S	S	*	*			trans	-52.1	118.1	154.9	178	0	0	0	0	109.7	E591	V589-E591 HydrophobicContact CG1-CG 3.98Å
590	N	29.1	Very low	29.4	Very low	157 Å²	157	155.2 Å²	155.2	84%	0.84	83%	0.834	S	S	*	*			trans	-124.6	93.5	162.9	-125.6	-0.6	0	0	0	107.4	S588 S592	S588-N590 PolarHBondContact O-N 2.92Å; N590-S592 PolarHBondContact O-N 3.03Å
591	E	26	Very low	29.6	Very low	179 Å²	179	157.3 Å²	157.3	84%	0.836	83%	0.834	S	S	*	*			trans	-66.8	117.6	169.2	-71	178.6	158	0	0	108.9	V589	V589-E591 HydrophobicContact CG1-CG 3.98Å
592	S	30	Very low	29.9	Very low	119 Å²	119	161.1 Å²	161.1	83%	0.832	86%	0.86	S	S	*	*			trans	-145.1	127.7	155.9	60.2	0	0	0	0	110.8	N590	N590-S592 PolarHBondContact O-N 3.03Å
593	M	27.4	Very low	30	Very low	184 Å²	184	159.6 Å²	159.6	91%	0.906	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-61.1	162.5	-170.5	-83.9	-175.8	179.5	0	0	116
594	P	35.2	Very low	30	Very low	123 Å²	123	161.4 Å²	161.4	80%	0.799	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-79.4	131.4	-167.9	32.3	-33.5	0	0	0	112.3
595	K	31.7	Very low	30.2	Very low	213 Å²	213	159.8 Å²	159.8	93%	0.926	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-84.4	121.9	167.2	-84.4	-175.9	176.2	178.7	0	110
596	K	33.1	Very low	30.2	Very low	198 Å²	198	158.1 Å²	158.1	86%	0.861	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-52.7	137.9	174.9	-76.2	175.7	171.6	179.1	0	112.2
597	V	33.6	Very low	30.7	Very low	125 Å²	125	156.1 Å²	156.1	76%	0.758	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-47.7	129.8	160	174.9	0	0	0	0	109.9	D599	V597-D599 HydrophobicContact CG1-CB 4.48Å
598	N	31.9	Very low	31	Very low	157 Å²	157	154.7 Å²	154.7	84%	0.84	85%	0.852	S	S	*	*			trans	-134	70.7	178.4	-148.7	36.6	0	0	0	106.6
599	D	39.6	Very low	31.2	Very low	157 Å²	157	158.1 Å²	158.1	84%	0.84	86%	0.86	S	S	*	*			trans	-106.8	100.8	171.4	-70.8	-26.8	0	0	0	107.3	V597	V597-D599 HydrophobicContact CG1-CB 4.48Å
600	G	29.1	Very low	31.7	Very low	64 Å²	64	160.6 Å²	160.6	66%	0.66	87%	0.868	S	S	*	*			trans	-106.7	144.5	165.8	0	0	0	0	0	109.7
601	L	29.8	Very low	31.9	Very low	170 Å²	170	160.9 Å²	160.9	89%	0.89	87%	0.87	S	S	*	*			trans	69.5	92.9	152.2	-60.4	158.6	0	0	0	115.9
602	D	35.5	Very low	32.4	Very low	242 Å²	242	159.3 Å²	159.3	100%	1.294	87%	0.873	S	S	*	*				-149.3	0	90.7	-87.1	-27.6	0	0	0	111

Retrieved 602 of 602 residues in 372.5 ms (Link to these results)

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