A0A5K4FCH3_SCHMA Loading...

NR LBD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCH3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 622 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	89.4	Confident	80	Confident	94 Å²	94	63.6 Å²	63.6	46%	0.463	32%	0.315	S	S	.	.				0	-80.6	0	-166.6	-174.6	69.9	0	0	111.6	L3 Q4 A5 I157 L159	M1-L3 PolarHBondContact O-N 3.26Å; M1-Q4 WeakPolarHBondContact O-CA 3.18Å; M1-Q4 WeakPolarHBondContact O-CB 3.34Å; M1-Q4 PolarHBondContact O-N 3.23Å; M1-A5 PolarHBondContact O-N 3.06Å; M1-A5 VanDerWaalsContact O-N 3.15Å; M1-I157 HydrophobicContact CE-CG2 3.73Å; M1-I157 HydrophobicContact SD-CG2 3.99Å; M1-L159 HydrophobicContact CE-CD1 3.79Å; M1-L159 HydrophobicContact CE-CG 4Å; M1-L159 HydrophobicContact SD-CD1 4.3Å; M1-L159 HydrophobicContact SD-CG 3.93Å
2	L	93.1	Very high	77.7	Confident	20 Å²	20	65.8 Å²	65.8	11%	0.105	32%	0.318	C	S	.	.	H	α-helix	trans	-54.6	-48.1	-171.3	-61.8	176.7	0	0	0	114.4	Q4 A5 E6 I157 V248 A252	L2-Q4 PolarHBondContact O-N 3.23Å; L2-A5 PolarHBondContact O-N 3.32Å; L2-A5 VanDerWaalsContact O-N 3.17Å; L2-E6 PolarHBondContact O-N 3.48Å; L2-E6 VanDerWaalsContact O-N 3.16Å; L2-I157 HydrophobicContact CD2-CD1 3.68Å; L2-I157 HydrophobicContact CD2-CG1 4.04Å; L2-I157 HydrophobicContact CD2-CG2 4.3Å; L2-V248 HydrophobicContact CB-CB 3.93Å; L2-V248 HydrophobicContact CB-CG2 3.61Å; L2-A252 HydrophobicContact CD1-CB 3.66Å; L2-A252 HydrophobicContact CD2-CB 3.81Å; L2-A252 HydrophobicContact CG-CB 4.4Å
3	L	91	Very high	76.1	Confident	73 Å²	73	64.2 Å²	64.2	38%	0.382	31%	0.312	S	S	.	.	H	α-helix	trans	-60.1	-26.4	173.5	-73.8	172.9	0	0	0	114	M1 N7 Q244 V248	M1-L3 PolarHBondContact O-N 3.26Å; L3-N7 VanDerWaalsContact O-CG 3.23Å; L3-N7 PolarHBondContact O-N 2.56Å; L3-N7 PolarHBondContact O-ND2 3.19Å; L3-Q244 HydrophobicContact CD2-CB 4.34Å; L3-Q244 HydrophobicContact CD2-CG 3.86Å; L3-Q244 WeakPolarHBondContact CD2-O 3.42Å; L3-V248 HydrophobicContact CD2-CG1 4.33Å; L3-V248 HydrophobicContact CD2-CG2 3.85Å; L3-V248 HydrophobicContact CG-CG2 3.96Å
4	Q	89.3	Confident	74.6	Confident	126 Å²	126	69.1 Å²	69.1	59%	0.589	34%	0.34	S	S	*	.	H	α-helix	trans	-76	-40.1	176.8	-175.4	-179.9	-12.3	0	0	110.7	M1 L2 N7 H8	M1-Q4 WeakPolarHBondContact O-CA 3.18Å; M1-Q4 WeakPolarHBondContact O-CB 3.34Å; M1-Q4 PolarHBondContact O-N 3.23Å; L2-Q4 PolarHBondContact O-N 3.23Å; Q4-N7 PolarHBondContact O-N 3.46Å; Q4-H8 PolarHBondContact O-N 3.21Å; Q4-H8 PolarHBondContact O-ND1 3.23Å
5	A	87.6	Confident	73.8	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.017	33%	0.333	C	S	.	.	H	α-helix	trans	-61.8	-46.6	174.8	0	0	0	0	0	111.7	M1 L2 N7 H8 S9 N156 I157	M1-A5 PolarHBondContact O-N 3.06Å; M1-A5 VanDerWaalsContact O-N 3.15Å; L2-A5 PolarHBondContact O-N 3.32Å; L2-A5 VanDerWaalsContact O-N 3.17Å; A5-N7 VanDerWaalsContact C-N 3.3Å; A5-N7 PolarHBondContact O-N 3.26Å; A5-H8 PolarHBondContact O-N 2.9Å; A5-S9 PolarHBondContact O-N 3.37Å; A5-S9 VanDerWaalsContact O-N 3.14Å; A5-N156 HydrophobicContact CB-CB 3.68Å; A5-I157 HydrophobicContact CB-CG1 3.88Å
6	E	87.1	Confident	73.2	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-54.8	-41.2	174.8	-177.5	82.2	-172.2	0	0	112.7	L2 H8 S9 N10 Q186 Q244 V248 K251	L2-E6 PolarHBondContact O-N 3.48Å; L2-E6 VanDerWaalsContact O-N 3.16Å; E6-H8 PolarHBondContact O-N 3.22Å; E6-S9 PolarHBondContact O-N 3.43Å; E6-S9 PolarHBondContact O-OG 3.46Å; E6-N10 WeakPolarHBondContact CG-ND2 3.29Å; E6-N10 WeakPolarHBondContact O-CB 3.38Å; E6-N10 PolarHBondContact O-N 3.37Å; E6-N10 VanDerWaalsContact O-N 3.09Å; E6-N10 PolarHBondContact OE1-ND2 3.39Å; E6-Q186 PolarHBondContact OE1-NE2 3.19Å; E6-Q244 PolarHBondContact OE1-NE2 3.34Å; E6-Q244 VanDerWaalsContact OE1-NE2 3.11Å; E6-V248 HydrophobicContact CB-CG1 3.64Å; E6-V248 HydrophobicContact CG-CG1 3.7Å; E6-V248 WeakPolarHBondContact OE2-CG1 3.29Å; E6-K251 IonicContact OE1-NZ 2.63Å; E6-K251 PolarHBondContact OE1-NZ 2.81Å; E6-K251 IonicContact OE2-NZ 2.95Å; E6-K251 PolarHBondContact OE2-NZ 2.95Å
7	N	81.8	Confident	72.7	Confident	113 Å²	113	72.7 Å²	72.7	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-69.9	-15.4	177	-74.3	-20.9	0	0	0	114.2	L3 Q4 A5	L3-N7 VanDerWaalsContact O-CG 3.23Å; L3-N7 PolarHBondContact O-N 2.56Å; L3-N7 PolarHBondContact O-ND2 3.19Å; Q4-N7 PolarHBondContact O-N 3.46Å; A5-N7 VanDerWaalsContact C-N 3.3Å; A5-N7 PolarHBondContact O-N 3.26Å
8	H	72.9	Confident	72.7	Confident	89 Å²	89	68.7 Å²	68.7	41%	0.412	34%	0.336	S	S	.	.	H	α-helix	trans	-89.5	-40.3	173.2	-71.1	71	0	0	0	111.4	Q4 A5 E6	Q4-H8 PolarHBondContact O-N 3.21Å; Q4-H8 PolarHBondContact O-ND1 3.23Å; A5-H8 PolarHBondContact O-N 2.9Å; E6-H8 PolarHBondContact O-N 3.22Å
9	S	70.8	Confident	72.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-77	-32.8	-176.1	63.6	0	0	0	0	113.9	A5 E6 Q11 V149	A5-S9 PolarHBondContact O-N 3.37Å; A5-S9 VanDerWaalsContact O-N 3.14Å; E6-S9 PolarHBondContact O-N 3.43Å; E6-S9 PolarHBondContact O-OG 3.46Å; S9-Q11 PolarHBondContact O-N 2.87Å; S9-V149 WeakPolarHBondContact O-CG2 3.31Å
10	N	63.8	Low	72.4	Confident	54 Å²	54	69.5 Å²	69.5	29%	0.289	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-72.6	13.8	-174.6	-72.7	-9.2	0	0	0	115	E6 Y12	E6-N10 WeakPolarHBondContact CG-ND2 3.29Å; E6-N10 WeakPolarHBondContact O-CB 3.38Å; E6-N10 PolarHBondContact O-N 3.37Å; E6-N10 VanDerWaalsContact O-N 3.09Å; E6-N10 PolarHBondContact OE1-ND2 3.39Å; N10-Y12 VanDerWaalsContact C-N 3.27Å; N10-Y12 PolarHBondContact O-N 3.18Å
11	Q	53.5	Low	72.4	Confident	129 Å²	129	67.8 Å²	67.8	60%	0.603	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-77.6	-6.2	179.8	-63.3	-174.4	13	0	0	114.2	S9	S9-Q11 PolarHBondContact O-N 2.87Å
12	Y	52	Low	71.8	Confident	89 Å²	89	63.4 Å²	63.4	35%	0.349	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-121.6	5.4	-172.3	-49.5	-71	0	0	0	114.8	N10 N14 V149 E152 K351	N10-Y12 VanDerWaalsContact C-N 3.27Å; N10-Y12 PolarHBondContact O-N 3.18Å; Y12-N14 PolarHBondContact O-N 3.4Å; Y12-V149 HydrophobicContact CD2-CG2 4.16Å; Y12-E152 VanDerWaalsContact CE2-OE2 3.26Å; Y12-E152 WeakPolarHBondContact CE2-OE2 3.41Å; Y12-K351 PolarHBondContact OH-NZ 3.01Å
13	L	57.6	Low	70.8	Confident	46 Å²	46	63.9 Å²	63.9	24%	0.241	32%	0.315	C	S	.	.			trans	-93.1	78.5	-175.7	-98.7	61.7	0	0	0	112.9	Y146 V149 Y183 I187	L13-Y146 HydrophobicContact CD1-CD1 4.09Å; L13-Y146 HydrophobicContact CD1-CE1 4.05Å; L13-Y146 HydrophobicContact CD2-CD1 4.01Å; L13-Y146 HydrophobicContact CD2-CE1 3.58Å; L13-Y146 HydrophobicContact CG-CD1 4.01Å; L13-Y146 HydrophobicContact CG-CE1 3.47Å; L13-Y146 VanDerWaalsContact CG-CE1 3.47Å; L13-V149 HydrophobicContact CD1-CB 3.99Å; L13-V149 HydrophobicContact CD1-CG1 3.79Å; L13-V149 HydrophobicContact CD1-CG2 3.64Å; L13-Y183 HydrophobicContact CD2-CD1 4.18Å; L13-Y183 HydrophobicContact CD2-CE1 4.46Å; L13-I187 HydrophobicContact CD2-CG2 4.08Å
14	N	54.1	Low	69.8	Low	132 Å²	132	63.1 Å²	63.1	71%	0.706	31%	0.311	S	S	*	.			trans	-155.9	103.8	151.7	-155.4	6.8	0	0	0	111.6	Y12	Y12-N14 PolarHBondContact O-N 3.4Å
15	N	63.2	Low	69	Low	45 Å²	45	58 Å²	58	24%	0.241	29%	0.288	C	S	.	.			trans	-133.7	113	163	-171.6	-4.5	0	0	0	110.2	Q17 F18 I19 S142	N15-Q17 PolarHBondContact ND2-OE1 3.02Å; N15-Q17 PolarHBondContact O-N 3.43Å; N15-Q17 WeakPolarHBondContact OD1-CB 3.39Å; N15-Q17 WeakPolarHBondContact OD1-CG 3.49Å; N15-Q17 PolarHBondContact OD1-N 3.17Å; N15-F18 HydrophobicContact CB-CB 4.39Å; N15-F18 PolarHBondContact O-N 3.01Å; N15-F18 VanDerWaalsContact O-N 3.16Å; N15-I19 PolarHBondContact O-N 3.3Å; N15-S142 PolarHBondContact ND2-OG 3.17Å
16	E	64.9	Low	68.5	Low	143 Å²	143	58 Å²	58	67%	0.668	29%	0.287	S	S	*	.	H	α-helix	trans	-56	-35.9	176.4	-59	-178.3	158.6	0	0	112.3	F18 I19 N20	E16-F18 VanDerWaalsContact C-N 3.33Å; E16-F18 PolarHBondContact O-N 3.26Å; E16-I19 PolarHBondContact O-N 3.36Å; E16-N20 VanDerWaalsContact O-CB 3.32Å; E16-N20 WeakPolarHBondContact O-CB 3.38Å; E16-N20 PolarHBondContact O-N 2.83Å; E16-N20 PolarHBondContact O-ND2 3.21Å; E16-N20 VanDerWaalsContact O-ND2 3.16Å
17	Q	63.8	Low	67.6	Low	81 Å²	81	63 Å²	63	38%	0.379	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-40	179.3	-59	178	-50.2	0	0	112	N15 N20 H21 E138	N15-Q17 PolarHBondContact ND2-OE1 3.02Å; N15-Q17 PolarHBondContact O-N 3.43Å; N15-Q17 WeakPolarHBondContact OD1-CB 3.39Å; N15-Q17 WeakPolarHBondContact OD1-CG 3.49Å; N15-Q17 PolarHBondContact OD1-N 3.17Å; Q17-N20 PolarHBondContact O-N 3.22Å; Q17-H21 WeakPolarHBondContact O-CB 3.34Å; Q17-H21 PolarHBondContact O-N 2.97Å; Q17-E138 PolarHBondContact NE2-OE2 3.35Å
18	F	72.4	Confident	66.8	Low	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-71.6	-40.5	177.8	-179.7	-91.2	0	0	0	111.6	N15 E16 N20 H21 L22 T143 Y146 F180 L184 I187 F323	N15-F18 HydrophobicContact CB-CB 4.39Å; N15-F18 PolarHBondContact O-N 3.01Å; N15-F18 VanDerWaalsContact O-N 3.16Å; E16-F18 VanDerWaalsContact C-N 3.33Å; E16-F18 PolarHBondContact O-N 3.26Å; F18-N20 VanDerWaalsContact C-N 3.31Å; F18-N20 PolarHBondContact O-N 3.34Å; F18-H21 PolarHBondContact O-N 3.39Å; F18-L22 WeakPolarHBondContact O-CB 3.33Å; F18-L22 PolarHBondContact O-N 2.87Å; F18-T143 HydrophobicContact CE2-CG2 4.43Å; F18-T143 WeakPolarHBondContact CE2-OG1 3.22Å; F18-Y146 HydrophobicContact CB-CE2 4.48Å; F18-Y146 HydrophobicContact CD1-CD2 4.16Å; F18-Y146 AromaticContact CD1-CE2 3.28Å; F18-Y146 HydrophobicContact CD1-CE2 3.28Å; F18-Y146 AromaticContact CD1-CZ 3.67Å; F18-Y146 HydrophobicContact CD2-CD2 4.34Å; F18-Y146 HydrophobicContact CD2-CE2 4.06Å; F18-Y146 AromaticContact CE1-CD2 3.77Å; F18-Y146 HydrophobicContact CE1-CD2 3.77Å; F18-Y146 HydrophobicContact CE1-CE1 4.32Å; F18-Y146 AromaticContact CE1-CE2 3.24Å; F18-Y146 HydrophobicContact CE1-CE2 3.24Å; F18-Y146 AromaticContact CE1-CZ 3.56Å; F18-Y146 AromaticContact CE2-CD2 3.98Å; F18-Y146 HydrophobicContact CE2-CD2 3.98Å; F18-Y146 HydrophobicContact CE2-CE2 4.04Å; F18-Y146 HydrophobicContact CG-CD2 4.41Å; F18-Y146 AromaticContact CG-CE2 3.69Å; F18-Y146 HydrophobicContact CG-CE2 3.69Å; F18-Y146 AromaticContact CZ-CD2 3.66Å; F18-Y146 HydrophobicContact CZ-CD2 3.66Å; F18-Y146 AromaticContact CZ-CE2 3.63Å; F18-Y146 HydrophobicContact CZ-CE2 3.63Å; F18-Y146 HydrophobicContact CZ-CG 4.4Å; F18-F180 HydrophobicContact CE2-CZ 4.39Å; F18-F180 HydrophobicContact CZ-CE2 4.12Å; F18-F180 AromaticContact CZ-CZ 3.94Å; F18-F180 HydrophobicContact CZ-CZ 3.94Å; F18-L184 HydrophobicContact CE1-CD2 3.62Å; F18-L184 HydrophobicContact CZ-CD2 3.7Å; F18-I187 HydrophobicContact CD1-CD1 4.31Å; F18-I187 HydrophobicContact CE1-CD1 3.86Å; F18-F323 HydrophobicContact CE2-CD1 4.11Å; F18-F323 HydrophobicContact CZ-CD1 4.3Å; F18-F323 HydrophobicContact CZ-CE1 4.44Å
19	I	71.9	Confident	66.7	Low	54 Å²	54	56.7 Å²	56.7	28%	0.277	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-40.6	174.8	-64.3	170.4	0	0	0	110.2	N15 E16 L22 N23	N15-I19 PolarHBondContact O-N 3.3Å; E16-I19 PolarHBondContact O-N 3.36Å; I19-L22 PolarHBondContact O-N 2.71Å; I19-N23 WeakPolarHBondContact O-CB 3.47Å; I19-N23 PolarHBondContact O-N 2.86Å; I19-N23 PolarHBondContact O-ND2 3.12Å
20	N	67.2	Low	66.6	Low	100 Å²	100	58.9 Å²	58.9	54%	0.535	28%	0.281	S	S	.	.	H	α-helix	trans	-66.4	-38.5	175.1	-71.9	-27.9	0	0	0	112.6	E16 Q17 F18 N23 L24	E16-N20 VanDerWaalsContact O-CB 3.32Å; E16-N20 WeakPolarHBondContact O-CB 3.38Å; E16-N20 PolarHBondContact O-N 2.83Å; E16-N20 PolarHBondContact O-ND2 3.21Å; E16-N20 VanDerWaalsContact O-ND2 3.16Å; Q17-N20 PolarHBondContact O-N 3.22Å; F18-N20 VanDerWaalsContact C-N 3.31Å; F18-N20 PolarHBondContact O-N 3.34Å; N20-N23 PolarHBondContact O-N 3.1Å; N20-L24 WeakPolarHBondContact O-CB 3.44Å; N20-L24 PolarHBondContact O-N 3.16Å
21	H	72.4	Confident	66.6	Low	34 Å²	34	58.3 Å²	58.3	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-42	174	-176.4	63.7	0	0	0	112.4	Q17 F18 L24 I25 I139 S322	Q17-H21 WeakPolarHBondContact O-CB 3.34Å; Q17-H21 PolarHBondContact O-N 2.97Å; F18-H21 PolarHBondContact O-N 3.39Å; H21-L24 WeakPolarHBondContact O-CB 3.46Å; H21-L24 PolarHBondContact O-N 2.96Å; H21-I25 WeakPolarHBondContact O-CG1 3.47Å; H21-I25 PolarHBondContact O-N 3.39Å; H21-I139 HydrophobicContact CB-CD1 4.19Å; H21-I139 HydrophobicContact CB-CG1 4.16Å; H21-S322 PolarHBondContact NE2-O 3.45Å
22	L	77.7	Confident	67.3	Low	2 Å²	2	52.6 Å²	52.6	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-49	172.1	179.6	66	0	0	0	111	F18 I19 L24 I25 L26 L184 I187 Y188 F323	F18-L22 WeakPolarHBondContact O-CB 3.33Å; F18-L22 PolarHBondContact O-N 2.87Å; I19-L22 PolarHBondContact O-N 2.71Å; L22-L24 VanDerWaalsContact C-N 3.26Å; L22-L24 PolarHBondContact O-N 3.37Å; L22-I25 PolarHBondContact O-N 3.24Å; L22-I25 VanDerWaalsContact O-N 3.17Å; L22-L26 HydrophobicContact CD1-CD1 4.1Å; L22-L26 HydrophobicContact CD1-CG 4.3Å; L22-L26 HydrophobicContact CG-CD1 3.99Å; L22-L26 HydrophobicContact CG-CG 4.49Å; L22-L26 WeakPolarHBondContact O-CG 3.36Å; L22-L26 PolarHBondContact O-N 3.07Å; L22-L184 HydrophobicContact CD1-CD1 4.23Å; L22-L184 HydrophobicContact CD1-CD2 3.93Å; L22-L184 HydrophobicContact CD2-CD2 3.87Å; L22-L184 HydrophobicContact CG-CD2 4.48Å; L22-I187 HydrophobicContact CD2-CD1 4.44Å; L22-Y188 HydrophobicContact CD2-CD2 4.45Å; L22-F323 HydrophobicContact CD1-CE1 4.03Å; L22-F323 HydrophobicContact CD1-CZ 3.93Å
23	N	72.3	Confident	68.1	Low	29 Å²	29	50.7 Å²	50.7	16%	0.155	25%	0.245	C	C	.	.	H	α-helix	trans	-58.8	-36.7	175.9	-71.9	-22.3	0	0	0	112	I19 N20 Y27	I19-N23 WeakPolarHBondContact O-CB 3.47Å; I19-N23 PolarHBondContact O-N 2.86Å; I19-N23 PolarHBondContact O-ND2 3.12Å; N20-N23 PolarHBondContact O-N 3.1Å; N23-Y27 WeakPolarHBondContact O-CB 3.44Å; N23-Y27 PolarHBondContact O-N 3.09Å
24	L	70	Confident	68.5	Low	57 Å²	57	50 Å²	50	30%	0.298	24%	0.24	S	C	.	.	H	α-helix	trans	-67.5	-42.5	175.2	178.4	58.7	0	0	0	112.4	N20 H21 L22 K28 I79	N20-L24 WeakPolarHBondContact O-CB 3.44Å; N20-L24 PolarHBondContact O-N 3.16Å; H21-L24 WeakPolarHBondContact O-CB 3.46Å; H21-L24 PolarHBondContact O-N 2.96Å; L22-L24 VanDerWaalsContact C-N 3.26Å; L22-L24 PolarHBondContact O-N 3.37Å; L24-K28 WeakPolarHBondContact O-CB 3.3Å; L24-K28 PolarHBondContact O-N 3.24Å; L24-I79 HydrophobicContact CD1-CD1 3.68Å; L24-I79 HydrophobicContact CD2-CD1 4.3Å
25	I	72.5	Confident	68.9	Low	19 Å²	19	47.1 Å²	47.1	10%	0.097	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-52.1	173.9	-69.6	167.5	0	0	0	109.7	H21 L22 Y27 K28 S29 W318 F323	H21-I25 WeakPolarHBondContact O-CG1 3.47Å; H21-I25 PolarHBondContact O-N 3.39Å; L22-I25 PolarHBondContact O-N 3.24Å; L22-I25 VanDerWaalsContact O-N 3.17Å; I25-Y27 PolarHBondContact O-N 2.96Å; I25-K28 WeakPolarHBondContact O-CB 3.12Å; I25-K28 PolarHBondContact O-N 3.01Å; I25-S29 PolarHBondContact O-N 3.14Å; I25-S29 PolarHBondContact O-OG 3.48Å; I25-W318 HydrophobicContact CG2-CH2 4.13Å; I25-W318 HydrophobicContact CG2-CZ2 4.26Å; I25-F323 HydrophobicContact CD1-CD1 4.31Å; I25-F323 HydrophobicContact CD1-CE1 3.77Å; I25-F323 HydrophobicContact CD1-CE2 4.07Å; I25-F323 HydrophobicContact CD1-CZ 3.63Å
26	L	76.8	Confident	69	Low	1 Å²	1	51 Å²	51	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-36.4	-176.9	-60.2	176.3	0	0	0	112.5	L22 S29 R30 Y188 F230 Q231 L234	L22-L26 HydrophobicContact CD1-CD1 4.1Å; L22-L26 HydrophobicContact CD1-CG 4.3Å; L22-L26 HydrophobicContact CG-CD1 3.99Å; L22-L26 HydrophobicContact CG-CG 4.49Å; L22-L26 WeakPolarHBondContact O-CG 3.36Å; L22-L26 PolarHBondContact O-N 3.07Å; L26-S29 PolarHBondContact O-N 3.22Å; L26-R30 WeakPolarHBondContact O-CB 3.39Å; L26-R30 PolarHBondContact O-N 3.38Å; L26-Y188 HydrophobicContact CD1-CD1 4.03Å; L26-Y188 HydrophobicContact CD1-CD2 3.87Å; L26-Y188 HydrophobicContact CD1-CE1 3.82Å; L26-Y188 HydrophobicContact CD1-CE2 3.66Å; L26-Y188 HydrophobicContact CD1-CG 4.07Å; L26-F230 HydrophobicContact CD2-CD1 4.42Å; L26-Q231 HydrophobicContact CD2-CB 3.85Å; L26-Q231 HydrophobicContact CD2-CG 4.09Å; L26-Q231 PolarHBondContact O-OE1 3.47Å; L26-L234 HydrophobicContact CD1-CD1 4.35Å; L26-L234 HydrophobicContact CD2-CD1 3.83Å
27	Y	67.9	Low	69	Low	105 Å²	105	49.6 Å²	49.6	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-64.2	-43.1	172.3	-178.1	-97.1	0	0	0	111.5	N23 I25 R30 I31	N23-Y27 WeakPolarHBondContact O-CB 3.44Å; N23-Y27 PolarHBondContact O-N 3.09Å; I25-Y27 PolarHBondContact O-N 2.96Å; Y27-R30 PolarHBondContact O-N 3.07Å; Y27-I31 HydrophobicContact CD1-CG1 4.19Å; Y27-I31 HydrophobicContact CE1-CD1 4.37Å; Y27-I31 HydrophobicContact CE1-CG1 3.76Å; Y27-I31 HydrophobicContact CE2-CD1 4.35Å; Y27-I31 HydrophobicContact CE2-CG1 4.29Å; Y27-I31 WeakPolarHBondContact O-CG1 3.22Å; Y27-I31 PolarHBondContact O-N 2.81Å
28	K	65.1	Low	68.2	Low	70 Å²	70	48.6 Å²	48.6	30%	0.304	25%	0.246	S	C	.	.	H	α-helix	trans	-59.7	-49.5	174.8	-171.7	-177.9	-179.9	178.5	0	110.4	L24 I25 R30 I31 I32	L24-K28 WeakPolarHBondContact O-CB 3.3Å; L24-K28 PolarHBondContact O-N 3.24Å; I25-K28 WeakPolarHBondContact O-CB 3.12Å; I25-K28 PolarHBondContact O-N 3.01Å; K28-R30 VanDerWaalsContact C-N 3.33Å; K28-R30 PolarHBondContact O-N 3.2Å; K28-I31 PolarHBondContact O-N 3.2Å; K28-I32 HydrophobicContact CG-CD1 3.89Å; K28-I32 VanDerWaalsContact O-CD1 3.31Å; K28-I32 WeakPolarHBondContact O-CD1 3.4Å; K28-I32 WeakPolarHBondContact O-CG1 3.02Å; K28-I32 PolarHBondContact O-N 2.93Å
29	S	70.9	Confident	67.2	Low	1 Å²	1	54 Å²	54	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-56.7	-42.9	176.7	-60.8	0	0	0	0	112.7	I25 L26 I32 K33 S227	I25-S29 PolarHBondContact O-N 3.14Å; I25-S29 PolarHBondContact O-OG 3.48Å; L26-S29 PolarHBondContact O-N 3.22Å; S29-I32 PolarHBondContact O-N 2.98Å; S29-K33 WeakPolarHBondContact O-CB 3.36Å; S29-K33 PolarHBondContact O-N 2.97Å; S29-S227 WeakPolarHBondContact CB-O 3.33Å; S29-S227 VanDerWaalsContact OG-C 3.3Å; S29-S227 WeakPolarHBondContact OG-CB 3.33Å; S29-S227 PolarHBondContact OG-O 3.46Å; S29-S227 VanDerWaalsContact OG-O 3.1Å; S29-S227 PolarHBondContact OG-OG 2.86Å
30	R	68.7	Low	65.8	Low	45 Å²	45	55.8 Å²	55.8	17%	0.17	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-46.2	175.9	-177	172.9	171.4	166.1	0.4	112.6	L26 Y27 K28 I32 K33 E34 I193 S197	L26-R30 WeakPolarHBondContact O-CB 3.39Å; L26-R30 PolarHBondContact O-N 3.38Å; Y27-R30 PolarHBondContact O-N 3.07Å; K28-R30 VanDerWaalsContact C-N 3.33Å; K28-R30 PolarHBondContact O-N 3.2Å; R30-I32 VanDerWaalsContact C-N 3.33Å; R30-I32 PolarHBondContact O-N 3.39Å; R30-K33 WeakPolarHBondContact O-CB 3.47Å; R30-K33 PolarHBondContact O-N 2.66Å; R30-K33 VanDerWaalsContact O-N 3.16Å; R30-E34 HydrophobicContact CG-CG 4.35Å; R30-E34 IonicContact CZ-OE1 2.69Å; R30-E34 VanDerWaalsContact CZ-OE1 3.24Å; R30-E34 IonicContact NE-OE1 2.78Å; R30-E34 PolarHBondContact NE-OE1 3.03Å; R30-E34 IonicContact NE-OE2 2.84Å; R30-E34 IonicContact NH2-OE1 3.24Å; R30-E34 PolarHBondContact NH2-OE1 3.03Å; R30-E34 WeakPolarHBondContact O-CG 3.33Å; R30-E34 PolarHBondContact O-N 2.87Å; R30-I193 PolarHBondContact NH1-O 2.87Å; R30-S197 PolarHBondContact NH2-OG 2.94Å; R30-S197 VanDerWaalsContact NH2-OG 3.07Å
31	I	63.4	Low	64.5	Low	43 Å²	43	54.8 Å²	54.8	22%	0.221	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-39.9	177.6	-66.9	-65.7	0	0	0	111.1	Y27 K28 K33 E34 L35	Y27-I31 HydrophobicContact CD1-CG1 4.19Å; Y27-I31 HydrophobicContact CE1-CD1 4.37Å; Y27-I31 HydrophobicContact CE1-CG1 3.76Å; Y27-I31 HydrophobicContact CE2-CD1 4.35Å; Y27-I31 HydrophobicContact CE2-CG1 4.29Å; Y27-I31 WeakPolarHBondContact O-CG1 3.22Å; Y27-I31 PolarHBondContact O-N 2.81Å; K28-I31 PolarHBondContact O-N 3.2Å; I31-K33 VanDerWaalsContact C-N 3.33Å; I31-K33 PolarHBondContact O-N 3.31Å; I31-E34 PolarHBondContact O-N 2.96Å; I31-L35 HydrophobicContact CG2-CD1 3.93Å; I31-L35 HydrophobicContact CG2-CG 4.43Å; I31-L35 WeakPolarHBondContact O-CB 3.11Å; I31-L35 WeakPolarHBondContact O-CD1 3.32Å; I31-L35 WeakPolarHBondContact O-CG 3.45Å; I31-L35 PolarHBondContact O-N 3.29Å
32	I	68.3	Low	62.9	Low	9 Å²	9	58.9 Å²	58.9	5%	0.046	30%	0.302	C	S	.	.	H	α-helix	trans	-59.6	-45.4	173.5	-62.8	155.9	0	0	0	110.1	K28 S29 R30 L35 H36 Q224 I228	K28-I32 HydrophobicContact CG-CD1 3.89Å; K28-I32 VanDerWaalsContact O-CD1 3.31Å; K28-I32 WeakPolarHBondContact O-CD1 3.4Å; K28-I32 WeakPolarHBondContact O-CG1 3.02Å; K28-I32 PolarHBondContact O-N 2.93Å; S29-I32 PolarHBondContact O-N 2.98Å; R30-I32 VanDerWaalsContact C-N 3.33Å; R30-I32 PolarHBondContact O-N 3.39Å; I32-L35 PolarHBondContact O-N 3.19Å; I32-H36 PolarHBondContact O-CD2 3.4Å; I32-H36 PolarHBondContact O-N 2.93Å; I32-Q224 HydrophobicContact CD1-CB 4.3Å; I32-Q224 HydrophobicContact CD1-CG 3.72Å; I32-Q224 HydrophobicContact CG1-CG 4.09Å; I32-Q224 HydrophobicContact CG2-CB 3.75Å; I32-Q224 HydrophobicContact CG2-CG 3.78Å; I32-I228 HydrophobicContact CB-CD1 4.4Å; I32-I228 HydrophobicContact CG2-CD1 3.77Å; I32-I228 HydrophobicContact CG2-CG1 4.34Å
33	K	69.5	Low	61	Low	48 Å²	48	66.2 Å²	66.2	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-48.4	177.7	-174	175.7	178.7	176.9	0	112.5	S29 R30 I31 L35 H36 E37 I228 D232	S29-K33 WeakPolarHBondContact O-CB 3.36Å; S29-K33 PolarHBondContact O-N 2.97Å; R30-K33 WeakPolarHBondContact O-CB 3.47Å; R30-K33 PolarHBondContact O-N 2.66Å; R30-K33 VanDerWaalsContact O-N 3.16Å; I31-K33 VanDerWaalsContact C-N 3.33Å; I31-K33 PolarHBondContact O-N 3.31Å; K33-L35 VanDerWaalsContact C-N 3.29Å; K33-L35 PolarHBondContact O-N 3.33Å; K33-H36 PolarHBondContact O-N 3.08Å; K33-H36 VanDerWaalsContact O-N 3.12Å; K33-E37 WeakPolarHBondContact CE-OE1 3.42Å; K33-E37 WeakPolarHBondContact CG-OE1 3.45Å; K33-E37 WeakPolarHBondContact O-CB 3.04Å; K33-E37 WeakPolarHBondContact O-CG 3.44Å; K33-E37 PolarHBondContact O-N 2.64Å; K33-I228 HydrophobicContact CB-CD1 4.16Å; K33-I228 HydrophobicContact CB-CG1 4.23Å; K33-I228 HydrophobicContact CD-CG2 4.33Å; K33-D232 IonicContact NZ-OD1 2.7Å; K33-D232 PolarHBondContact NZ-OD1 2.86Å
34	E	65.5	Low	59.2	Low	31 Å²	31	67.6 Å²	67.6	15%	0.145	35%	0.346	C	S	.	.	H	α-helix	trans	-65.6	-30.2	179.5	-71	172.1	163	0	0	112.6	R30 I31 G38 N39 Y40	R30-E34 HydrophobicContact CG-CG 4.35Å; R30-E34 IonicContact CZ-OE1 2.69Å; R30-E34 VanDerWaalsContact CZ-OE1 3.24Å; R30-E34 IonicContact NE-OE1 2.78Å; R30-E34 PolarHBondContact NE-OE1 3.03Å; R30-E34 IonicContact NE-OE2 2.84Å; R30-E34 IonicContact NH2-OE1 3.24Å; R30-E34 PolarHBondContact NH2-OE1 3.03Å; R30-E34 WeakPolarHBondContact O-CG 3.33Å; R30-E34 PolarHBondContact O-N 2.87Å; I31-E34 PolarHBondContact O-N 2.96Å; E34-G38 PolarHBondContact O-N 2.7Å; E34-N39 PolarHBondContact O-N 2.69Å; E34-N39 VanDerWaalsContact O-N 3.16Å; E34-Y40 HydrophobicContact CB-CD2 4.24Å; E34-Y40 HydrophobicContact CB-CE2 3.87Å
35	L	62.8	Low	57.7	Low	72 Å²	72	67.3 Å²	67.3	38%	0.377	35%	0.345	S	S	.	.	H	α-helix	trans	-70.1	-42.7	169.5	-72.5	168.1	0	0	0	112.2	I31 I32 K33 E37 G38 Y40 I45	I31-L35 HydrophobicContact CG2-CD1 3.93Å; I31-L35 HydrophobicContact CG2-CG 4.43Å; I31-L35 WeakPolarHBondContact O-CB 3.11Å; I31-L35 WeakPolarHBondContact O-CD1 3.32Å; I31-L35 WeakPolarHBondContact O-CG 3.45Å; I31-L35 PolarHBondContact O-N 3.29Å; I32-L35 PolarHBondContact O-N 3.19Å; K33-L35 VanDerWaalsContact C-N 3.29Å; K33-L35 PolarHBondContact O-N 3.33Å; L35-E37 VanDerWaalsContact C-N 3.33Å; L35-G38 PolarHBondContact O-N 2.69Å; L35-Y40 HydrophobicContact CD2-CD2 4.32Å; L35-I45 HydrophobicContact CD2-CD1 4.11Å; L35-I45 HydrophobicContact CD2-CG1 4.44Å
36	H	66.1	Low	56	Low	126 Å²	126	73 Å²	73	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-65.8	-33.4	175.7	-95.4	-88.9	0	0	0	113.2	I32 K33 G38	I32-H36 PolarHBondContact O-CD2 3.4Å; I32-H36 PolarHBondContact O-N 2.93Å; K33-H36 PolarHBondContact O-N 3.08Å; K33-H36 VanDerWaalsContact O-N 3.12Å; H36-G38 PolarHBondContact O-N 3.34Å
37	E	63.4	Low	54	Low	115 Å²	115	77.7 Å²	77.7	54%	0.537	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-5.6	176	-70	174.1	-172.8	0	0	113	K33 L35	K33-E37 WeakPolarHBondContact CE-OE1 3.42Å; K33-E37 WeakPolarHBondContact CG-OE1 3.45Å; K33-E37 WeakPolarHBondContact O-CB 3.04Å; K33-E37 WeakPolarHBondContact O-CG 3.44Å; K33-E37 PolarHBondContact O-N 2.64Å; L35-E37 VanDerWaalsContact C-N 3.33Å
38	G	46.9	Very low	52.3	Low	60 Å²	60	76.5 Å²	76.5	62%	0.619	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	15.9	173.5	0	0	0	0	0	115.1	E34 L35 H36 Y40	E34-G38 PolarHBondContact O-N 2.7Å; L35-G38 PolarHBondContact O-N 2.69Å; H36-G38 PolarHBondContact O-N 3.34Å; G38-Y40 VanDerWaalsContact C-N 3.26Å; G38-Y40 PolarHBondContact O-N 3.28Å
39	N	52.1	Low	50.7	Low	114 Å²	114	78.5 Å²	78.5	61%	0.61	42%	0.419	S	S	*	.			trans	-78.8	0.1	-171.3	-71.4	-44.7	0	0	0	114.8	E34	E34-N39 PolarHBondContact O-N 2.69Å; E34-N39 VanDerWaalsContact O-N 3.16Å
40	Y	41.6	Very low	48.7	Very low	91 Å²	91	86.3 Å²	86.3	36%	0.357	46%	0.457	S	S	.	.			trans	-116.5	125.4	-178.4	-82	-68.5	0	0	0	113.4	E34 L35 G38 T44	E34-Y40 HydrophobicContact CB-CD2 4.24Å; E34-Y40 HydrophobicContact CB-CE2 3.87Å; L35-Y40 HydrophobicContact CD2-CD2 4.32Å; G38-Y40 VanDerWaalsContact C-N 3.26Å; G38-Y40 PolarHBondContact O-N 3.28Å; Y40-T44 HydrophobicContact CD1-CG2 4.01Å; Y40-T44 HydrophobicContact CE1-CG2 3.97Å
41	S	41.1	Very low	47.2	Very low	78 Å²	78	88.4 Å²	88.4	55%	0.545	47%	0.471	S	S	.	.			trans	-75.9	149.5	167.5	56.2	0	0	0	0	111.6	E43 T44	S41-E43 PolarHBondContact O-N 3.47Å; S41-T44 PolarHBondContact O-N 3.36Å
42	N	38.2	Very low	45.8	Very low	120 Å²	120	89.3 Å²	89.3	64%	0.642	47%	0.474	S	S	*	.	H	α-helix	trans	-61.7	-4.9	-172.3	-73.7	-30.3	0	0	0	116.1
43	E	37.7	Very low	44	Very low	157 Å²	157	93.4 Å²	93.4	73%	0.734	50%	0.495	S	S	*	.	H	α-helix	trans	-91.6	-34.7	177.6	-61	-166.8	134.9	0	0	112.2	S41 I45 K46	S41-E43 PolarHBondContact O-N 3.47Å; E43-I45 VanDerWaalsContact C-N 3.26Å; E43-I45 PolarHBondContact O-N 3.33Å; E43-K46 PolarHBondContact O-N 3.16Å
44	T	34.7	Very low	42.3	Very low	57 Å²	57	92.7 Å²	92.7	35%	0.35	50%	0.495	S	S	.	.	H	α-helix	trans	-64.9	-36.3	171.9	-30.3	0	0	0	0	110.8	Y40 S41 K46 S47 S48	Y40-T44 HydrophobicContact CD1-CG2 4.01Å; Y40-T44 HydrophobicContact CE1-CG2 3.97Å; S41-T44 PolarHBondContact O-N 3.36Å; T44-K46 VanDerWaalsContact C-N 3.29Å; T44-K46 PolarHBondContact O-N 3.46Å; T44-S47 PolarHBondContact O-N 3.19Å; T44-S47 VanDerWaalsContact O-N 3.1Å; T44-S47 PolarHBondContact O-OG 3.43Å; T44-S48 PolarHBondContact O-N 3.07Å
45	I	39.5	Very low	40.8	Very low	52 Å²	52	92 Å²	92	27%	0.267	49%	0.493	S	S	.	.	H	α-helix	trans	-57.9	-41.1	175.2	-62.3	179.2	0	0	0	110.6	L35 E43 S47 S48 E49	L35-I45 HydrophobicContact CD2-CD1 4.11Å; L35-I45 HydrophobicContact CD2-CG1 4.44Å; E43-I45 VanDerWaalsContact C-N 3.26Å; E43-I45 PolarHBondContact O-N 3.33Å; I45-S47 PolarHBondContact O-N 2.84Å; I45-S48 CarbonylContact O-C 3.38Å; I45-S48 WeakPolarHBondContact O-CA 3.38Å; I45-S48 PolarHBondContact O-N 3.34Å; I45-E49 HydrophobicContact CG2-CG 4.2Å; I45-E49 WeakPolarHBondContact O-CG 3.38Å; I45-E49 PolarHBondContact O-N 2.86Å
46	K	36	Very low	39.5	Very low	138 Å²	138	92 Å²	92	60%	0.6	49%	0.489	S	S	*	.	H	α-helix	trans	-65.4	-20.7	177.2	-70.6	171.2	-177.6	175.9	0	115.2	E43 T44 E49	E43-K46 PolarHBondContact O-N 3.16Å; T44-K46 VanDerWaalsContact C-N 3.29Å; T44-K46 PolarHBondContact O-N 3.46Å; K46-E49 VanDerWaalsContact CG-OE1 3.29Å; K46-E49 WeakPolarHBondContact CG-OE1 3.17Å
47	S	34	Very low	38.2	Very low	99 Å²	99	88.6 Å²	88.6	69%	0.692	48%	0.475	S	S	*	.	H	α-helix	trans	-86.5	-10.4	168.5	56.6	0	0	0	0	113.9	T44 I45	T44-S47 PolarHBondContact O-N 3.19Å; T44-S47 VanDerWaalsContact O-N 3.1Å; T44-S47 PolarHBondContact O-OG 3.43Å; I45-S47 PolarHBondContact O-N 2.84Å
48	S	33.6	Very low	36.7	Very low	81 Å²	81	86.3 Å²	86.3	57%	0.566	47%	0.466	S	S	*	.	H	α-helix	trans	-105.8	-7.8	173.9	-61.8	0	0	0	0	113.5	T44 I45 M50 I51	T44-S48 PolarHBondContact O-N 3.07Å; I45-S48 CarbonylContact O-C 3.38Å; I45-S48 WeakPolarHBondContact O-CA 3.38Å; I45-S48 PolarHBondContact O-N 3.34Å; S48-M50 PolarHBondContact O-N 2.79Å; S48-I51 PolarHBondContact O-N 3.37Å
49	E	29.9	Very low	36	Very low	112 Å²	112	87.3 Å²	87.3	52%	0.523	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	49.5	178.8	-88.9	172.6	-152.1	0	0	114.7	I45 K46	I45-E49 HydrophobicContact CG2-CG 4.2Å; I45-E49 WeakPolarHBondContact O-CG 3.38Å; I45-E49 PolarHBondContact O-N 2.86Å; K46-E49 VanDerWaalsContact CG-OE1 3.29Å; K46-E49 WeakPolarHBondContact CG-OE1 3.17Å
50	M	30.5	Very low	35.2	Very low	165 Å²	165	87.2 Å²	87.2	81%	0.813	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-164.9	0.1	153.1	-120.9	171.4	-74.1	0	0	116.5	S48 H52	S48-M50 PolarHBondContact O-N 2.79Å; M50-H52 PolarHBondContact O-N 3.42Å
51	I	35.5	Very low	34.7	Very low	89 Å²	89	86.5 Å²	86.5	46%	0.456	47%	0.473	S	S	.	.	S	Bend	trans	-73.7	96.4	170.4	-69.1	-174.1	0	0	0	107.6	S48 L53 L75	S48-I51 PolarHBondContact O-N 3.37Å; I51-L53 PolarHBondContact O-N 2.96Å; I51-L53 VanDerWaalsContact O-N 3.07Å; I51-L75 HydrophobicContact CG2-CD2 3.55Å; I51-L75 HydrophobicContact CG2-CG 3.9Å
52	H	34.2	Very low	34	Very low	62 Å²	62	89.7 Å²	89.7	29%	0.287	49%	0.49	S	S	.	.			trans	-52.7	109.1	-162.8	-120	-108.7	0	0	0	113.2	M50 T54 N71 L75	M50-H52 PolarHBondContact O-N 3.42Å; H52-T54 WeakPolarHBondContact ND1-CG2 3.49Å; H52-T54 PolarHBondContact ND1-OG1 3.37Å; H52-T54 PolarHBondContact O-N 2.98Å; H52-T54 VanDerWaalsContact O-N 3.08Å; H52-N71 HydrophobicContact CB-CB 4.17Å; H52-N71 PolarHBondContact CD2-ND2 3.45Å; H52-N71 VanDerWaalsContact CD2-ND2 3.34Å; H52-N71 PolarHBondContact CE1-ND2 2.9Å; H52-N71 PolarHBondContact NE2-ND2 3.47Å; H52-L75 HydrophobicContact CB-CD1 3.79Å
53	L	31.4	Very low	33.7	Very low	94 Å²	94	90 Å²	90	49%	0.492	49%	0.491	S	S	.	.			trans	-71.4	3.8	177.5	-107.1	164.1	0	0	0	113.9	I51 T55	I51-L53 PolarHBondContact O-N 2.96Å; I51-L53 VanDerWaalsContact O-N 3.07Å; L53-T55 PolarHBondContact O-N 3.47Å
54	T	33.5	Very low	33.4	Very low	33 Å²	33	90 Å²	90	20%	0.202	50%	0.496	C	S	.	.			trans	-52.2	109.5	170.1	46.5	0	0	0	0	110	H52 D58	H52-T54 WeakPolarHBondContact ND1-CG2 3.49Å; H52-T54 PolarHBondContact ND1-OG1 3.37Å; H52-T54 PolarHBondContact O-N 2.98Å; H52-T54 VanDerWaalsContact O-N 3.08Å; T54-D58 VanDerWaalsContact CA-OD2 3.25Å; T54-D58 WeakPolarHBondContact CA-OD2 3.4Å; T54-D58 WeakPolarHBondContact CB-OD2 3.46Å; T54-D58 WeakPolarHBondContact CG2-OD2 3.28Å
55	T	34	Very low	33.4	Very low	17 Å²	17	92.2 Å²	92.2	10%	0.104	51%	0.506	C	S	.	.			trans	-51.7	153.2	162.8	26.6	0	0	0	0	110.8	L53 N57 D58 L220 D223	L53-T55 PolarHBondContact O-N 3.47Å; T55-N57 PolarHBondContact O-N 2.97Å; T55-D58 PolarHBondContact O-N 3.39Å; T55-D58 VanDerWaalsContact O-N 3.14Å; T55-L220 HydrophobicContact CG2-CD2 3.69Å; T55-D223 HydrophobicContact CG2-CB 4.31Å; T55-D223 WeakPolarHBondContact CG2-OD2 3.22Å
56	Y	36	Very low	33.2	Very low	72 Å²	72	95.8 Å²	95.8	28%	0.282	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-59.1	-15.4	175.7	-136.1	-91.4	0	0	0	113.4	D58 I59 Y72 L136	Y56-D58 VanDerWaalsContact C-N 3.31Å; Y56-D58 PolarHBondContact O-N 3.18Å; Y56-I59 HydrophobicContact CD1-CD1 4.42Å; Y56-I59 HydrophobicContact CE1-CD1 3.91Å; Y56-Y72 HydrophobicContact CD2-CE2 4.17Å; Y56-Y72 AromaticContact CD2-CZ 3.99Å; Y56-Y72 WeakPolarHBondContact CD2-OH 3.44Å; Y56-Y72 HydrophobicContact CE2-CE1 4.32Å; Y56-Y72 AromaticContact CE2-CE2 3.95Å; Y56-Y72 HydrophobicContact CE2-CE2 3.95Å; Y56-Y72 AromaticContact CE2-CZ 3.7Å; Y56-L136 HydrophobicContact CE1-CD1 3.93Å; Y56-L136 HydrophobicContact CE1-CD2 4.2Å; Y56-L136 HydrophobicContact CE2-CD2 4.09Å; Y56-L136 WeakPolarHBondContact OH-CD1 3.45Å
57	N	37.9	Very low	33.1	Very low	55 Å²	55	94.3 Å²	94.3	29%	0.294	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-67.1	-18.2	177	-66.9	-42.4	0	0	0	114.5	T55 I59 S60 D223 Q321	T55-N57 PolarHBondContact O-N 2.97Å; N57-I59 PolarHBondContact O-N 2.96Å; N57-I59 VanDerWaalsContact O-N 3.11Å; N57-S60 PolarHBondContact O-N 2.71Å; N57-S60 PolarHBondContact O-OG 2.85Å; N57-S60 VanDerWaalsContact O-OG 3.13Å; N57-D223 PolarHBondContact ND2-OD2 2.85Å; N57-Q321 PolarHBondContact OD1-NE2 3.3Å; N57-Q321 VanDerWaalsContact OD1-NE2 3.14Å
58	D	32.2	Very low	33	Very low	66 Å²	66	93.6 Å²	93.6	35%	0.353	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-74.1	0.7	-179.1	-64.5	-37.8	0	0	0	114.5	T54 T55 Y56	T54-D58 VanDerWaalsContact CA-OD2 3.25Å; T54-D58 WeakPolarHBondContact CA-OD2 3.4Å; T54-D58 WeakPolarHBondContact CB-OD2 3.46Å; T54-D58 WeakPolarHBondContact CG2-OD2 3.28Å; T55-D58 PolarHBondContact O-N 3.39Å; T55-D58 VanDerWaalsContact O-N 3.14Å; Y56-D58 VanDerWaalsContact C-N 3.31Å; Y56-D58 PolarHBondContact O-N 3.18Å
59	I	32.9	Very low	33	Very low	82 Å²	82	92.7 Å²	92.7	42%	0.421	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-90.4	-5.8	178.6	-60	177.1	0	0	0	111.6	Y56 N57 S61	Y56-I59 HydrophobicContact CD1-CD1 4.42Å; Y56-I59 HydrophobicContact CE1-CD1 3.91Å; N57-I59 PolarHBondContact O-N 2.96Å; N57-I59 VanDerWaalsContact O-N 3.11Å; I59-S61 PolarHBondContact O-N 3.46Å
60	S	34.3	Very low	33.1	Very low	111 Å²	111	90.1 Å²	90.1	78%	0.776	49%	0.488	S	S	*	.	S	Bend	trans	-79.6	-7.6	180	61.3	0	0	0	0	115.6	N57	N57-S60 PolarHBondContact O-N 2.71Å; N57-S60 PolarHBondContact O-OG 2.85Å; N57-S60 VanDerWaalsContact O-OG 3.13Å
61	S	30.9	Very low	33.2	Very low	77 Å²	77	84.2 Å²	84.2	54%	0.538	46%	0.46	S	S	.	.	S	Bend	trans	-91.7	117.2	171.7	53.6	0	0	0	0	110.9	I59 D63	I59-S61 PolarHBondContact O-N 3.46Å; S61-D63 VanDerWaalsContact C-N 3.26Å; S61-D63 PolarHBondContact O-N 3.21Å
62	T	27.8	Very low	33.2	Very low	145 Å²	145	83.6 Å²	83.6	89%	0.89	45%	0.452	S	S	*	.			trans	-76	69	-179.6	54.6	0	0	0	0	112.6
63	D	31.2	Very low	33.2	Very low	125 Å²	125	83.3 Å²	83.3	67%	0.668	45%	0.453	S	S	*	.			trans	-122.7	139.6	173.6	-96.7	-51.6	0	0	0	111.6	S61 N65	S61-D63 VanDerWaalsContact C-N 3.26Å; S61-D63 PolarHBondContact O-N 3.21Å; D63-N65 PolarHBondContact O-N 2.83Å
64	N	32.2	Very low	33.5	Very low	158 Å²	158	82 Å²	82	85%	0.845	45%	0.448	S	S	*	.			trans	-76.3	27.9	-164.3	-72	-71.4	0	0	0	115.5	H66	N64-H66 PolarHBondContact O-N 3.45Å; N64-H66 VanDerWaalsContact O-N 3.12Å
65	N	34.1	Very low	33.7	Very low	103 Å²	103	81.2 Å²	81.2	55%	0.551	44%	0.443	S	S	*	.			trans	-80.9	94.1	-173.1	-76.3	-35.3	0	0	0	112.8	D63 N67	D63-N65 PolarHBondContact O-N 2.83Å; N65-N67 PolarHBondContact O-N 3.38Å
66	H	35.1	Very low	33.9	Very low	128 Å²	128	83.2 Å²	83.2	59%	0.593	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-16.8	172.2	-90.6	17.1	0	0	0	115.7	N64 S70	N64-H66 PolarHBondContact O-N 3.45Å; N64-H66 VanDerWaalsContact O-N 3.12Å; H66-S70 PolarHBondContact O-N 3.21Å
67	N	33.5	Very low	34.2	Very low	106 Å²	106	83 Å²	83	57%	0.567	46%	0.462	S	S	*	.	H	α-helix	trans	-65.8	-42.2	-174.7	-62.9	-11.5	0	0	0	113.3	N65 I69 S70 N71	N65-N67 PolarHBondContact O-N 3.38Å; N67-I69 VanDerWaalsContact C-N 3.3Å; N67-I69 PolarHBondContact O-N 3.35Å; N67-S70 VanDerWaalsContact O-CB 3.29Å; N67-S70 WeakPolarHBondContact O-CB 3.41Å; N67-S70 PolarHBondContact O-N 3.07Å; N67-S70 VanDerWaalsContact O-N 3.09Å; N67-N71 PolarHBondContact O-N 2.87Å; N67-N71 PolarHBondContact O-ND2 3.14Å; N67-N71 PolarHBondContact O-OD1 2.91Å
68	H	32.9	Very low	34.3	Very low	85 Å²	85	82.9 Å²	82.9	39%	0.394	47%	0.466	S	S	.	.	H	α-helix	trans	-63.8	-36.4	-176.6	-66.8	-102.5	0	0	0	112.1	N71 Y72	H68-N71 PolarHBondContact O-N 2.9Å; H68-Y72 PolarHBondContact O-N 3.22Å
69	I	33.9	Very low	34.7	Very low	61 Å²	61	81.9 Å²	81.9	31%	0.313	46%	0.46	S	S	.	.	H	α-helix	trans	-69.4	-38.1	174.8	-71.5	175.4	0	0	0	111.5	N67 N71 Y72 L73	N67-I69 VanDerWaalsContact C-N 3.3Å; N67-I69 PolarHBondContact O-N 3.35Å; I69-N71 VanDerWaalsContact C-N 3.28Å; I69-N71 PolarHBondContact O-N 3.02Å; I69-Y72 PolarHBondContact O-N 3.3Å; I69-L73 PolarHBondContact O-N 3.48Å
70	S	30.8	Very low	35	Very low	59 Å²	59	82 Å²	82	41%	0.413	46%	0.462	S	S	.	.	H	α-helix	trans	-58.2	-43.9	173.2	-168.7	0	0	0	0	111.2	H66 N67 Y72 L73 T74	H66-S70 PolarHBondContact O-N 3.21Å; N67-S70 VanDerWaalsContact O-CB 3.29Å; N67-S70 WeakPolarHBondContact O-CB 3.41Å; N67-S70 PolarHBondContact O-N 3.07Å; N67-S70 VanDerWaalsContact O-N 3.09Å; S70-Y72 VanDerWaalsContact C-N 3.28Å; S70-Y72 PolarHBondContact O-N 3.35Å; S70-L73 PolarHBondContact O-N 3.01Å; S70-T74 PolarHBondContact O-N 2.86Å; S70-T74 PolarHBondContact O-OG1 3.47Å
71	N	33.1	Very low	35.5	Very low	41 Å²	41	79.7 Å²	79.7	22%	0.219	45%	0.445	C	S	.	.	H	α-helix	trans	-68.7	-25.7	-173.8	-62.6	-10.2	0	0	0	113	H52 N67 H68 I69 T74 L75	H52-N71 HydrophobicContact CB-CB 4.17Å; H52-N71 PolarHBondContact CD2-ND2 3.45Å; H52-N71 VanDerWaalsContact CD2-ND2 3.34Å; H52-N71 PolarHBondContact CE1-ND2 2.9Å; H52-N71 PolarHBondContact NE2-ND2 3.47Å; N67-N71 PolarHBondContact O-N 2.87Å; N67-N71 PolarHBondContact O-ND2 3.14Å; N67-N71 PolarHBondContact O-OD1 2.91Å; H68-N71 PolarHBondContact O-N 2.9Å; I69-N71 VanDerWaalsContact C-N 3.28Å; I69-N71 PolarHBondContact O-N 3.02Å; N71-T74 WeakPolarHBondContact CA-OG1 3.49Å; N71-T74 PolarHBondContact O-OG1 2.87Å; N71-T74 VanDerWaalsContact O-OG1 3.07Å; N71-L75 VanDerWaalsContact O-CB 3.27Å; N71-L75 WeakPolarHBondContact O-CB 3.49Å; N71-L75 PolarHBondContact O-N 3.35Å
72	Y	34.8	Very low	35.9	Very low	76 Å²	76	80 Å²	80	30%	0.298	44%	0.437	S	S	.	.	H	α-helix	trans	-76.2	-33.6	174.2	-128.2	-84.5	0	0	0	113	Y56 H68 I69 S70 L75 N76	Y56-Y72 HydrophobicContact CD2-CE2 4.17Å; Y56-Y72 AromaticContact CD2-CZ 3.99Å; Y56-Y72 WeakPolarHBondContact CD2-OH 3.44Å; Y56-Y72 HydrophobicContact CE2-CE1 4.32Å; Y56-Y72 AromaticContact CE2-CE2 3.95Å; Y56-Y72 HydrophobicContact CE2-CE2 3.95Å; Y56-Y72 AromaticContact CE2-CZ 3.7Å; H68-Y72 PolarHBondContact O-N 3.22Å; I69-Y72 PolarHBondContact O-N 3.3Å; S70-Y72 VanDerWaalsContact C-N 3.28Å; S70-Y72 PolarHBondContact O-N 3.35Å; Y72-L75 VanDerWaalsContact O-CB 3.29Å; Y72-L75 WeakPolarHBondContact O-CB 3.36Å; Y72-L75 PolarHBondContact O-N 2.83Å; Y72-N76 PolarHBondContact O-N 2.96Å
73	L	35.2	Very low	36.4	Very low	56 Å²	56	78.6 Å²	78.6	29%	0.293	42%	0.422	S	S	.	.	H	α-helix	trans	-75.9	-36.2	175.8	-71.5	172	0	0	0	111.5	I69 S70 N76 S77 K128	I69-L73 PolarHBondContact O-N 3.48Å; S70-L73 PolarHBondContact O-N 3.01Å; L73-N76 PolarHBondContact O-N 2.78Å; L73-S77 WeakPolarHBondContact O-CB 3.39Å; L73-S77 PolarHBondContact O-N 3.11Å; L73-S77 PolarHBondContact O-OG 2.67Å; L73-K128 HydrophobicContact CD1-CG 4.46Å
74	T	37.9	Very low	36.8	Very low	65 Å²	65	77.6 Å²	77.6	40%	0.399	42%	0.416	S	S	.	.	H	α-helix	trans	-67.4	-36.1	167.5	53.7	0	0	0	0	111.7	S70 N71 N76 S77 S78	S70-T74 PolarHBondContact O-N 2.86Å; S70-T74 PolarHBondContact O-OG1 3.47Å; N71-T74 WeakPolarHBondContact CA-OG1 3.49Å; N71-T74 PolarHBondContact O-OG1 2.87Å; N71-T74 VanDerWaalsContact O-OG1 3.07Å; T74-N76 PolarHBondContact O-N 3.06Å; T74-S77 WeakPolarHBondContact CA-OG 3.42Å; T74-S77 PolarHBondContact O-N 2.69Å; T74-S77 PolarHBondContact O-OG 3.33Å; T74-S77 VanDerWaalsContact O-OG 3.14Å; T74-S78 WeakPolarHBondContact O-CA 3.47Å; T74-S78 WeakPolarHBondContact O-CB 3.34Å; T74-S78 PolarHBondContact O-N 2.98Å; T74-S78 PolarHBondContact O-OG 2.8Å
75	L	36.5	Very low	37	Very low	17 Å²	17	74.8 Å²	74.8	9%	0.089	40%	0.398	C	S	.	.	H	α-helix	trans	-54	-52.9	170.1	-121.8	146	0	0	0	111.3	I51 H52 N71 Y72 S78 I79	I51-L75 HydrophobicContact CG2-CD2 3.55Å; I51-L75 HydrophobicContact CG2-CG 3.9Å; H52-L75 HydrophobicContact CB-CD1 3.79Å; N71-L75 VanDerWaalsContact O-CB 3.27Å; N71-L75 WeakPolarHBondContact O-CB 3.49Å; N71-L75 PolarHBondContact O-N 3.35Å; Y72-L75 VanDerWaalsContact O-CB 3.29Å; Y72-L75 WeakPolarHBondContact O-CB 3.36Å; Y72-L75 PolarHBondContact O-N 2.83Å; L75-S78 PolarHBondContact O-N 3.49Å; L75-I79 HydrophobicContact CD2-CD1 3.63Å; L75-I79 HydrophobicContact CD2-CG1 4.45Å; L75-I79 WeakPolarHBondContact O-CB 3.36Å; L75-I79 VanDerWaalsContact O-CG1 3.31Å; L75-I79 WeakPolarHBondContact O-CG1 3.37Å; L75-I79 PolarHBondContact O-N 3.42Å
76	N	38.7	Very low	37.1	Very low	59 Å²	59	74.5 Å²	74.5	32%	0.316	39%	0.392	S	S	.	.	H	α-helix	trans	-72.9	-33.1	-176.2	-132.7	9.6	0	0	0	112.2	Y72 L73 T74 N80	Y72-N76 PolarHBondContact O-N 2.96Å; L73-N76 PolarHBondContact O-N 2.78Å; T74-N76 PolarHBondContact O-N 3.06Å; N76-N80 WeakPolarHBondContact O-CB 3.39Å; N76-N80 PolarHBondContact O-N 2.62Å; N76-N80 PolarHBondContact O-ND2 2.83Å
77	S	42.3	Very low	36.9	Very low	69 Å²	69	71.2 Å²	71.2	48%	0.483	38%	0.384	S	S	.	.	H	α-helix	trans	-70.2	-34.4	170.9	69.5	0	0	0	0	112.4	L73 T74 S81	L73-S77 WeakPolarHBondContact O-CB 3.39Å; L73-S77 PolarHBondContact O-N 3.11Å; L73-S77 PolarHBondContact O-OG 2.67Å; T74-S77 WeakPolarHBondContact CA-OG 3.42Å; T74-S77 PolarHBondContact O-N 2.69Å; T74-S77 PolarHBondContact O-OG 3.33Å; T74-S77 VanDerWaalsContact O-OG 3.14Å; S77-S81 WeakPolarHBondContact O-CA 3.35Å; S77-S81 WeakPolarHBondContact O-CB 3.46Å; S77-S81 PolarHBondContact O-N 2.62Å
78	S	39.2	Very low	36.9	Very low	52 Å²	52	68.8 Å²	68.8	36%	0.364	38%	0.375	S	S	.	.	H	α-helix	trans	-78.4	-30.5	178.1	-68.4	0	0	0	0	112.6	T74 L75 F82	T74-S78 WeakPolarHBondContact O-CA 3.47Å; T74-S78 WeakPolarHBondContact O-CB 3.34Å; T74-S78 PolarHBondContact O-N 2.98Å; T74-S78 PolarHBondContact O-OG 2.8Å; L75-S78 PolarHBondContact O-N 3.49Å; S78-F82 WeakPolarHBondContact O-CB 3.16Å; S78-F82 PolarHBondContact O-N 2.91Å
79	I	41.5	Very low	36.9	Very low	44 Å²	44	69.4 Å²	69.4	23%	0.226	38%	0.38	C	S	.	.	H	α-helix	trans	-68.1	-50.2	169.1	-71.9	163.8	0	0	0	109.5	L24 L75 S81 F82 M83	L24-I79 HydrophobicContact CD1-CD1 3.68Å; L24-I79 HydrophobicContact CD2-CD1 4.3Å; L75-I79 HydrophobicContact CD2-CD1 3.63Å; L75-I79 HydrophobicContact CD2-CG1 4.45Å; L75-I79 WeakPolarHBondContact O-CB 3.36Å; L75-I79 VanDerWaalsContact O-CG1 3.31Å; L75-I79 WeakPolarHBondContact O-CG1 3.37Å; L75-I79 PolarHBondContact O-N 3.42Å; I79-S81 VanDerWaalsContact C-N 3.29Å; I79-S81 PolarHBondContact O-N 3.13Å; I79-F82 PolarHBondContact O-N 3.31Å; I79-M83 HydrophobicContact CG2-CG 4.3Å; I79-M83 WeakPolarHBondContact O-CB 3.26Å; I79-M83 VanDerWaalsContact O-CG 3.23Å; I79-M83 WeakPolarHBondContact O-CG 3.45Å; I79-M83 PolarHBondContact O-N 2.83Å
80	N	39.6	Very low	36.8	Very low	86 Å²	86	72.8 Å²	72.8	46%	0.46	40%	0.397	S	S	.	.	H	α-helix	trans	-64.1	-35.9	176.4	-74.8	-63.9	0	0	0	111.8	N76 N84	N76-N80 WeakPolarHBondContact O-CB 3.39Å; N76-N80 PolarHBondContact O-N 2.62Å; N76-N80 PolarHBondContact O-ND2 2.83Å; N80-N84 WeakPolarHBondContact O-CB 3.42Å; N80-N84 PolarHBondContact O-N 3.4Å; N80-N84 PolarHBondContact O-ND2 3.37Å; N80-N84 VanDerWaalsContact O-ND2 3.16Å
81	S	44	Very low	36.8	Very low	62 Å²	62	73 Å²	73	43%	0.434	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-53.9	170.7	-167.7	0	0	0	0	110.3	S77 I79 M83 N84 E85	S77-S81 WeakPolarHBondContact O-CA 3.35Å; S77-S81 WeakPolarHBondContact O-CB 3.46Å; S77-S81 PolarHBondContact O-N 2.62Å; I79-S81 VanDerWaalsContact C-N 3.29Å; I79-S81 PolarHBondContact O-N 3.13Å; S81-M83 VanDerWaalsContact C-N 3.31Å; S81-M83 PolarHBondContact O-N 3.25Å; S81-N84 CarbonylContact O-C 3.41Å; S81-N84 PolarHBondContact O-N 2.75Å; S81-N84 VanDerWaalsContact O-N 3.13Å; S81-E85 WeakPolarHBondContact O-CA 3.31Å; S81-E85 WeakPolarHBondContact O-CB 3.32Å; S81-E85 PolarHBondContact O-N 2.87Å
82	F	39.8	Very low	36.8	Very low	82 Å²	82	73.4 Å²	73.4	36%	0.36	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-33.4	-178.3	-175.2	-109.7	0	0	0	113.4	S78 I79 K86	S78-F82 WeakPolarHBondContact O-CB 3.16Å; S78-F82 PolarHBondContact O-N 2.91Å; I79-F82 PolarHBondContact O-N 3.31Å; F82-K86 HydrophobicContact CD1-CD 4.35Å; F82-K86 HydrophobicContact CE1-CD 3.91Å; F82-K86 HydrophobicContact CE2-CD 4.35Å; F82-K86 HydrophobicContact CZ-CD 3.94Å; F82-K86 VanDerWaalsContact CZ-NZ 3.34Å; F82-K86 WeakPolarHBondContact O-CB 3.45Å; F82-K86 PolarHBondContact O-N 2.73Å
83	M	37.5	Very low	36.6	Very low	116 Å²	116	73 Å²	73	57%	0.571	41%	0.408	S	S	*	.	H	α-helix	trans	-72.2	-44.4	172.5	-68.1	-67.7	-79.8	0	0	111.2	I79 S81 E85 S87	I79-M83 HydrophobicContact CG2-CG 4.3Å; I79-M83 WeakPolarHBondContact O-CB 3.26Å; I79-M83 VanDerWaalsContact O-CG 3.23Å; I79-M83 WeakPolarHBondContact O-CG 3.45Å; I79-M83 PolarHBondContact O-N 2.83Å; S81-M83 VanDerWaalsContact C-N 3.31Å; S81-M83 PolarHBondContact O-N 3.25Å; M83-E85 VanDerWaalsContact C-N 3.25Å; M83-E85 PolarHBondContact O-N 2.76Å; M83-S87 VanDerWaalsContact O-CB 3.32Å; M83-S87 WeakPolarHBondContact O-CB 3.01Å; M83-S87 PolarHBondContact O-N 2.98Å; M83-S87 PolarHBondContact O-OG 2.75Å
84	N	39.7	Very low	36.3	Very low	104 Å²	104	71.9 Å²	71.9	56%	0.556	41%	0.405	S	S	*	.	H	α-helix	trans	-67.5	-24.1	171.8	-71.8	-22.5	0	0	0	112.8	N80 S81 S87 S88	N80-N84 WeakPolarHBondContact O-CB 3.42Å; N80-N84 PolarHBondContact O-N 3.4Å; N80-N84 PolarHBondContact O-ND2 3.37Å; N80-N84 VanDerWaalsContact O-ND2 3.16Å; S81-N84 CarbonylContact O-C 3.41Å; S81-N84 PolarHBondContact O-N 2.75Å; S81-N84 VanDerWaalsContact O-N 3.13Å; N84-S87 VanDerWaalsContact CA-OG 3.31Å; N84-S87 WeakPolarHBondContact CA-OG 3.37Å; N84-S87 PolarHBondContact O-OG 3.28Å; N84-S88 WeakPolarHBondContact O-CA 3.34Å; N84-S88 WeakPolarHBondContact O-CB 2.99Å; N84-S88 PolarHBondContact O-N 3.29Å; N84-S88 PolarHBondContact O-OG 2.75Å
85	E	37.4	Very low	36	Very low	100 Å²	100	74 Å²	74	47%	0.467	42%	0.417	S	S	.	.	H	α-helix	trans	-91.8	-34.3	-176.1	-175	168.1	-147.6	0	0	110.3	S81 M83 S88 I89	S81-E85 WeakPolarHBondContact O-CA 3.31Å; S81-E85 WeakPolarHBondContact O-CB 3.32Å; S81-E85 PolarHBondContact O-N 2.87Å; M83-E85 VanDerWaalsContact C-N 3.25Å; M83-E85 PolarHBondContact O-N 2.76Å; E85-S88 WeakPolarHBondContact CA-OG 3.09Å; E85-S88 CarbonylContact O-C 3.59Å; E85-I89 HydrophobicContact CG-CD1 3.96Å; E85-I89 HydrophobicContact CG-CG1 4.47Å; E85-I89 WeakPolarHBondContact O-CA 3.06Å; E85-I89 WeakPolarHBondContact O-CB 3.11Å; E85-I89 WeakPolarHBondContact O-CD1 3.45Å; E85-I89 WeakPolarHBondContact O-CG1 3.48Å; E85-I89 PolarHBondContact O-N 3.26Å
86	K	34.8	Very low	35.7	Very low	96 Å²	96	79.1 Å²	79.1	42%	0.417	45%	0.45	S	S	.	.	H	α-helix	trans	-70.5	-44.7	165.8	-79.4	-173.8	166.7	-178.9	0	111.8	F82 S88 I89 I90	F82-K86 HydrophobicContact CD1-CD 4.35Å; F82-K86 HydrophobicContact CE1-CD 3.91Å; F82-K86 HydrophobicContact CE2-CD 4.35Å; F82-K86 HydrophobicContact CZ-CD 3.94Å; F82-K86 VanDerWaalsContact CZ-NZ 3.34Å; F82-K86 WeakPolarHBondContact O-CB 3.45Å; F82-K86 PolarHBondContact O-N 2.73Å; K86-S88 VanDerWaalsContact C-N 3.34Å; K86-S88 PolarHBondContact O-N 2.79Å; K86-I89 PolarHBondContact O-N 2.9Å; K86-I90 WeakPolarHBondContact O-CG1 3.37Å; K86-I90 PolarHBondContact O-N 3.41Å; K86-I90 VanDerWaalsContact O-N 3.08Å
87	S	32.1	Very low	35.3	Very low	60 Å²	60	82.8 Å²	82.8	42%	0.42	47%	0.474	S	S	.	.	H	α-helix	trans	-65.6	-35.4	173.5	58.1	0	0	0	0	112.3	M83 N84 T91	M83-S87 VanDerWaalsContact O-CB 3.32Å; M83-S87 WeakPolarHBondContact O-CB 3.01Å; M83-S87 PolarHBondContact O-N 2.98Å; M83-S87 PolarHBondContact O-OG 2.75Å; N84-S87 VanDerWaalsContact CA-OG 3.31Å; N84-S87 WeakPolarHBondContact CA-OG 3.37Å; N84-S87 PolarHBondContact O-OG 3.28Å; S87-T91 WeakPolarHBondContact O-CB 3.16Å; S87-T91 PolarHBondContact O-N 3.34Å; S87-T91 PolarHBondContact O-OG1 2.96Å
88	S	32.3	Very low	34.8	Very low	55 Å²	55	91.2 Å²	91.2	39%	0.385	50%	0.495	S	S	.	.	H	α-helix	trans	-81.1	-21.1	172.2	69.8	0	0	0	0	114.8	N84 E85 K86 I90 T91 S92	N84-S88 WeakPolarHBondContact O-CA 3.34Å; N84-S88 WeakPolarHBondContact O-CB 2.99Å; N84-S88 PolarHBondContact O-N 3.29Å; N84-S88 PolarHBondContact O-OG 2.75Å; E85-S88 WeakPolarHBondContact CA-OG 3.09Å; E85-S88 CarbonylContact O-C 3.59Å; K86-S88 VanDerWaalsContact C-N 3.34Å; K86-S88 PolarHBondContact O-N 2.79Å; S88-I90 VanDerWaalsContact C-N 3.33Å; S88-T91 CarbonylContact O-C 3.57Å; S88-T91 WeakPolarHBondContact O-CA 3.44Å; S88-T91 PolarHBondContact O-N 2.98Å; S88-S92 WeakPolarHBondContact O-CA 3.35Å; S88-S92 WeakPolarHBondContact O-CB 3.31Å; S88-S92 PolarHBondContact O-N 3.22Å; S88-S92 PolarHBondContact O-OG 3.45Å
89	I	33.8	Very low	34.4	Very low	97 Å²	97	100.2 Å²	100.2	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-38.8	167.8	-80.2	163.4	0	0	0	109.8	E85 K86 T91	E85-I89 HydrophobicContact CG-CD1 3.96Å; E85-I89 HydrophobicContact CG-CG1 4.47Å; E85-I89 WeakPolarHBondContact O-CA 3.06Å; E85-I89 WeakPolarHBondContact O-CB 3.11Å; E85-I89 WeakPolarHBondContact O-CD1 3.45Å; E85-I89 WeakPolarHBondContact O-CG1 3.48Å; E85-I89 PolarHBondContact O-N 3.26Å; K86-I89 PolarHBondContact O-N 2.9Å; I89-T91 PolarHBondContact O-N 3.26Å
90	I	31.7	Very low	33.8	Very low	133 Å²	133	103.1 Å²	103.1	68%	0.682	55%	0.545	S	S	*	.	H	α-helix	trans	-61.8	-18.3	167.5	-66.7	165.2	0	0	0	111.8	K86 S88	K86-I90 WeakPolarHBondContact O-CG1 3.37Å; K86-I90 PolarHBondContact O-N 3.41Å; K86-I90 VanDerWaalsContact O-N 3.08Å; S88-I90 VanDerWaalsContact C-N 3.33Å
91	T	31.8	Very low	33.4	Very low	63 Å²	63	106.6 Å²	106.6	39%	0.387	56%	0.563	S	S	.	*	H	α-helix	trans	-119.6	0.9	-172.6	-45	0	0	0	0	114.5	S87 S88 I89 K580	S87-T91 WeakPolarHBondContact O-CB 3.16Å; S87-T91 PolarHBondContact O-N 3.34Å; S87-T91 PolarHBondContact O-OG1 2.96Å; S88-T91 CarbonylContact O-C 3.57Å; S88-T91 WeakPolarHBondContact O-CA 3.44Å; S88-T91 PolarHBondContact O-N 2.98Å; I89-T91 PolarHBondContact O-N 3.26Å; T91-K580 VanDerWaalsContact O-CE 3.26Å; T91-K580 WeakPolarHBondContact O-CE 3.49Å; T91-K580 PolarHBondContact O-NZ 3.38Å; T91-K580 VanDerWaalsContact O-NZ 3.11Å
92	S	31.9	Very low	32.9	Very low	49 Å²	49	108.6 Å²	108.6	34%	0.343	58%	0.577	S	S	.	*	H	α-helix	trans	-124.5	0.6	-170.6	62.5	0	0	0	0	115.2	S88 S94 T95	S88-S92 WeakPolarHBondContact O-CA 3.35Å; S88-S92 WeakPolarHBondContact O-CB 3.31Å; S88-S92 PolarHBondContact O-N 3.22Å; S88-S92 PolarHBondContact O-OG 3.45Å; S92-S94 PolarHBondContact O-N 2.93Å; S92-T95 PolarHBondContact O-N 3.07Å; S92-T95 PolarHBondContact O-OG1 3.32Å
93	T	30.1	Very low	32.5	Very low	67 Å²	67	110.3 Å²	110.3	41%	0.411	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.5	-1.7	163.1	41.8	0	0	0	0	113.8	Q576	T93-Q576 PolarHBondContact OG1-NE2 3.02Å
94	S	30.4	Very low	32.5	Very low	34 Å²	34	113.7 Å²	113.7	24%	0.238	61%	0.614	C	S	.	*	T	Hydrogen-bonded Turn	trans	-111.5	5.4	-179.5	-52.9	0	0	0	0	115.6	S92 N577 K580	S92-S94 PolarHBondContact O-N 2.93Å; S94-N577 WeakPolarHBondContact CA-OD1 3.46Å; S94-N577 WeakPolarHBondContact CB-OD1 3.02Å; S94-N577 PolarHBondContact OG-OD1 3.49Å; S94-K580 VanDerWaalsContact OG-CD 3.22Å; S94-K580 WeakPolarHBondContact OG-CD 3.1Å
95	T	30.3	Very low	32.6	Very low	108 Å²	108	116.3 Å²	116.3	66%	0.663	62%	0.623	S	S	*	*			trans	-119.4	25.9	-173.8	48.1	0	0	0	0	115.6	S92 V97	S92-T95 PolarHBondContact O-N 3.07Å; S92-T95 PolarHBondContact O-OG1 3.32Å; T95-V97 VanDerWaalsContact C-N 3.25Å; T95-V97 PolarHBondContact O-N 3.49Å
96	T	30.2	Very low	32.8	Very low	126 Å²	126	116.8 Å²	116.8	77%	0.773	63%	0.625	S	S	*	*			trans	-76.5	-0.7	178.7	-36.8	0	0	0	0	114.6
97	V	30.3	Very low	33.1	Very low	135 Å²	135	120.1 Å²	120.1	82%	0.818	64%	0.642	S	S	*	*			trans	-109	74.9	-171.5	-168.7	0	0	0	0	113.3	T95	T95-V97 VanDerWaalsContact C-N 3.25Å; T95-V97 PolarHBondContact O-N 3.49Å
98	R	32.8	Very low	33.6	Very low	247 Å²	247	125.2 Å²	125.2	93%	0.932	66%	0.659	S	S	*	*			trans	-170.9	110.3	139.5	-106.6	160.9	-173.2	166.5	4.3	112
99	R	31.7	Very low	34.1	Very low	241 Å²	241	129.5 Å²	129.5	91%	0.909	67%	0.667	S	S	*	*			trans	-94.8	169.2	166.4	-80.2	-176.4	171.6	132.5	-2.7	110.8
100	S	28.7	Very low	34.6	Very low	104 Å²	104	130.7 Å²	130.7	73%	0.727	67%	0.67	S	S	*	*			trans	85.2	149.7	159.1	78.3	0	0	0	0	118.3
101	L	30	Very low	35.2	Very low	160 Å²	160	131.7 Å²	131.7	84%	0.838	67%	0.672	S	S	*	*			trans	71.4	119.3	173.6	-56.3	158.7	0	0	0	114.7
102	S	34.1	Very low	35.7	Very low	104 Å²	104	136.2 Å²	136.2	73%	0.727	69%	0.689	S	S	*	*			cis	-149.7	147	-2.4	-66.7	0	0	0	0	111.4
103	S	31	Very low	36.2	Very low	118 Å²	118	144 Å²	144	83%	0.825	71%	0.711	S	S	*	*			trans	-99.4	89.8	-177.4	53.7	0	0	0	0	112.5
104	E	37.3	Very low	36.8	Very low	186 Å²	186	148.4 Å²	148.4	87%	0.869	73%	0.727	S	S	*	*			trans	-157.5	-13.1	174.1	-120.2	154.8	-155.9	0	0	117
105	Q	41.2	Very low	37.4	Very low	160 Å²	160	155.1 Å²	155.1	75%	0.748	75%	0.754	S	S	*	*	S	Bend	trans	-102.3	17.6	-172.2	-67.2	-171	-22.1	0	0	115.9	R109	Q105-R109 PolarHBondContact O-NE 2.7Å
106	E	42.1	Very low	37.7	Very low	110 Å²	110	157.5 Å²	157.5	51%	0.514	76%	0.758	S	S	.	*	S	Bend	trans	-95.7	-18	-168.9	-145	56.2	-151.1	0	0	115.1	R109	E106-R109 IonicContact OE1-NH2 2.86Å; E106-R109 IonicContact OE2-CZ 3.56Å; E106-R109 IonicContact OE2-NH2 3.73Å; E106-R109 PolarHBondContact OE2-NH2 2.91Å
107	Q	42.5	Very low	37.9	Very low	165 Å²	165	153.9 Å²	153.9	77%	0.771	75%	0.745	S	S	*	*	S	Bend	trans	-85.6	-38.9	-173	-69.4	-175.4	-15.6	0	0	113.8	R109 Q110	Q107-R109 PolarHBondContact O-N 2.69Å; Q107-Q110 PolarHBondContact O-N 2.68Å
108	E	41.4	Very low	38	Very low	168 Å²	168	158.3 Å²	158.3	79%	0.785	75%	0.747	S	S	*	*	H	α-helix	trans	-68.6	-35.5	-179	-62.5	-170.1	135.4	0	0	112.6	Q110 Q111	E108-Q110 PolarHBondContact O-N 3.07Å; E108-Q111 PolarHBondContact O-N 3.08Å
109	R	42.5	Very low	38	Very low	145 Å²	145	155.2 Å²	155.2	55%	0.547	74%	0.743	S	S	.	*	H	α-helix	trans	-66.3	-17.1	179.5	-64.8	-168.2	-70.2	-179.2	2.8	113.6	Q105 E106 Q107 R113	Q105-R109 PolarHBondContact O-NE 2.7Å; E106-R109 IonicContact OE1-NH2 2.86Å; E106-R109 IonicContact OE2-CZ 3.56Å; E106-R109 IonicContact OE2-NH2 3.73Å; E106-R109 PolarHBondContact OE2-NH2 2.91Å; Q107-R109 PolarHBondContact O-N 2.69Å; R109-R113 WeakPolarHBondContact O-CG 3.19Å
110	Q	45.5	Very low	38.1	Very low	122 Å²	122	150.3 Å²	150.3	57%	0.57	73%	0.731	S	S	*	*	H	α-helix	trans	-81.1	-31.3	178.7	-66.9	-174.1	10	0	0	113.2	Q107 E108	Q107-Q110 PolarHBondContact O-N 2.68Å; E108-Q110 PolarHBondContact O-N 3.07Å
111	Q	44	Very low	38.2	Very low	153 Å²	153	153 Å²	153	72%	0.715	73%	0.732	S	S	*	*	H	α-helix	trans	-75.5	-38.4	-178.2	-64.8	-169.5	5.3	0	0	112.6	E108 R113 Q114	E108-Q111 PolarHBondContact O-N 3.08Å; Q111-R113 VanDerWaalsContact C-N 3.31Å; Q111-R113 PolarHBondContact O-N 3.25Å; Q111-Q114 PolarHBondContact O-N 3.34Å
112	Q	43	Very low	38.2	Very low	159 Å²	159	149.9 Å²	149.9	74%	0.743	72%	0.724	S	S	*	*	H	α-helix	trans	-66.6	-30	178.9	-66.6	-173.7	-0.5	0	0	113.2	Q114	Q112-Q114 VanDerWaalsContact C-N 3.25Å; Q112-Q114 PolarHBondContact O-N 3.21Å
113	R	41.3	Very low	38	Very low	213 Å²	213	153.8 Å²	153.8	80%	0.804	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-18.6	179.2	-68.8	-176	102.1	-172.5	5.6	114	R109 Q111	R109-R113 WeakPolarHBondContact O-CG 3.19Å; Q111-R113 VanDerWaalsContact C-N 3.31Å; Q111-R113 PolarHBondContact O-N 3.25Å
114	Q	43.8	Very low	38.2	Very low	159 Å²	159	151.9 Å²	151.9	74%	0.743	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-17.7	-176.5	-64.5	-171.2	6.5	0	0	114.3	Q111 Q112	Q111-Q114 PolarHBondContact O-N 3.34Å; Q112-Q114 VanDerWaalsContact C-N 3.25Å; Q112-Q114 PolarHBondContact O-N 3.21Å
115	Q	41.5	Very low	38	Very low	174 Å²	174	145.5 Å²	145.5	81%	0.813	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-23.7	-174.4	-62.4	-168.7	8.7	0	0	114.6
116	Q	37.6	Very low	37.4	Very low	159 Å²	159	144 Å²	144	74%	0.743	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-81.4	-13.7	177.7	-68.5	-175.7	-11	0	0	114	R118	Q116-R118 VanDerWaalsContact C-N 3.29Å; Q116-R118 PolarHBondContact O-N 2.87Å; Q116-R118 VanDerWaalsContact O-N 3.16Å
117	G	33.4	Very low	36.7	Very low	49 Å²	49	145.9 Å²	145.9	51%	0.505	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-72	-4.9	-169.7	0	0	0	0	0	117.4
118	R	33.4	Very low	36.2	Very low	228 Å²	228	142.7 Å²	142.7	86%	0.86	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-102.3	0.5	-170.1	-75.7	-167.7	176.7	-163.6	-0.2	116.8	Q116	Q116-R118 VanDerWaalsContact C-N 3.29Å; Q116-R118 PolarHBondContact O-N 2.87Å; Q116-R118 VanDerWaalsContact O-N 3.16Å
119	Q	33.1	Very low	35.8	Very low	182 Å²	182	138.9 Å²	138.9	85%	0.85	66%	0.655	S	S	*	*	S	Bend	trans	-124.9	2.9	-174.9	-68.9	-173	-6.5	0	0	115.9
120	Q	32.2	Very low	35.7	Very low	139 Å²	139	136.5 Å²	136.5	65%	0.65	65%	0.653	S	S	*	*	S	Bend	trans	-104.7	-2.3	-179.2	-65.6	-175.7	-2.8	0	0	114.7	S122 I124	Q120-S122 PolarHBondContact O-N 3.01Å; Q120-I124 WeakPolarHBondContact O-CD1 3.47Å
121	Q	30.8	Very low	35.8	Very low	159 Å²	159	135.5 Å²	135.5	74%	0.743	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-9.1	-165.4	-71.3	-178.2	-36.6	0	0	115.9
122	S	29.7	Very low	36	Very low	96 Å²	96	129.2 Å²	129.2	67%	0.671	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-16.6	-174.9	50.3	0	0	0	0	116.1	Q120	Q120-S122 PolarHBondContact O-N 3.01Å
123	F	31	Very low	36.8	Very low	185 Å²	185	123.1 Å²	123.1	81%	0.811	59%	0.592	S	S	*	*	S	Bend	trans	-105.8	-5.2	-173.7	-86.1	-91.2	0	0	0	115.2
124	I	34.9	Very low	37.8	Very low	79 Å²	79	115.2 Å²	115.2	41%	0.405	57%	0.567	S	S	.	*	S	Bend	trans	-79.4	-29.2	-170.9	-63.7	172.8	0	0	0	115.6	Q120 N126 K128	Q120-I124 WeakPolarHBondContact O-CD1 3.47Å; I124-N126 PolarHBondContact O-N 2.78Å; I124-K128 HydrophobicContact CG2-CD 4.37Å
125	P	33.3	Very low	38.8	Very low	51 Å²	51	109.8 Å²	109.8	33%	0.331	54%	0.543	S	S	.	.	H	α-helix	trans	-59.4	-48.3	-174.1	-28.4	36.4	0	0	0	115.5	M127 K128	P125-M127 VanDerWaalsContact C-N 3.29Å; P125-M127 PolarHBondContact O-N 3.33Å; P125-K128 PolarHBondContact O-N 3.01Å
126	N	27.9	Very low	39.9	Very low	128 Å²	128	102.6 Å²	102.6	68%	0.684	51%	0.51	S	S	*	.	H	α-helix	trans	-62.8	-32.1	-171.5	-73.5	1.8	0	0	0	113.5	I124 K128 N130	I124-N126 PolarHBondContact O-N 2.78Å; N126-K128 VanDerWaalsContact C-N 3.28Å; N126-K128 PolarHBondContact O-N 3.25Å; N126-N130 PolarHBondContact O-N 2.93Å; N126-N130 PolarHBondContact O-ND2 3.23Å; N126-N130 PolarHBondContact O-OD1 2.87Å
127	M	27.2	Very low	41.4	Very low	150 Å²	150	96.2 Å²	96.2	74%	0.739	48%	0.481	S	S	*	.	H	α-helix	trans	-65.6	-30.6	177	-72.9	-70.4	179.8	0	0	112.7	P125	P125-M127 VanDerWaalsContact C-N 3.29Å; P125-M127 PolarHBondContact O-N 3.33Å
128	K	32.5	Very low	43.1	Very low	98 Å²	98	97 Å²	97	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-79.4	-44.9	-174.6	-66.7	-178.5	174.4	-177.6	0	112.7	L73 I124 P125 N126 N130 H131 Q132	L73-K128 HydrophobicContact CD1-CG 4.46Å; I124-K128 HydrophobicContact CG2-CD 4.37Å; P125-K128 PolarHBondContact O-N 3.01Å; N126-K128 VanDerWaalsContact C-N 3.28Å; N126-K128 PolarHBondContact O-N 3.25Å; K128-N130 VanDerWaalsContact C-N 3.33Å; K128-N130 PolarHBondContact O-N 3.24Å; K128-H131 PolarHBondContact O-N 3.31Å; K128-Q132 PolarHBondContact O-N 2.98Å
129	H	34.2	Very low	44.8	Very low	88 Å²	88	86.8 Å²	86.8	41%	0.407	43%	0.434	S	S	.	.	H	α-helix	trans	-63.7	-41.4	178.6	-172.6	42.3	0	0	0	111.2	H131 Q132 L133	H129-H131 VanDerWaalsContact C-N 3.33Å; H129-H131 PolarHBondContact O-N 2.77Å; H129-Q132 PolarHBondContact O-N 3.49Å; H129-L133 WeakPolarHBondContact O-CG 3.05Å; H129-L133 PolarHBondContact O-N 2.82Å
130	N	39.6	Very low	46.8	Very low	95 Å²	95	78.3 Å²	78.3	51%	0.508	39%	0.394	S	S	.	.	H	α-helix	trans	-55.6	-44.1	175.3	-72.4	-2	0	0	0	112.5	N126 K128 L133 T134	N126-N130 PolarHBondContact O-N 2.93Å; N126-N130 PolarHBondContact O-ND2 3.23Å; N126-N130 PolarHBondContact O-OD1 2.87Å; K128-N130 VanDerWaalsContact C-N 3.33Å; K128-N130 PolarHBondContact O-N 3.24Å; N130-L133 PolarHBondContact O-N 3.47Å; N130-T134 PolarHBondContact O-N 3.46Å; N130-T134 PolarHBondContact O-OG1 3.34Å; N130-T134 VanDerWaalsContact O-OG1 3.09Å
131	H	47.4	Very low	48.8	Very low	102 Å²	102	73.7 Å²	73.7	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-68.5	-36.4	-178.4	-172.9	48.5	0	0	0	113.1	K128 H129 T134 I135	K128-H131 PolarHBondContact O-N 3.31Å; H129-H131 VanDerWaalsContact C-N 3.33Å; H129-H131 PolarHBondContact O-N 2.77Å; H131-T134 WeakPolarHBondContact O-CB 3.19Å; H131-T134 PolarHBondContact O-N 3.32Å; H131-I135 WeakPolarHBondContact O-CG1 3.5Å; H131-I135 PolarHBondContact O-N 3.5Å; H131-I135 VanDerWaalsContact O-N 3.09Å
132	Q	48.3	Very low	50.9	Low	20 Å²	20	66.4 Å²	66.4	9%	0.093	34%	0.341	C	S	.	.	H	α-helix	trans	-65.5	-46	173.2	-70.3	-178.4	-46.8	0	0	111.6	K128 H129 T134 I135 L136	K128-Q132 PolarHBondContact O-N 2.98Å; H129-Q132 PolarHBondContact O-N 3.49Å; Q132-T134 VanDerWaalsContact C-N 3.28Å; Q132-T134 PolarHBondContact O-N 3.5Å; Q132-I135 PolarHBondContact O-N 3.49Å; Q132-L136 WeakPolarHBondContact O-CG 3.16Å; Q132-L136 PolarHBondContact O-N 2.74Å
133	L	59.7	Low	53.4	Low	32 Å²	32	61.8 Å²	61.8	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-60.6	-37.4	175	-70.6	173.4	0	0	0	111.8	H129 N130 L136 N137 Y330	H129-L133 WeakPolarHBondContact O-CG 3.05Å; H129-L133 PolarHBondContact O-N 2.82Å; N130-L133 PolarHBondContact O-N 3.47Å; L133-L136 PolarHBondContact O-N 3.44Å; L133-N137 VanDerWaalsContact O-CB 3.24Å; L133-N137 WeakPolarHBondContact O-CB 3.08Å; L133-N137 PolarHBondContact O-N 3Å; L133-N137 PolarHBondContact O-ND2 3.4Å; L133-Y330 HydrophobicContact CD2-CE2 4.37Å
134	T	62.4	Low	55.9	Low	47 Å²	47	53.4 Å²	53.4	29%	0.288	27%	0.272	S	S	.	.	H	α-helix	trans	-58.1	-51.1	171.8	-68	0	0	0	0	111.4	N130 H131 Q132 L136 N137 E138	N130-T134 PolarHBondContact O-N 3.46Å; N130-T134 PolarHBondContact O-OG1 3.34Å; N130-T134 VanDerWaalsContact O-OG1 3.09Å; H131-T134 WeakPolarHBondContact O-CB 3.19Å; H131-T134 PolarHBondContact O-N 3.32Å; Q132-T134 VanDerWaalsContact C-N 3.28Å; Q132-T134 PolarHBondContact O-N 3.5Å; T134-L136 PolarHBondContact O-N 3.2Å; T134-N137 CarbonylContact O-C 3.6Å; T134-N137 PolarHBondContact O-N 3.28Å; T134-E138 HydrophobicContact CG2-CG 4.3Å; T134-E138 VanDerWaalsContact CG2-OE1 3.23Å; T134-E138 WeakPolarHBondContact CG2-OE1 3.38Å; T134-E138 WeakPolarHBondContact O-CB 3.44Å; T134-E138 VanDerWaalsContact O-CG 3.31Å; T134-E138 WeakPolarHBondContact O-CG 3.36Å; T134-E138 PolarHBondContact O-N 3.49Å
135	I	64.4	Low	58	Low	45 Å²	45	51.9 Å²	51.9	23%	0.231	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-42.1	-179.8	-65.9	167	0	0	0	111.5	H131 Q132 N137 E138 I139	H131-I135 WeakPolarHBondContact O-CG1 3.5Å; H131-I135 PolarHBondContact O-N 3.5Å; H131-I135 VanDerWaalsContact O-N 3.09Å; Q132-I135 PolarHBondContact O-N 3.49Å; I135-N137 VanDerWaalsContact C-N 3.34Å; I135-N137 PolarHBondContact O-N 2.94Å; I135-E138 PolarHBondContact O-N 3.15Å; I135-I139 HydrophobicContact CG2-CD1 3.86Å; I135-I139 WeakPolarHBondContact O-CG1 3.21Å; I135-I139 PolarHBondContact O-N 3.42Å
136	L	64.8	Low	60.4	Low	22 Å²	22	49.9 Å²	49.9	12%	0.115	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-40.2	174.9	-66.4	-173	0	0	0	112.6	Y56 Q132 L133 T134 T140 P325 S326	Y56-L136 HydrophobicContact CE1-CD1 3.93Å; Y56-L136 HydrophobicContact CE1-CD2 4.2Å; Y56-L136 HydrophobicContact CE2-CD2 4.09Å; Y56-L136 WeakPolarHBondContact OH-CD1 3.45Å; Q132-L136 WeakPolarHBondContact O-CG 3.16Å; Q132-L136 PolarHBondContact O-N 2.74Å; L133-L136 PolarHBondContact O-N 3.44Å; T134-L136 PolarHBondContact O-N 3.2Å; L136-T140 VanDerWaalsContact O-CB 3.26Å; L136-T140 WeakPolarHBondContact O-CB 3.48Å; L136-T140 PolarHBondContact O-N 2.9Å; L136-T140 PolarHBondContact O-OG1 3.49Å; L136-P325 HydrophobicContact CB-CG 4.36Å; L136-P325 HydrophobicContact CD2-CB 4.01Å; L136-P325 HydrophobicContact CD2-CG 3.77Å; L136-S326 WeakPolarHBondContact CB-OG 3.2Å; L136-S326 PolarHBondContact O-OG 3.09Å
137	N	69.3	Low	63.2	Low	26 Å²	26	43.9 Å²	43.9	14%	0.139	22%	0.219	C	C	.	.	H	α-helix	trans	-70.6	-35.1	178.1	-70.7	-11.5	0	0	0	111	L133 T134 I135 N141 S326 N359	L133-N137 VanDerWaalsContact O-CB 3.24Å; L133-N137 WeakPolarHBondContact O-CB 3.08Å; L133-N137 PolarHBondContact O-N 3Å; L133-N137 PolarHBondContact O-ND2 3.4Å; T134-N137 CarbonylContact O-C 3.6Å; T134-N137 PolarHBondContact O-N 3.28Å; I135-N137 VanDerWaalsContact C-N 3.34Å; I135-N137 PolarHBondContact O-N 2.94Å; N137-N141 WeakPolarHBondContact O-CB 3.33Å; N137-N141 PolarHBondContact O-N 3.18Å; N137-N141 PolarHBondContact O-ND2 2.96Å; N137-N141 VanDerWaalsContact O-ND2 3.1Å; N137-S326 VanDerWaalsContact OD1-CB 3.27Å; N137-S326 WeakPolarHBondContact OD1-CB 3.25Å; N137-S326 PolarHBondContact OD1-OG 3.02Å; N137-N359 PolarHBondContact ND2-OD1 3.46Å
138	E	69	Low	65.9	Low	65 Å²	65	37.3 Å²	37.3	30%	0.304	19%	0.187	S	C	.	.	H	α-helix	trans	-66.2	-44.3	173.2	-75.7	168.6	174.2	0	0	111.9	Q17 T134 I135 S142	Q17-E138 PolarHBondContact NE2-OE2 3.35Å; T134-E138 HydrophobicContact CG2-CG 4.3Å; T134-E138 VanDerWaalsContact CG2-OE1 3.23Å; T134-E138 WeakPolarHBondContact CG2-OE1 3.38Å; T134-E138 WeakPolarHBondContact O-CB 3.44Å; T134-E138 VanDerWaalsContact O-CG 3.31Å; T134-E138 WeakPolarHBondContact O-CG 3.36Å; T134-E138 PolarHBondContact O-N 3.49Å; I135-E138 PolarHBondContact O-N 3.15Å; E138-S142 WeakPolarHBondContact O-CB 3.5Å; E138-S142 PolarHBondContact O-N 3.44Å; E138-S142 PolarHBondContact O-OG 3.17Å
139	I	68.8	Low	68.5	Low	13 Å²	13	32.8 Å²	32.8	7%	0.067	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-53.8	171.7	-68.9	161.7	0	0	0	110.1	H21 I135 N141 S142 T143	H21-I139 HydrophobicContact CB-CD1 4.19Å; H21-I139 HydrophobicContact CB-CG1 4.16Å; I135-I139 HydrophobicContact CG2-CD1 3.86Å; I135-I139 WeakPolarHBondContact O-CG1 3.21Å; I135-I139 PolarHBondContact O-N 3.42Å; I139-N141 PolarHBondContact O-N 3.02Å; I139-S142 WeakPolarHBondContact O-CA 3.43Å; I139-S142 WeakPolarHBondContact O-CB 3.35Å; I139-S142 PolarHBondContact O-N 2.77Å; I139-T143 PolarHBondContact O-N 2.91Å; I139-T143 PolarHBondContact O-OG1 3.46Å
140	T	75.3	Confident	71.1	Confident	4 Å²	4	28.6 Å²	28.6	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-44.6	-177.2	-55.1	0	0	0	0	111.4	L136 S142 T143 L144 F324 P325 S326 L327	L136-T140 VanDerWaalsContact O-CB 3.26Å; L136-T140 WeakPolarHBondContact O-CB 3.48Å; L136-T140 PolarHBondContact O-N 2.9Å; L136-T140 PolarHBondContact O-OG1 3.49Å; T140-S142 VanDerWaalsContact C-N 3.28Å; T140-S142 PolarHBondContact O-N 3.47Å; T140-T143 PolarHBondContact O-N 3.22Å; T140-L144 HydrophobicContact CG2-CD1 4.07Å; T140-L144 HydrophobicContact CG2-CG 4.43Å; T140-L144 WeakPolarHBondContact O-CB 3.35Å; T140-L144 VanDerWaalsContact O-CG 3.22Å; T140-L144 WeakPolarHBondContact O-CG 3.5Å; T140-L144 PolarHBondContact O-N 3.3Å; T140-F324 HydrophobicContact CG2-CB 4.46Å; T140-P325 WeakPolarHBondContact OG1-CD 3.49Å; T140-S326 WeakPolarHBondContact OG1-CB 3.46Å; T140-S326 PolarHBondContact OG1-N 2.98Å; T140-S326 PolarHBondContact OG1-OG 3.41Å; T140-L327 HydrophobicContact CG2-CD2 4.5Å; T140-L327 HydrophobicContact CG2-CG 4.13Å
141	N	74.5	Confident	73.6	Confident	42 Å²	42	24.1 Å²	24.1	23%	0.225	12%	0.124	C	C	.	.	H	α-helix	trans	-61	-37.3	174.4	-72.5	-21.8	0	0	0	111.7	N137 I139 L144 N145	N137-N141 WeakPolarHBondContact O-CB 3.33Å; N137-N141 PolarHBondContact O-N 3.18Å; N137-N141 PolarHBondContact O-ND2 2.96Å; N137-N141 VanDerWaalsContact O-ND2 3.1Å; I139-N141 PolarHBondContact O-N 3.02Å; N141-L144 PolarHBondContact O-N 3.4Å; N141-N145 PolarHBondContact O-N 3.44Å; N141-N145 PolarHBondContact O-ND2 2.8Å; N141-N145 PolarHBondContact O-OD1 3.32Å
142	S	75.8	Confident	75.5	Confident	6 Å²	6	21.2 Å²	21.2	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-65.4	-48.2	175.3	-57.3	0	0	0	0	111.3	N15 E138 I139 T140 L144 N145 Y146	N15-S142 PolarHBondContact ND2-OG 3.17Å; E138-S142 WeakPolarHBondContact O-CB 3.5Å; E138-S142 PolarHBondContact O-N 3.44Å; E138-S142 PolarHBondContact O-OG 3.17Å; I139-S142 WeakPolarHBondContact O-CA 3.43Å; I139-S142 WeakPolarHBondContact O-CB 3.35Å; I139-S142 PolarHBondContact O-N 2.77Å; T140-S142 VanDerWaalsContact C-N 3.28Å; T140-S142 PolarHBondContact O-N 3.47Å; S142-L144 VanDerWaalsContact C-N 3.27Å; S142-L144 PolarHBondContact O-N 2.86Å; S142-N145 WeakPolarHBondContact O-CA 3.26Å; S142-N145 WeakPolarHBondContact O-CB 3.49Å; S142-N145 PolarHBondContact O-N 2.91Å; S142-Y146 WeakPolarHBondContact O-CD2 3.3Å; S142-Y146 PolarHBondContact O-N 2.75Å; S142-Y146 VanDerWaalsContact O-N 3.11Å
143	T	81	Confident	77.6	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.2	-39.8	174.7	-46.4	0	0	0	0	111.9	F18 I139 T140 N145 Y146 L147 F180 F323 F324	F18-T143 HydrophobicContact CE2-CG2 4.43Å; F18-T143 WeakPolarHBondContact CE2-OG1 3.22Å; I139-T143 PolarHBondContact O-N 2.91Å; I139-T143 PolarHBondContact O-OG1 3.46Å; T140-T143 PolarHBondContact O-N 3.22Å; T143-N145 VanDerWaalsContact C-N 3.32Å; T143-N145 PolarHBondContact O-N 2.93Å; T143-Y146 WeakPolarHBondContact O-CB 3.49Å; T143-Y146 PolarHBondContact O-N 3.23Å; T143-L147 PolarHBondContact O-N 3.43Å; T143-F180 HydrophobicContact CG2-CE2 3.84Å; T143-F180 HydrophobicContact CG2-CZ 3.69Å; T143-F323 VanDerWaalsContact CB-O 3.29Å; T143-F323 WeakPolarHBondContact CB-O 3.36Å; T143-F323 HydrophobicContact CG2-CB 3.77Å; T143-F323 PolarHBondContact OG1-O 2.96Å; T143-F324 HydrophobicContact CG2-CD1 3.86Å; T143-F324 HydrophobicContact CG2-CD2 3.93Å; T143-F324 HydrophobicContact CG2-CE1 3.45Å; T143-F324 VanDerWaalsContact CG2-CE1 3.45Å; T143-F324 HydrophobicContact CG2-CE2 3.53Å; T143-F324 HydrophobicContact CG2-CG 4.1Å; T143-F324 HydrophobicContact CG2-CZ 3.29Å
144	L	82.9	Confident	79.2	Confident	8 Å²	8	18.7 Å²	18.7	4%	0.042	10%	0.098	C	C	.	.	H	α-helix	trans	-65.1	-33	174.2	-69.6	169.8	0	0	0	112.5	T140 N141 S142 L147 L148 F324 L338 L342	T140-L144 HydrophobicContact CG2-CD1 4.07Å; T140-L144 HydrophobicContact CG2-CG 4.43Å; T140-L144 WeakPolarHBondContact O-CB 3.35Å; T140-L144 VanDerWaalsContact O-CG 3.22Å; T140-L144 WeakPolarHBondContact O-CG 3.5Å; T140-L144 PolarHBondContact O-N 3.3Å; N141-L144 PolarHBondContact O-N 3.4Å; S142-L144 VanDerWaalsContact C-N 3.27Å; S142-L144 PolarHBondContact O-N 2.86Å; L144-L147 HydrophobicContact CD2-CD2 4.42Å; L144-L147 PolarHBondContact O-N 3.15Å; L144-L148 WeakPolarHBondContact O-CB 3.31Å; L144-L148 WeakPolarHBondContact O-CG 3.44Å; L144-L148 PolarHBondContact O-N 3.47Å; L144-F324 HydrophobicContact CD2-CD1 4.13Å; L144-F324 HydrophobicContact CD2-CE1 3.91Å; L144-F324 HydrophobicContact CG-CD1 4.41Å; L144-F324 HydrophobicContact CG-CE1 4.39Å; L144-L338 HydrophobicContact CD2-CD2 3.51Å; L144-L338 HydrophobicContact CD2-CG 4.4Å; L144-L342 HydrophobicContact CD2-CD1 4.34Å
145	N	80.1	Confident	80.6	Confident	47 Å²	47	19 Å²	19	25%	0.251	10%	0.095	S	C	.	.	H	α-helix	trans	-67	-36.2	171.6	-65.4	-24.1	0	0	0	112	N141 S142 T143 L148 V149	N141-N145 PolarHBondContact O-N 3.44Å; N141-N145 PolarHBondContact O-ND2 2.8Å; N141-N145 PolarHBondContact O-OD1 3.32Å; S142-N145 WeakPolarHBondContact O-CA 3.26Å; S142-N145 WeakPolarHBondContact O-CB 3.49Å; S142-N145 PolarHBondContact O-N 2.91Å; T143-N145 VanDerWaalsContact C-N 3.32Å; T143-N145 PolarHBondContact O-N 2.93Å; N145-L148 PolarHBondContact O-N 3.34Å; N145-V149 WeakPolarHBondContact O-CB 3.48Å; N145-V149 VanDerWaalsContact O-CG2 3.29Å; N145-V149 WeakPolarHBondContact O-CG2 3.47Å; N145-V149 PolarHBondContact O-N 3.04Å
146	Y	83.3	Confident	81.9	Confident	9 Å²	9	20.5 Å²	20.5	4%	0.035	10%	0.103	C	C	.	.	H	α-helix	trans	-65.2	-38.7	170.6	-74	-86.5	0	0	0	112.1	L13 F18 S142 T143 V149 I150 F180 I187	L13-Y146 HydrophobicContact CD1-CD1 4.09Å; L13-Y146 HydrophobicContact CD1-CE1 4.05Å; L13-Y146 HydrophobicContact CD2-CD1 4.01Å; L13-Y146 HydrophobicContact CD2-CE1 3.58Å; L13-Y146 HydrophobicContact CG-CD1 4.01Å; L13-Y146 HydrophobicContact CG-CE1 3.47Å; L13-Y146 VanDerWaalsContact CG-CE1 3.47Å; F18-Y146 HydrophobicContact CB-CE2 4.48Å; F18-Y146 HydrophobicContact CD1-CD2 4.16Å; F18-Y146 AromaticContact CD1-CE2 3.28Å; F18-Y146 HydrophobicContact CD1-CE2 3.28Å; F18-Y146 AromaticContact CD1-CZ 3.67Å; F18-Y146 HydrophobicContact CD2-CD2 4.34Å; F18-Y146 HydrophobicContact CD2-CE2 4.06Å; F18-Y146 AromaticContact CE1-CD2 3.77Å; F18-Y146 HydrophobicContact CE1-CD2 3.77Å; F18-Y146 HydrophobicContact CE1-CE1 4.32Å; F18-Y146 AromaticContact CE1-CE2 3.24Å; F18-Y146 HydrophobicContact CE1-CE2 3.24Å; F18-Y146 AromaticContact CE1-CZ 3.56Å; F18-Y146 AromaticContact CE2-CD2 3.98Å; F18-Y146 HydrophobicContact CE2-CD2 3.98Å; F18-Y146 HydrophobicContact CE2-CE2 4.04Å; F18-Y146 HydrophobicContact CG-CD2 4.41Å; F18-Y146 AromaticContact CG-CE2 3.69Å; F18-Y146 HydrophobicContact CG-CE2 3.69Å; F18-Y146 AromaticContact CZ-CD2 3.66Å; F18-Y146 HydrophobicContact CZ-CD2 3.66Å; F18-Y146 AromaticContact CZ-CE2 3.63Å; F18-Y146 HydrophobicContact CZ-CE2 3.63Å; F18-Y146 HydrophobicContact CZ-CG 4.4Å; S142-Y146 WeakPolarHBondContact O-CD2 3.3Å; S142-Y146 PolarHBondContact O-N 2.75Å; S142-Y146 VanDerWaalsContact O-N 3.11Å; T143-Y146 WeakPolarHBondContact O-CB 3.49Å; T143-Y146 PolarHBondContact O-N 3.23Å; Y146-V149 PolarHBondContact O-N 3.25Å; Y146-I150 WeakPolarHBondContact O-CG1 3.19Å; Y146-I150 PolarHBondContact O-N 2.94Å; Y146-F180 HydrophobicContact CG-CE2 4.4Å; Y146-I187 HydrophobicContact CE1-CD1 3.72Å; Y146-I187 HydrophobicContact CE1-CG2 4.32Å; Y146-I187 WeakPolarHBondContact OH-CD1 3.43Å
147	L	86.8	Confident	83.3	Confident	3 Å²	3	19.5 Å²	19.5	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-67.4	-39.4	176.2	-172.1	60.2	0	0	0	112.1	T143 L144 I150 I151 W176 F324 L335 I339 L342	T143-L147 PolarHBondContact O-N 3.43Å; L144-L147 HydrophobicContact CD2-CD2 4.42Å; L144-L147 PolarHBondContact O-N 3.15Å; L147-I150 WeakPolarHBondContact O-CB 3.26Å; L147-I150 PolarHBondContact O-N 3.04Å; L147-I151 HydrophobicContact CG-CD1 4.36Å; L147-I151 WeakPolarHBondContact O-CG1 3.44Å; L147-I151 PolarHBondContact O-N 2.84Å; L147-W176 HydrophobicContact CD1-CB 4.02Å; L147-W176 HydrophobicContact CD1-CE3 4.5Å; L147-W176 HydrophobicContact CD1-CG 4.48Å; L147-F324 HydrophobicContact CD2-CE1 4.28Å; L147-F324 HydrophobicContact CD2-CZ 4.4Å; L147-L335 HydrophobicContact CD2-CD2 4.24Å; L147-I339 HydrophobicContact CD1-CD1 4.23Å; L147-I339 HydrophobicContact CD1-CG1 4.15Å; L147-I339 HydrophobicContact CD2-CG1 3.96Å; L147-I339 HydrophobicContact CG-CG1 4.36Å; L147-L342 HydrophobicContact CD2-CD1 3.85Å; L147-L342 HydrophobicContact CG-CD1 4.19Å
148	L	85	Confident	84.5	Confident	12 Å²	12	21.1 Å²	21.1	6%	0.063	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-42.3	169.9	-79.6	165.3	0	0	0	111.6	L144 N145 I150 I151 E152 L342 E346 L354 F356	L144-L148 WeakPolarHBondContact O-CB 3.31Å; L144-L148 WeakPolarHBondContact O-CG 3.44Å; L144-L148 PolarHBondContact O-N 3.47Å; N145-L148 PolarHBondContact O-N 3.34Å; L148-I150 VanDerWaalsContact C-N 3.32Å; L148-I150 PolarHBondContact O-N 2.92Å; L148-I151 CarbonylContact O-C 3.6Å; L148-I151 WeakPolarHBondContact O-CA 3.37Å; L148-I151 PolarHBondContact O-N 2.89Å; L148-E152 PolarHBondContact O-N 3.16Å; L148-L342 HydrophobicContact CD1-CD2 4.38Å; L148-L342 HydrophobicContact CD2-CB 4.1Å; L148-L342 HydrophobicContact CD2-CD2 3.84Å; L148-L342 HydrophobicContact CD2-CG 4.4Å; L148-L342 HydrophobicContact CG-CD2 4.09Å; L148-E346 WeakPolarHBondContact CD2-OE1 3.26Å; L148-L354 HydrophobicContact CD1-CD1 3.99Å; L148-L354 HydrophobicContact CD1-CD2 3.78Å; L148-F356 HydrophobicContact CD1-CE2 4.34Å
149	V	85.6	Confident	85.7	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-65	-33.5	176.8	162.8	0	0	0	0	112.4	S9 Y12 L13 N145 Y146 W153 Y183	S9-V149 WeakPolarHBondContact O-CG2 3.31Å; Y12-V149 HydrophobicContact CD2-CG2 4.16Å; L13-V149 HydrophobicContact CD1-CB 3.99Å; L13-V149 HydrophobicContact CD1-CG1 3.79Å; L13-V149 HydrophobicContact CD1-CG2 3.64Å; N145-V149 WeakPolarHBondContact O-CB 3.48Å; N145-V149 VanDerWaalsContact O-CG2 3.29Å; N145-V149 WeakPolarHBondContact O-CG2 3.47Å; N145-V149 PolarHBondContact O-N 3.04Å; Y146-V149 PolarHBondContact O-N 3.25Å; V149-W153 WeakPolarHBondContact O-CB 3.44Å; V149-W153 PolarHBondContact O-N 3.14Å; V149-Y183 HydrophobicContact CG1-CE1 3.84Å
150	I	90.2	Very high	86.9	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-63.5	-43.3	169	-71.1	162.2	0	0	0	111	Y146 L147 L148 W153 A154 L172 L179 F180 Y183	Y146-I150 WeakPolarHBondContact O-CG1 3.19Å; Y146-I150 PolarHBondContact O-N 2.94Å; L147-I150 WeakPolarHBondContact O-CB 3.26Å; L147-I150 PolarHBondContact O-N 3.04Å; L148-I150 VanDerWaalsContact C-N 3.32Å; L148-I150 PolarHBondContact O-N 2.92Å; I150-W153 PolarHBondContact O-N 2.92Å; I150-A154 PolarHBondContact O-N 3.34Å; I150-L172 HydrophobicContact CG2-CD2 4.29Å; I150-L179 HydrophobicContact CD1-CB 4.07Å; I150-L179 HydrophobicContact CG1-CB 4.33Å; I150-L179 HydrophobicContact CG2-CB 4.29Å; I150-L179 HydrophobicContact CG2-CD1 3.7Å; I150-F180 HydrophobicContact CD1-CB 4.16Å; I150-Y183 HydrophobicContact CD1-CD2 4.07Å; I150-Y183 HydrophobicContact CD1-CE2 4.41Å; I150-Y183 HydrophobicContact CG1-CD2 3.6Å; I150-Y183 HydrophobicContact CG1-CE2 3.46Å; I150-Y183 VanDerWaalsContact CG1-CE2 3.46Å
151	I	90.4	Very high	87.8	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-69.1	-49.4	-178.8	-72.3	167.2	0	0	0	111.6	L147 L148 W153 A154 K155 L172 I339 L342 F343	L147-I151 HydrophobicContact CG-CD1 4.36Å; L147-I151 WeakPolarHBondContact O-CG1 3.44Å; L147-I151 PolarHBondContact O-N 2.84Å; L148-I151 CarbonylContact O-C 3.6Å; L148-I151 WeakPolarHBondContact O-CA 3.37Å; L148-I151 PolarHBondContact O-N 2.89Å; I151-W153 VanDerWaalsContact C-N 3.31Å; I151-W153 PolarHBondContact O-N 3.44Å; I151-A154 PolarHBondContact O-N 3.4Å; I151-K155 HydrophobicContact CG2-CD 3.59Å; I151-K155 WeakPolarHBondContact O-CB 3.29Å; I151-K155 WeakPolarHBondContact O-CD 3.35Å; I151-K155 VanDerWaalsContact O-CG 3.27Å; I151-K155 WeakPolarHBondContact O-CG 3.44Å; I151-K155 PolarHBondContact O-N 3.43Å; I151-L172 HydrophobicContact CG1-CD1 4.4Å; I151-I339 HydrophobicContact CD1-CG2 4.41Å; I151-L342 HydrophobicContact CD1-CB 3.72Å; I151-L342 HydrophobicContact CD1-CD1 4.25Å; I151-F343 HydrophobicContact CG2-CD2 4.05Å
152	E	88.6	Confident	88.7	Confident	40 Å²	40	25.1 Å²	25.1	19%	0.187	14%	0.137	C	C	.	.	H	α-helix	trans	-57.7	-43.4	172.6	-80.3	-163.3	147.4	0	0	110.9	Y12 L148 K155 N156	Y12-E152 VanDerWaalsContact CE2-OE2 3.26Å; Y12-E152 WeakPolarHBondContact CE2-OE2 3.41Å; L148-E152 PolarHBondContact O-N 3.16Å; E152-K155 PolarHBondContact O-N 2.81Å; E152-N156 WeakPolarHBondContact O-CB 3.42Å; E152-N156 PolarHBondContact O-N 3.05Å; E152-N156 PolarHBondContact O-ND2 3.25Å
153	W	92.1	Very high	89.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.4	-50.5	177.5	172.6	80.6	0	0	0	111.6	V149 I150 I151 K155 N156 I157 L179 K251 A252 L255	V149-W153 WeakPolarHBondContact O-CB 3.44Å; V149-W153 PolarHBondContact O-N 3.14Å; I150-W153 PolarHBondContact O-N 2.92Å; I151-W153 VanDerWaalsContact C-N 3.31Å; I151-W153 PolarHBondContact O-N 3.44Å; W153-K155 PolarHBondContact O-N 3.39Å; W153-N156 PolarHBondContact O-N 3.08Å; W153-I157 HydrophobicContact CD2-CD1 4.19Å; W153-I157 HydrophobicContact CE3-CD1 4.34Å; W153-I157 HydrophobicContact CH2-CD1 3.81Å; W153-I157 HydrophobicContact CZ2-CD1 3.68Å; W153-I157 HydrophobicContact CZ3-CD1 4.18Å; W153-L179 HydrophobicContact CZ3-CD1 4.49Å; W153-L179 HydrophobicContact CZ3-CD2 4.39Å; W153-K251 HydrophobicContact CH2-CB 3.44Å; W153-K251 VanDerWaalsContact CH2-CB 3.44Å; W153-K251 HydrophobicContact CZ2-CB 3.59Å; W153-K251 HydrophobicContact CZ2-CD 4.27Å; W153-K251 HydrophobicContact CZ3-CB 4.12Å; W153-A252 HydrophobicContact CH2-CB 4.33Å; W153-L255 HydrophobicContact CE3-CD2 4.49Å; W153-L255 HydrophobicContact CH2-CB 4.41Å; W153-L255 HydrophobicContact CH2-CD2 4.18Å; W153-L255 HydrophobicContact CZ3-CB 4.17Å; W153-L255 HydrophobicContact CZ3-CD2 3.7Å; W153-L255 HydrophobicContact CZ3-CG 4.46Å
154	A	93.6	Very high	90.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-44.8	177.5	0	0	0	0	0	111.9	I150 I151 N156 I157 F160 L172 L255	I150-A154 PolarHBondContact O-N 3.34Å; I151-A154 PolarHBondContact O-N 3.4Å; A154-N156 PolarHBondContact O-N 3.11Å; A154-I157 WeakPolarHBondContact O-CB 3.22Å; A154-I157 PolarHBondContact O-N 3.21Å; A154-F160 HydrophobicContact CB-CD1 4.1Å; A154-F160 HydrophobicContact CB-CD2 4.47Å; A154-F160 HydrophobicContact CB-CE1 3.97Å; A154-F160 HydrophobicContact CB-CE2 4.34Å; A154-F160 HydrophobicContact CB-CG 4.34Å; A154-F160 HydrophobicContact CB-CZ 4.08Å; A154-F160 WeakPolarHBondContact O-CB 3.49Å; A154-F160 VanDerWaalsContact O-CD1 3.27Å; A154-F160 WeakPolarHBondContact O-CD1 3.21Å; A154-L172 HydrophobicContact CB-CD2 3.98Å; A154-L255 HydrophobicContact CB-CD1 4.45Å; A154-L255 HydrophobicContact CB-CD2 3.88Å
155	K	91.6	Very high	90.6	Very high	54 Å²	54	33.4 Å²	33.4	24%	0.235	18%	0.182	C	C	.	.	H	α-helix	trans	-67.4	-16.4	179.1	-68.8	164.7	72	173.2	0	113.8	I151 E152 W153 F160 T161 F343 E346	I151-K155 HydrophobicContact CG2-CD 3.59Å; I151-K155 WeakPolarHBondContact O-CB 3.29Å; I151-K155 WeakPolarHBondContact O-CD 3.35Å; I151-K155 VanDerWaalsContact O-CG 3.27Å; I151-K155 WeakPolarHBondContact O-CG 3.44Å; I151-K155 PolarHBondContact O-N 3.43Å; E152-K155 PolarHBondContact O-N 2.81Å; W153-K155 PolarHBondContact O-N 3.39Å; K155-F160 HydrophobicContact CG-CE1 4.46Å; K155-T161 WeakPolarHBondContact O-CG2 3.37Å; K155-F343 HydrophobicContact CD-CD2 3.86Å; K155-F343 HydrophobicContact CD-CE2 3.74Å; K155-F343 HydrophobicContact CD-CZ 4.49Å; K155-F343 HydrophobicContact CG-CD2 4.33Å; K155-F343 HydrophobicContact CG-CE2 3.74Å; K155-F343 HydrophobicContact CG-CZ 4.42Å; K155-F343 PolarHBondContact NZ-O 2.97Å; K155-E346 WeakPolarHBondContact CE-OE2 3.14Å; K155-E346 IonicContact NZ-OE2 2.61Å; K155-E346 PolarHBondContact NZ-OE2 3.38Å
156	N	91.5	Very high	91.2	Very high	76 Å²	76	32.7 Å²	32.7	41%	0.406	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	1.4	171.4	-78.5	-70.9	0	0	0	113.8	A5 E152 W153 A154	A5-N156 HydrophobicContact CB-CB 3.68Å; E152-N156 WeakPolarHBondContact O-CB 3.42Å; E152-N156 PolarHBondContact O-N 3.05Å; E152-N156 PolarHBondContact O-ND2 3.25Å; W153-N156 PolarHBondContact O-N 3.08Å; A154-N156 PolarHBondContact O-N 3.11Å
157	I	94.5	Very high	91.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.18	C	C	.	.			trans	-96.6	116.2	173.9	-61.7	169.3	0	0	0	109.1	M1 L2 A5 W153 A154 L159 F160 T161 L255 F256	M1-I157 HydrophobicContact CE-CG2 3.73Å; M1-I157 HydrophobicContact SD-CG2 3.99Å; L2-I157 HydrophobicContact CD2-CD1 3.68Å; L2-I157 HydrophobicContact CD2-CG1 4.04Å; L2-I157 HydrophobicContact CD2-CG2 4.3Å; A5-I157 HydrophobicContact CB-CG1 3.88Å; W153-I157 HydrophobicContact CD2-CD1 4.19Å; W153-I157 HydrophobicContact CE3-CD1 4.34Å; W153-I157 HydrophobicContact CH2-CD1 3.81Å; W153-I157 HydrophobicContact CZ2-CD1 3.68Å; W153-I157 HydrophobicContact CZ3-CD1 4.18Å; A154-I157 WeakPolarHBondContact O-CB 3.22Å; A154-I157 PolarHBondContact O-N 3.21Å; I157-L159 VanDerWaalsContact C-N 3.33Å; I157-L159 HydrophobicContact CG2-CB 4.21Å; I157-L159 PolarHBondContact O-N 2.94Å; I157-F160 HydrophobicContact CB-CB 4.02Å; I157-F160 HydrophobicContact CG2-CB 4.19Å; I157-F160 WeakPolarHBondContact O-CB 3.19Å; I157-F160 PolarHBondContact O-N 3.17Å; I157-T161 PolarHBondContact O-N 3.32Å; I157-T161 VanDerWaalsContact O-N 3.12Å; I157-L255 HydrophobicContact CD1-CD2 4.28Å; I157-F256 HydrophobicContact CG2-CE2 4.31Å; I157-F256 HydrophobicContact CG2-CZ 4.08Å
158	S	93.2	Very high	92.2	Very high	60 Å²	60	33.1 Å²	33.1	42%	0.42	18%	0.183	S	C	.	.	H	α-helix	trans	-59.6	-42.6	-178.2	65.8	0	0	0	0	112.5	F160 T161 D162	S158-F160 PolarHBondContact O-N 2.96Å; S158-T161 WeakPolarHBondContact CA-OG1 3.23Å; S158-T161 PolarHBondContact O-N 3.44Å; S158-T161 VanDerWaalsContact O-N 3.07Å; S158-T161 PolarHBondContact O-OG1 2.84Å; S158-D162 WeakPolarHBondContact O-CB 3.35Å; S158-D162 PolarHBondContact O-N 3.48Å; S158-D162 VanDerWaalsContact O-OD2 3.11Å
159	L	94.2	Very high	92.6	Very high	28 Å²	28	34 Å²	34	15%	0.147	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-16.1	176.3	-59.4	-175.8	0	0	0	114.1	M1 I157 F256 I272	M1-L159 HydrophobicContact CE-CD1 3.79Å; M1-L159 HydrophobicContact CE-CG 4Å; M1-L159 HydrophobicContact SD-CD1 4.3Å; M1-L159 HydrophobicContact SD-CG 3.93Å; I157-L159 VanDerWaalsContact C-N 3.33Å; I157-L159 HydrophobicContact CG2-CB 4.21Å; I157-L159 PolarHBondContact O-N 2.94Å; L159-F256 HydrophobicContact CB-CZ 4.2Å; L159-I272 HydrophobicContact CB-CD1 4.22Å; L159-I272 HydrophobicContact CB-CG1 4.38Å; L159-I272 HydrophobicContact CB-CG2 4.28Å; L159-I272 HydrophobicContact CD1-CG1 4.39Å; L159-I272 HydrophobicContact CD1-CG2 3.99Å; L159-I272 WeakPolarHBondContact O-CD1 3.37Å
160	F	94.8	Very high	93	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-89.4	-44.4	172.4	179	-94.4	0	0	0	110.7	A154 K155 I157 S158 D162 L163 Q168 L171 L172 L255 F256 F343	A154-F160 HydrophobicContact CB-CD1 4.1Å; A154-F160 HydrophobicContact CB-CD2 4.47Å; A154-F160 HydrophobicContact CB-CE1 3.97Å; A154-F160 HydrophobicContact CB-CE2 4.34Å; A154-F160 HydrophobicContact CB-CG 4.34Å; A154-F160 HydrophobicContact CB-CZ 4.08Å; A154-F160 WeakPolarHBondContact O-CB 3.49Å; A154-F160 VanDerWaalsContact O-CD1 3.27Å; A154-F160 WeakPolarHBondContact O-CD1 3.21Å; K155-F160 HydrophobicContact CG-CE1 4.46Å; I157-F160 HydrophobicContact CB-CB 4.02Å; I157-F160 HydrophobicContact CG2-CB 4.19Å; I157-F160 WeakPolarHBondContact O-CB 3.19Å; I157-F160 PolarHBondContact O-N 3.17Å; S158-F160 PolarHBondContact O-N 2.96Å; F160-D162 PolarHBondContact O-N 3.23Å; F160-L163 HydrophobicContact CD2-CD1 4.45Å; F160-L163 WeakPolarHBondContact O-CB 3.46Å; F160-L163 PolarHBondContact O-N 3.45Å; F160-L163 VanDerWaalsContact O-N 3.11Å; F160-Q168 HydrophobicContact CD1-CG 4.21Å; F160-Q168 HydrophobicContact CE1-CB 3.75Å; F160-Q168 HydrophobicContact CE1-CG 3.86Å; F160-Q168 HydrophobicContact CE2-CB 4.04Å; F160-Q168 HydrophobicContact CE2-CG 4.27Å; F160-Q168 HydrophobicContact CZ-CB 3.45Å; F160-Q168 VanDerWaalsContact CZ-CB 3.45Å; F160-Q168 HydrophobicContact CZ-CG 3.91Å; F160-Q168 WeakPolarHBondContact CZ-O 3.31Å; F160-Q168 VanDerWaalsContact O-CD 3.25Å; F160-Q168 WeakPolarHBondContact O-CG 3.29Å; F160-Q168 PolarHBondContact O-NE2 3.02Å; F160-L171 HydrophobicContact CE2-CB 4.39Å; F160-L172 HydrophobicContact CE1-CD1 4.44Å; F160-L172 HydrophobicContact CE2-CG 4.33Å; F160-L172 HydrophobicContact CZ-CD1 3.76Å; F160-L172 HydrophobicContact CZ-CG 3.87Å; F160-L255 HydrophobicContact CD2-CD1 4.3Å; F160-L255 HydrophobicContact CD2-CD2 3.77Å; F160-L255 HydrophobicContact CD2-CG 4.17Å; F160-L255 HydrophobicContact CE2-CD1 3.93Å; F160-L255 HydrophobicContact CE2-CD2 4.21Å; F160-L255 HydrophobicContact CE2-CG 4.31Å; F160-L255 HydrophobicContact CG-CD2 4.39Å; F160-F256 HydrophobicContact CB-CE1 4.16Å; F160-F256 HydrophobicContact CB-CZ 3.83Å; F160-F256 HydrophobicContact CD2-CE1 4.32Å; F160-F343 AromaticContact CE1-CE2 3.96Å; F160-F343 HydrophobicContact CE1-CE2 3.96Å; F160-F343 HydrophobicContact CE1-CZ 4.33Å; F160-F343 HydrophobicContact CZ-CE2 4.28Å
161	T	93.3	Very high	93.3	Very high	67 Å²	67	35.8 Å²	35.8	41%	0.411	20%	0.197	S	C	.	.	H	α-helix	trans	-65	-24.4	176.5	56.2	0	0	0	0	113.6	K155 I157 S158 L163 Q168	K155-T161 WeakPolarHBondContact O-CG2 3.37Å; I157-T161 PolarHBondContact O-N 3.32Å; I157-T161 VanDerWaalsContact O-N 3.12Å; S158-T161 WeakPolarHBondContact CA-OG1 3.23Å; S158-T161 PolarHBondContact O-N 3.44Å; S158-T161 VanDerWaalsContact O-N 3.07Å; S158-T161 PolarHBondContact O-OG1 2.84Å; T161-L163 VanDerWaalsContact C-N 3.27Å; T161-L163 PolarHBondContact O-N 3Å; T161-Q168 PolarHBondContact O-NE2 3.4Å
162	D	93.5	Very high	93.5	Very high	114 Å²	114	35.8 Å²	35.8	61%	0.61	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.7	175.7	-64.1	-24.9	0	0	0	113	S158 F160	S158-D162 WeakPolarHBondContact O-CB 3.35Å; S158-D162 PolarHBondContact O-N 3.48Å; S158-D162 VanDerWaalsContact O-OD2 3.11Å; F160-D162 PolarHBondContact O-N 3.23Å
163	L	94.3	Very high	93.7	Very high	12 Å²	12	35.4 Å²	35.4	6%	0.063	20%	0.196	C	C	.	.	S	Bend	trans	-76.2	161.1	177.1	-60.2	179.6	0	0	0	112.1	F160 T161 Q168 L171 F256 L268 V269 I272	F160-L163 HydrophobicContact CD2-CD1 4.45Å; F160-L163 WeakPolarHBondContact O-CB 3.46Å; F160-L163 PolarHBondContact O-N 3.45Å; F160-L163 VanDerWaalsContact O-N 3.11Å; T161-L163 VanDerWaalsContact C-N 3.27Å; T161-L163 PolarHBondContact O-N 3Å; L163-Q168 HydrophobicContact CB-CG 3.94Å; L163-Q168 PolarHBondContact O-NE2 3.32Å; L163-L171 HydrophobicContact CD1-CD1 3.51Å; L163-F256 HydrophobicContact CD1-CD1 4.29Å; L163-F256 HydrophobicContact CD1-CE1 3.97Å; L163-L268 HydrophobicContact CD2-CD2 3.63Å; L163-L268 HydrophobicContact CD2-CG 3.85Å; L163-V269 HydrophobicContact CD1-CG2 4.29Å; L163-V269 HydrophobicContact CD2-CG2 4.32Å; L163-I272 HydrophobicContact CD2-CD1 3.93Å
164	H	94.2	Very high	93.6	Very high	98 Å²	98	38.7 Å²	38.7	45%	0.454	21%	0.214	S	C	.	.			trans	-62.1	136.7	172.4	-174.3	-68.3	0	0	0	110.8	S166 D167 Q168 K264	H164-S166 VanDerWaalsContact C-N 3.35Å; H164-S166 PolarHBondContact CE1-OG 3.48Å; H164-S166 VanDerWaalsContact CE1-OG 3.32Å; H164-S166 PolarHBondContact ND1-N 3.19Å; H164-S166 VanDerWaalsContact ND1-N 3.19Å; H164-S166 PolarHBondContact ND1-OG 3.01Å; H164-S166 PolarHBondContact O-N 2.77Å; H164-D167 HydrophobicContact CB-CB 4.45Å; H164-D167 IonicContact ND1-OD1 3.83Å; H164-D167 WeakPolarHBondContact O-CA 3.21Å; H164-D167 VanDerWaalsContact O-CB 3.29Å; H164-D167 WeakPolarHBondContact O-CB 3.33Å; H164-D167 PolarHBondContact O-N 3.46Å; H164-Q168 PolarHBondContact O-N 3.1Å; H164-Q168 VanDerWaalsContact O-N 3.09Å; H164-K264 PolarHBondContact CE1-NZ 3.16Å; H164-K264 PolarHBondContact ND1-NZ 3.19Å; H164-K264 PolarHBondContact NE2-NZ 2.93Å
165	P	92.1	Very high	93.6	Very high	77 Å²	77	38.9 Å²	38.9	50%	0.5	22%	0.215	S	C	.	.	H	α-helix	trans	-56	-35.2	-174.7	-31.3	36.7	0	0	0	116.8	D167 Q168 L169	P165-D167 PolarHBondContact O-N 2.84Å; P165-Q168 WeakPolarHBondContact O-CB 3.27Å; P165-Q168 PolarHBondContact O-N 2.99Å; P165-L169 PolarHBondContact O-N 3.42Å
166	S	93	Very high	93.7	Very high	33 Å²	33	36.8 Å²	36.8	23%	0.231	21%	0.205	C	C	.	.	H	α-helix	trans	-58.8	-36.6	170.3	50.9	0	0	0	0	113	H164 L169 I170 K264	H164-S166 VanDerWaalsContact C-N 3.35Å; H164-S166 PolarHBondContact CE1-OG 3.48Å; H164-S166 VanDerWaalsContact CE1-OG 3.32Å; H164-S166 PolarHBondContact ND1-N 3.19Å; H164-S166 VanDerWaalsContact ND1-N 3.19Å; H164-S166 PolarHBondContact ND1-OG 3.01Å; H164-S166 PolarHBondContact O-N 2.77Å; S166-L169 PolarHBondContact O-N 3.37Å; S166-I170 WeakPolarHBondContact O-CB 3.38Å; S166-I170 WeakPolarHBondContact O-CD1 3.46Å; S166-I170 WeakPolarHBondContact O-CG1 3.39Å; S166-I170 PolarHBondContact O-N 3.02Å; S166-K264 WeakPolarHBondContact OG-CE 3.1Å; S166-K264 PolarHBondContact OG-NZ 3.05Å
167	D	95.9	Very high	93.7	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-78.7	-36.6	-173.9	-60.6	39.8	0	0	0	108.8	H164 P165 L169 I170 L171 L263 K264 D265	H164-D167 HydrophobicContact CB-CB 4.45Å; H164-D167 IonicContact ND1-OD1 3.83Å; H164-D167 WeakPolarHBondContact O-CA 3.21Å; H164-D167 VanDerWaalsContact O-CB 3.29Å; H164-D167 WeakPolarHBondContact O-CB 3.33Å; H164-D167 PolarHBondContact O-N 3.46Å; P165-D167 PolarHBondContact O-N 2.84Å; D167-L169 VanDerWaalsContact C-N 3.33Å; D167-L169 PolarHBondContact O-N 3.42Å; D167-I170 PolarHBondContact O-N 3.11Å; D167-L171 WeakPolarHBondContact O-CB 3.44Å; D167-L171 VanDerWaalsContact O-CG 3.26Å; D167-L171 WeakPolarHBondContact O-CG 3.07Å; D167-L171 PolarHBondContact O-N 3.09Å; D167-L263 HydrophobicContact CB-CD2 3.77Å; D167-K264 WeakPolarHBondContact OD2-CA 3.34Å; D167-K264 WeakPolarHBondContact OD2-CB 3.47Å; D167-K264 PolarHBondContact OD2-N 3.19Å; D167-D265 PolarHBondContact OD2-N 3.14Å
168	Q	95.1	Very high	93.7	Very high	17 Å²	17	34 Å²	34	8%	0.079	19%	0.191	C	C	.	.	H	α-helix	trans	-54.1	-46.8	167.4	-64.9	-177.1	37.7	0	0	111.8	F160 T161 L163 H164 P165 L172 F343	F160-Q168 HydrophobicContact CD1-CG 4.21Å; F160-Q168 HydrophobicContact CE1-CB 3.75Å; F160-Q168 HydrophobicContact CE1-CG 3.86Å; F160-Q168 HydrophobicContact CE2-CB 4.04Å; F160-Q168 HydrophobicContact CE2-CG 4.27Å; F160-Q168 HydrophobicContact CZ-CB 3.45Å; F160-Q168 VanDerWaalsContact CZ-CB 3.45Å; F160-Q168 HydrophobicContact CZ-CG 3.91Å; F160-Q168 WeakPolarHBondContact CZ-O 3.31Å; F160-Q168 VanDerWaalsContact O-CD 3.25Å; F160-Q168 WeakPolarHBondContact O-CG 3.29Å; F160-Q168 PolarHBondContact O-NE2 3.02Å; T161-Q168 PolarHBondContact O-NE2 3.4Å; L163-Q168 HydrophobicContact CB-CG 3.94Å; L163-Q168 PolarHBondContact O-NE2 3.32Å; H164-Q168 PolarHBondContact O-N 3.1Å; H164-Q168 VanDerWaalsContact O-N 3.09Å; P165-Q168 WeakPolarHBondContact O-CB 3.27Å; P165-Q168 PolarHBondContact O-N 2.99Å; Q168-L172 WeakPolarHBondContact O-CG 3.47Å; Q168-L172 PolarHBondContact O-N 3.41Å; Q168-L172 VanDerWaalsContact O-N 3.14Å; Q168-F343 HydrophobicContact CB-CZ 4.04Å
169	L	93.3	Very high	93.7	Very high	31 Å²	31	31.1 Å²	31.1	16%	0.162	17%	0.171	C	C	.	.	H	α-helix	trans	-67.7	-43.2	176.1	-72.7	171.6	0	0	0	112.9	P165 S166 D167 L171 L172 N173 E340 F343	P165-L169 PolarHBondContact O-N 3.42Å; S166-L169 PolarHBondContact O-N 3.37Å; D167-L169 VanDerWaalsContact C-N 3.33Å; D167-L169 PolarHBondContact O-N 3.42Å; L169-L171 PolarHBondContact O-N 2.94Å; L169-L172 PolarHBondContact O-N 3.2Å; L169-N173 WeakPolarHBondContact O-CB 3.29Å; L169-N173 PolarHBondContact O-N 3.48Å; L169-E340 HydrophobicContact CD1-CG 4.26Å; L169-E340 HydrophobicContact CD2-CB 4.49Å; L169-E340 HydrophobicContact CD2-CG 3.99Å; L169-F343 HydrophobicContact CD2-CB 3.85Å; L169-F343 HydrophobicContact CD2-CD1 3.55Å; L169-F343 HydrophobicContact CD2-CD2 4.32Å; L169-F343 HydrophobicContact CD2-CE1 4.16Å; L169-F343 HydrophobicContact CD2-CG 3.65Å; L169-F343 HydrophobicContact CG-CD1 4.18Å; L169-F343 HydrophobicContact CG-CE1 4.35Å
170	I	94.2	Very high	93.6	Very high	37 Å²	37	29.9 Å²	29.9	19%	0.19	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-44.4	177.9	-73	164.7	0	0	0	110.9	S166 D167 N173 N174 A260 P261 G262 L263	S166-I170 WeakPolarHBondContact O-CB 3.38Å; S166-I170 WeakPolarHBondContact O-CD1 3.46Å; S166-I170 WeakPolarHBondContact O-CG1 3.39Å; S166-I170 PolarHBondContact O-N 3.02Å; D167-I170 PolarHBondContact O-N 3.11Å; I170-N173 PolarHBondContact O-N 3.43Å; I170-N174 WeakPolarHBondContact O-CB 3.31Å; I170-N174 PolarHBondContact O-N 3.28Å; I170-N174 PolarHBondContact O-ND2 3.18Å; I170-A260 HydrophobicContact CG2-CB 4.02Å; I170-P261 WeakPolarHBondContact CG2-O 3.34Å; I170-G262 WeakPolarHBondContact CD1-O 3.44Å; I170-L263 HydrophobicContact CB-CD2 4.18Å; I170-L263 HydrophobicContact CG2-CD2 3.78Å; I170-L263 HydrophobicContact CG2-CG 4.21Å
171	L	96.2	Very high	93.4	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-45.6	176.4	-70.1	-178.9	0	0	0	111.2	F160 L163 D167 L169 N174 S175 L255 F256 N257 A260 L263 V269	F160-L171 HydrophobicContact CE2-CB 4.39Å; L163-L171 HydrophobicContact CD1-CD1 3.51Å; D167-L171 WeakPolarHBondContact O-CB 3.44Å; D167-L171 VanDerWaalsContact O-CG 3.26Å; D167-L171 WeakPolarHBondContact O-CG 3.07Å; D167-L171 PolarHBondContact O-N 3.09Å; L169-L171 PolarHBondContact O-N 2.94Å; L171-N174 PolarHBondContact O-N 2.89Å; L171-S175 WeakPolarHBondContact O-CB 3.49Å; L171-S175 PolarHBondContact O-N 2.96Å; L171-S175 PolarHBondContact O-OG 3.14Å; L171-L255 HydrophobicContact CB-CD1 4.38Å; L171-L255 WeakPolarHBondContact CD2-O 3.36Å; L171-F256 HydrophobicContact CD1-CD1 4.23Å; L171-N257 WeakPolarHBondContact CD2-O 3.48Å; L171-A260 HydrophobicContact CD2-CB 4.17Å; L171-L263 HydrophobicContact CD2-CD1 4.07Å; L171-L263 HydrophobicContact CD2-CD2 3.94Å; L171-L263 HydrophobicContact CG-CD2 4.02Å; L171-V269 HydrophobicContact CD1-CG2 4.24Å; L171-V269 HydrophobicContact CD2-CG1 4.37Å
172	L	94.5	Very high	93.2	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-63	-47.2	176.5	-76.4	169.4	0	0	0	112.7	I150 I151 A154 F160 Q168 L169 N174 S175 W176 L255 I339 F343	I150-L172 HydrophobicContact CG2-CD2 4.29Å; I151-L172 HydrophobicContact CG1-CD1 4.4Å; A154-L172 HydrophobicContact CB-CD2 3.98Å; F160-L172 HydrophobicContact CE1-CD1 4.44Å; F160-L172 HydrophobicContact CE2-CG 4.33Å; F160-L172 HydrophobicContact CZ-CD1 3.76Å; F160-L172 HydrophobicContact CZ-CG 3.87Å; Q168-L172 WeakPolarHBondContact O-CG 3.47Å; Q168-L172 PolarHBondContact O-N 3.41Å; Q168-L172 VanDerWaalsContact O-N 3.14Å; L169-L172 PolarHBondContact O-N 3.2Å; L172-N174 VanDerWaalsContact C-N 3.26Å; L172-N174 PolarHBondContact O-N 3.39Å; L172-S175 PolarHBondContact O-N 3.1Å; L172-W176 WeakPolarHBondContact O-CB 3.06Å; L172-W176 PolarHBondContact O-N 2.94Å; L172-L255 HydrophobicContact CD2-CD1 4Å; L172-L255 HydrophobicContact CG-CD1 4.41Å; L172-I339 HydrophobicContact CB-CG2 4.05Å; L172-F343 HydrophobicContact CD1-CD2 3.45Å; L172-F343 VanDerWaalsContact CD1-CD2 3.45Å; L172-F343 HydrophobicContact CD1-CE2 3.6Å
173	N	91.7	Very high	93	Very high	31 Å²	31	21.4 Å²	21.4	17%	0.166	12%	0.116	C	C	.	.	H	α-helix	trans	-62.5	-31.1	180	-80.8	-22.2	0	0	0	113	L169 I170 W176 E336 I339	L169-N173 WeakPolarHBondContact O-CB 3.29Å; L169-N173 PolarHBondContact O-N 3.48Å; I170-N173 PolarHBondContact O-N 3.43Å; N173-W176 VanDerWaalsContact O-CD1 3.26Å; N173-E336 WeakPolarHBondContact OD1-CA 3.36Å; N173-I339 WeakPolarHBondContact OD1-CB 3.36Å; N173-I339 WeakPolarHBondContact OD1-CG2 3.31Å
174	N	91.8	Very high	92.6	Very high	70 Å²	70	20.9 Å²	20.9	37%	0.374	11%	0.113	S	C	.	.	H	α-helix	trans	-84.4	-31.2	174.8	-76.3	-87	0	0	0	113.6	I170 L171 L172 A260	I170-N174 WeakPolarHBondContact O-CB 3.31Å; I170-N174 PolarHBondContact O-N 3.28Å; I170-N174 PolarHBondContact O-ND2 3.18Å; L171-N174 PolarHBondContact O-N 2.89Å; L172-N174 VanDerWaalsContact C-N 3.26Å; L172-N174 PolarHBondContact O-N 3.39Å; N174-A260 HydrophobicContact CB-CB 4.43Å
175	S	93.9	Very high	92.2	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.021	9%	0.093	C	C	.	.	H	α-helix	trans	-96.7	-21.1	-170.7	62.1	0	0	0	0	115.4	L171 L172 P177 E178 L179 I254	L171-S175 WeakPolarHBondContact O-CB 3.49Å; L171-S175 PolarHBondContact O-N 2.96Å; L171-S175 PolarHBondContact O-OG 3.14Å; L172-S175 PolarHBondContact O-N 3.1Å; S175-P177 VanDerWaalsContact C-N 3.35Å; S175-P177 WeakPolarHBondContact O-CD 3.44Å; S175-P177 VanDerWaalsContact O-N 3.14Å; S175-E178 PolarHBondContact O-N 2.87Å; S175-E178 VanDerWaalsContact O-N 3.14Å; S175-L179 WeakPolarHBondContact O-CG 3.35Å; S175-L179 PolarHBondContact O-N 3.12Å; S175-L179 WeakPolarHBondContact OG-CD1 3.47Å; S175-I254 WeakPolarHBondContact CB-O 3.48Å
176	W	92.3	Very high	91.8	Very high	10 Å²	10	14.7 Å²	14.7	4%	0.038	8%	0.079	C	C	.	.	H	α-helix	trans	-53	-34.9	-174.3	80	-91.5	0	0	0	116.1	L147 L172 N173 F180 L316 L319 Q320 F324 L335 I339	L147-W176 HydrophobicContact CD1-CB 4.02Å; L147-W176 HydrophobicContact CD1-CE3 4.5Å; L147-W176 HydrophobicContact CD1-CG 4.48Å; L172-W176 WeakPolarHBondContact O-CB 3.06Å; L172-W176 PolarHBondContact O-N 2.94Å; N173-W176 VanDerWaalsContact O-CD1 3.26Å; W176-F180 WeakPolarHBondContact O-CB 3.3Å; W176-F180 PolarHBondContact O-N 2.88Å; W176-L316 HydrophobicContact CH2-CD1 4.31Å; W176-L316 HydrophobicContact CZ2-CD1 3.73Å; W176-L316 HydrophobicContact CZ2-CG 4.46Å; W176-L319 HydrophobicContact CH2-CD2 3.73Å; W176-L319 HydrophobicContact CZ3-CD2 3.64Å; W176-Q320 HydrophobicContact CH2-CG 4.09Å; W176-Q320 HydrophobicContact CZ2-CG 4.44Å; W176-F324 HydrophobicContact CH2-CE2 4.25Å; W176-F324 AromaticContact CZ3-CE2 3.85Å; W176-F324 HydrophobicContact CZ3-CE2 3.85Å; W176-F324 HydrophobicContact CZ3-CZ 4.2Å; W176-L335 HydrophobicContact CD2-CD2 3.83Å; W176-L335 VanDerWaalsContact CE2-CD2 3.47Å; W176-L335 HydrophobicContact CE3-CD2 4.32Å; W176-L335 HydrophobicContact CG-CD2 4.34Å; W176-L335 HydrophobicContact CH2-CD1 3.69Å; W176-L335 HydrophobicContact CH2-CD2 4.21Å; W176-L335 HydrophobicContact CZ2-CD1 3.84Å; W176-L335 HydrophobicContact CZ2-CD2 3.7Å; W176-L335 HydrophobicContact CZ2-CG 4.31Å; W176-L335 HydrophobicContact CZ3-CD1 4.19Å; W176-L335 HydrophobicContact CZ3-CD2 4.49Å; W176-I339 HydrophobicContact CB-CD1 3.9Å; W176-I339 HydrophobicContact CD2-CD1 4.31Å; W176-I339 HydrophobicContact CG-CD1 3.56Å
177	P	92.3	Very high	91	Very high	8 Å²	8	15.6 Å²	15.6	5%	0.052	8%	0.08	C	C	.	.	H	α-helix	trans	-71.2	-38.4	-179	-12.4	27.9	0	0	0	111.5	S175 M181 V310 L316	S175-P177 VanDerWaalsContact C-N 3.35Å; S175-P177 WeakPolarHBondContact O-CD 3.44Å; S175-P177 VanDerWaalsContact O-N 3.14Å; P177-M181 PolarHBondContact O-N 2.94Å; P177-V310 HydrophobicContact CB-CB 3.85Å; P177-V310 HydrophobicContact CB-CG1 4.48Å; P177-V310 HydrophobicContact CB-CG2 3.87Å; P177-L316 HydrophobicContact CB-CD1 4.03Å; P177-L316 HydrophobicContact CG-CD1 3.53Å
178	E	93.9	Very high	89.8	Confident	10 Å²	10	16.3 Å²	16.3	5%	0.047	8%	0.083	C	C	.	.	H	α-helix	trans	-69.6	-43.8	177.4	-68.6	-169.9	-120.7	0	0	110.6	S175 M181 L182 I254 L306 K307 V310	S175-E178 PolarHBondContact O-N 2.87Å; S175-E178 VanDerWaalsContact O-N 3.14Å; E178-M181 PolarHBondContact O-N 3.41Å; E178-L182 PolarHBondContact O-N 3.11Å; E178-L182 VanDerWaalsContact O-N 3.08Å; E178-I254 HydrophobicContact CB-CD1 4.25Å; E178-I254 HydrophobicContact CB-CG1 4.49Å; E178-I254 HydrophobicContact CB-CG2 3.44Å; E178-I254 VanDerWaalsContact CB-CG2 3.44Å; E178-I254 HydrophobicContact CG-CG2 4.41Å; E178-L306 VanDerWaalsContact CA-CD2 3.49Å; E178-L306 HydrophobicContact CB-CD2 3.58Å; E178-L306 HydrophobicContact CG-CD2 3.75Å; E178-K307 VanDerWaalsContact OE1-CD 3.26Å; E178-K307 WeakPolarHBondContact OE1-CD 3.33Å; E178-K307 WeakPolarHBondContact OE1-CE 3.46Å; E178-K307 VanDerWaalsContact OE1-CG 3.24Å; E178-K307 WeakPolarHBondContact OE1-CG 3.24Å; E178-K307 IonicContact OE1-NZ 2.74Å; E178-K307 WeakPolarHBondContact OE2-CB 3.09Å; E178-V310 HydrophobicContact CB-CG2 4.39Å; E178-V310 HydrophobicContact CG-CG2 3.44Å; E178-V310 VanDerWaalsContact CG-CG2 3.44Å
179	L	93.8	Very high	88	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.4	-45	174.6	-66	175.5	0	0	0	111.7	I150 W153 S175 M181 L182 Y183 K251 I254 L255	I150-L179 HydrophobicContact CD1-CB 4.07Å; I150-L179 HydrophobicContact CG1-CB 4.33Å; I150-L179 HydrophobicContact CG2-CB 4.29Å; I150-L179 HydrophobicContact CG2-CD1 3.7Å; W153-L179 HydrophobicContact CZ3-CD1 4.49Å; W153-L179 HydrophobicContact CZ3-CD2 4.39Å; S175-L179 WeakPolarHBondContact O-CG 3.35Å; S175-L179 PolarHBondContact O-N 3.12Å; S175-L179 WeakPolarHBondContact OG-CD1 3.47Å; L179-M181 VanDerWaalsContact C-N 3.34Å; L179-M181 PolarHBondContact O-N 3.4Å; L179-L182 PolarHBondContact O-N 3.13Å; L179-L182 VanDerWaalsContact O-N 3.14Å; L179-Y183 WeakPolarHBondContact O-CD2 3.47Å; L179-Y183 PolarHBondContact O-N 2.88Å; L179-K251 HydrophobicContact CD2-CB 3.86Å; L179-K251 HydrophobicContact CD2-CG 4.18Å; L179-K251 WeakPolarHBondContact CD2-O 3.5Å; L179-I254 HydrophobicContact CD2-CB 4.02Å; L179-I254 HydrophobicContact CD2-CG2 3.72Å; L179-I254 HydrophobicContact CG-CG2 3.81Å; L179-L255 HydrophobicContact CD1-CD1 4.35Å
180	F	90.8	Very high	86.1	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.009	11%	0.112	C	C	.	.	H	α-helix	trans	-61.6	-40.4	177.8	-177.3	-111	0	0	0	111.8	F18 T143 Y146 I150 W176 L182 Y183 L184 L319 F323	F18-F180 HydrophobicContact CE2-CZ 4.39Å; F18-F180 HydrophobicContact CZ-CE2 4.12Å; F18-F180 AromaticContact CZ-CZ 3.94Å; F18-F180 HydrophobicContact CZ-CZ 3.94Å; T143-F180 HydrophobicContact CG2-CE2 3.84Å; T143-F180 HydrophobicContact CG2-CZ 3.69Å; Y146-F180 HydrophobicContact CG-CE2 4.4Å; I150-F180 HydrophobicContact CD1-CB 4.16Å; W176-F180 WeakPolarHBondContact O-CB 3.3Å; W176-F180 PolarHBondContact O-N 2.88Å; F180-L182 PolarHBondContact O-N 2.84Å; F180-Y183 PolarHBondContact O-N 2.6Å; F180-L184 HydrophobicContact CD1-CD1 3.95Å; F180-L184 HydrophobicContact CD1-CG 4.49Å; F180-L184 HydrophobicContact CE1-CD1 3.55Å; F180-L184 HydrophobicContact CE1-CG 4.22Å; F180-L184 HydrophobicContact CE2-CG 4.47Å; F180-L184 HydrophobicContact CZ-CD1 3.92Å; F180-L184 HydrophobicContact CZ-CD2 4.29Å; F180-L184 HydrophobicContact CZ-CG 4.19Å; F180-L184 WeakPolarHBondContact O-CG 3.43Å; F180-L184 PolarHBondContact O-N 2.96Å; F180-L319 HydrophobicContact CD1-CD2 4.04Å; F180-L319 HydrophobicContact CE1-CD2 4.21Å; F180-F323 HydrophobicContact CE1-CB 4.17Å; F180-F323 HydrophobicContact CE1-CD1 4.07Å; F180-F323 AromaticContact CE1-CD2 3.9Å; F180-F323 HydrophobicContact CE1-CD2 3.9Å; F180-F323 HydrophobicContact CE1-CE1 4.44Å; F180-F323 HydrophobicContact CE1-CE2 4.28Å; F180-F323 AromaticContact CE1-CG 3.78Å; F180-F323 HydrophobicContact CE1-CG 3.78Å; F180-F323 HydrophobicContact CZ-CB 4.17Å; F180-F323 AromaticContact CZ-CD1 3.86Å; F180-F323 HydrophobicContact CZ-CD1 3.86Å; F180-F323 HydrophobicContact CZ-CD2 4.49Å; F180-F323 HydrophobicContact CZ-CE1 4.37Å; F180-F323 AromaticContact CZ-CG 3.93Å; F180-F323 HydrophobicContact CZ-CG 3.93Å
181	M	90.4	Very high	83.7	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.3	-40	172.5	-178.1	176.9	-81.5	0	0	112.6	P177 E178 L179 L184 A185 F230 Q233 L234 I237 L306 T309 V310	P177-M181 PolarHBondContact O-N 2.94Å; E178-M181 PolarHBondContact O-N 3.41Å; L179-M181 VanDerWaalsContact C-N 3.34Å; L179-M181 PolarHBondContact O-N 3.4Å; M181-L184 PolarHBondContact O-N 3.29Å; M181-A185 PolarHBondContact O-N 3.39Å; M181-F230 HydrophobicContact CE-CD2 3.31Å; M181-F230 HydrophobicContact CE-CE2 3.66Å; M181-F230 HydrophobicContact CE-CG 4.15Å; M181-Q233 HydrophobicContact CE-CB 4.27Å; M181-Q233 HydrophobicContact SD-CB 3.82Å; M181-Q233 HydrophobicContact SD-CG 4.4Å; M181-L234 HydrophobicContact CG-CD2 3.89Å; M181-L234 WeakPolarHBondContact O-CD2 3.4Å; M181-I237 HydrophobicContact CG-CD1 4.18Å; M181-I237 HydrophobicContact SD-CD1 4.35Å; M181-L306 HydrophobicContact CB-CD2 4.25Å; M181-L306 HydrophobicContact CG-CD2 4.45Å; M181-L306 HydrophobicContact CG-CG 4.44Å; M181-L306 HydrophobicContact SD-CD2 3.98Å; M181-L306 HydrophobicContact SD-CG 3.81Å; M181-T309 HydrophobicContact CE-CG2 3.96Å; M181-V310 HydrophobicContact CE-CG1 3.59Å; M181-V310 HydrophobicContact SD-CG1 4.29Å
182	L	91	Very high	81.1	Confident	3 Å²	3	29 Å²	29	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-64.3	-43.5	173	-80	-170.1	0	0	0	112.6	E178 L179 F180 L184 A185 Q186 I237 L250 K251 I254 L306	E178-L182 PolarHBondContact O-N 3.11Å; E178-L182 VanDerWaalsContact O-N 3.08Å; L179-L182 PolarHBondContact O-N 3.13Å; L179-L182 VanDerWaalsContact O-N 3.14Å; F180-L182 PolarHBondContact O-N 2.84Å; L182-L184 VanDerWaalsContact C-N 3.31Å; L182-L184 PolarHBondContact O-N 3.17Å; L182-A185 PolarHBondContact O-N 3.11Å; L182-Q186 WeakPolarHBondContact O-CB 3.46Å; L182-Q186 PolarHBondContact O-N 3.43Å; L182-I237 HydrophobicContact CD2-CD1 4.33Å; L182-I237 HydrophobicContact CD2-CG2 4.12Å; L182-L250 HydrophobicContact CD1-CB 3.99Å; L182-K251 HydrophobicContact CB-CG 4.49Å; L182-K251 HydrophobicContact CD1-CB 4.48Å; L182-K251 HydrophobicContact CD1-CG 3.83Å; L182-I254 HydrophobicContact CD1-CD1 3.5Å; L182-I254 HydrophobicContact CG-CD1 4.03Å; L182-L306 HydrophobicContact CD2-CD1 3.58Å; L182-L306 HydrophobicContact CG-CD1 3.82Å
183	Y	87.8	Confident	78.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-40.4	176.2	-89.8	-82.7	0	0	0	111.4	L13 V149 I150 L179 F180 Q186 I187 K251	L13-Y183 HydrophobicContact CD2-CD1 4.18Å; L13-Y183 HydrophobicContact CD2-CE1 4.46Å; V149-Y183 HydrophobicContact CG1-CE1 3.84Å; I150-Y183 HydrophobicContact CD1-CD2 4.07Å; I150-Y183 HydrophobicContact CD1-CE2 4.41Å; I150-Y183 HydrophobicContact CG1-CD2 3.6Å; I150-Y183 HydrophobicContact CG1-CE2 3.46Å; I150-Y183 VanDerWaalsContact CG1-CE2 3.46Å; L179-Y183 WeakPolarHBondContact O-CD2 3.47Å; L179-Y183 PolarHBondContact O-N 2.88Å; F180-Y183 PolarHBondContact O-N 2.6Å; Y183-Q186 PolarHBondContact O-N 3.46Å; Y183-I187 PolarHBondContact O-N 2.86Å; Y183-I187 VanDerWaalsContact O-N 3.1Å; Y183-K251 HydrophobicContact CE2-CD 3.94Å; Y183-K251 PolarHBondContact OH-NZ 2.86Å
184	L	85.9	Confident	75.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-42	173.3	-72.8	179.8	0	0	0	112.6	F18 L22 F180 M181 L182 Q186 I187 Y188 F230 L234 F323	F18-L184 HydrophobicContact CE1-CD2 3.62Å; F18-L184 HydrophobicContact CZ-CD2 3.7Å; L22-L184 HydrophobicContact CD1-CD1 4.23Å; L22-L184 HydrophobicContact CD1-CD2 3.93Å; L22-L184 HydrophobicContact CD2-CD2 3.87Å; L22-L184 HydrophobicContact CG-CD2 4.48Å; F180-L184 HydrophobicContact CD1-CD1 3.95Å; F180-L184 HydrophobicContact CD1-CG 4.49Å; F180-L184 HydrophobicContact CE1-CD1 3.55Å; F180-L184 HydrophobicContact CE1-CG 4.22Å; F180-L184 HydrophobicContact CE2-CG 4.47Å; F180-L184 HydrophobicContact CZ-CD1 3.92Å; F180-L184 HydrophobicContact CZ-CD2 4.29Å; F180-L184 HydrophobicContact CZ-CG 4.19Å; F180-L184 WeakPolarHBondContact O-CG 3.43Å; F180-L184 PolarHBondContact O-N 2.96Å; M181-L184 PolarHBondContact O-N 3.29Å; L182-L184 VanDerWaalsContact C-N 3.31Å; L182-L184 PolarHBondContact O-N 3.17Å; L184-Q186 VanDerWaalsContact C-N 3.29Å; L184-Q186 PolarHBondContact O-N 3.02Å; L184-I187 HydrophobicContact CD2-CD1 4.03Å; L184-I187 WeakPolarHBondContact O-CG1 3.45Å; L184-I187 PolarHBondContact O-N 3.3Å; L184-Y188 WeakPolarHBondContact O-CB 3.19Å; L184-Y188 PolarHBondContact O-N 3.46Å; L184-F230 HydrophobicContact CD1-CE1 4.27Å; L184-F230 HydrophobicContact CD1-CZ 3.57Å; L184-L234 HydrophobicContact CB-CD2 3.91Å; L184-F323 HydrophobicContact CD1-CE1 4.17Å; L184-F323 HydrophobicContact CD1-CE2 4.38Å; L184-F323 HydrophobicContact CD1-CZ 3.87Å
185	A	86.4	Confident	73.1	Confident	2 Å²	2	34.6 Å²	34.6	2%	0.017	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-28.4	175	0	0	0	0	0	113.1	M181 L182 L234 I237 Q238 Y247	M181-A185 PolarHBondContact O-N 3.39Å; L182-A185 PolarHBondContact O-N 3.11Å; A185-L234 HydrophobicContact CB-CD2 3.84Å; A185-I237 HydrophobicContact CB-CB 3.96Å; A185-I237 HydrophobicContact CB-CD1 4.2Å; A185-I237 HydrophobicContact CB-CG2 3.57Å; A185-Q238 HydrophobicContact CB-CG 4.45Å; A185-Q238 PolarHBondContact O-NE2 3.2Å; A185-Y247 PolarHBondContact O-OH 2.87Å
186	Q	83.6	Confident	70.3	Confident	44 Å²	44	38.7 Å²	38.7	21%	0.206	23%	0.226	C	C	.	.	H	α-helix	trans	-75.9	-34.6	177.9	-168.6	-176.4	-4.3	0	0	112.7	E6 L182 Y183 L184 Q244 Y247 K251	E6-Q186 PolarHBondContact OE1-NE2 3.19Å; L182-Q186 WeakPolarHBondContact O-CB 3.46Å; L182-Q186 PolarHBondContact O-N 3.43Å; Y183-Q186 PolarHBondContact O-N 3.46Å; L184-Q186 VanDerWaalsContact C-N 3.29Å; L184-Q186 PolarHBondContact O-N 3.02Å; Q186-Q244 VanDerWaalsContact NE2-OE1 3.08Å; Q186-Y247 HydrophobicContact CB-CD1 4.31Å; Q186-Y247 HydrophobicContact CB-CE1 3.87Å; Q186-Y247 HydrophobicContact CB-CE2 4.36Å; Q186-Y247 HydrophobicContact CG-CD1 4.41Å; Q186-Y247 HydrophobicContact CG-CD2 4.22Å; Q186-Y247 HydrophobicContact CG-CE1 4.31Å; Q186-Y247 HydrophobicContact CG-CE2 4.08Å; Q186-Y247 HydrophobicContact CG-CG 4.38Å; Q186-K251 VanDerWaalsContact OE1-CE 3.27Å
187	I	76.9	Confident	67.5	Low	51 Å²	51	41.9 Å²	41.9	26%	0.262	25%	0.25	S	C	.	.	H	α-helix	trans	-90	-31.6	179.9	68.1	178.9	0	0	0	114.1	L13 F18 L22 Y146 Y183 L184	L13-I187 HydrophobicContact CD2-CG2 4.08Å; F18-I187 HydrophobicContact CD1-CD1 4.31Å; F18-I187 HydrophobicContact CE1-CD1 3.86Å; L22-I187 HydrophobicContact CD2-CD1 4.44Å; Y146-I187 HydrophobicContact CE1-CD1 3.72Å; Y146-I187 HydrophobicContact CE1-CG2 4.32Å; Y146-I187 WeakPolarHBondContact OH-CD1 3.43Å; Y183-I187 PolarHBondContact O-N 2.86Å; Y183-I187 VanDerWaalsContact O-N 3.1Å; L184-I187 HydrophobicContact CD2-CD1 4.03Å; L184-I187 WeakPolarHBondContact O-CG1 3.45Å; L184-I187 PolarHBondContact O-N 3.3Å
188	Y	70.1	Confident	64.4	Low	20 Å²	20	47 Å²	47	8%	0.078	29%	0.286	C	S	.	.			trans	-70.7	142.3	-175.9	174.7	-121.7	0	0	0	110.2	L22 L26 L184 I190 I193 Q238	L22-Y188 HydrophobicContact CD2-CD2 4.45Å; L26-Y188 HydrophobicContact CD1-CD1 4.03Å; L26-Y188 HydrophobicContact CD1-CD2 3.87Å; L26-Y188 HydrophobicContact CD1-CE1 3.82Å; L26-Y188 HydrophobicContact CD1-CE2 3.66Å; L26-Y188 HydrophobicContact CD1-CG 4.07Å; L184-Y188 WeakPolarHBondContact O-CB 3.19Å; L184-Y188 PolarHBondContact O-N 3.46Å; Y188-I190 HydrophobicContact CD1-CG1 4.47Å; Y188-I190 HydrophobicContact CE1-CG1 3.74Å; Y188-I193 HydrophobicContact CE2-CD1 4.45Å; Y188-I193 WeakPolarHBondContact OH-CD1 3.27Å; Y188-Q238 PolarHBondContact O-NE2 3.07Å
189	N	58.1	Low	61.4	Low	105 Å²	105	51.5 Å²	51.5	56%	0.561	32%	0.319	S	S	*	.			trans	-133.2	109.2	179.3	-168.4	-29.6	0	0	0	110.3	S191 L192	N189-S191 PolarHBondContact O-N 2.9Å; N189-S191 VanDerWaalsContact OD1-CB 3.22Å; N189-S191 WeakPolarHBondContact OD1-CB 3.17Å; N189-S191 PolarHBondContact OD1-N 3.3Å; N189-L192 PolarHBondContact O-N 2.81Å
190	I	53.6	Low	58.3	Low	56 Å²	56	58.7 Å²	58.7	29%	0.287	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-51.7	-22	-177.1	-81.9	168.2	0	0	0	114.1	Y188 L192 I193 T194 E235 Q238	Y188-I190 HydrophobicContact CD1-CG1 4.47Å; Y188-I190 HydrophobicContact CE1-CG1 3.74Å; I190-L192 PolarHBondContact O-N 3.44Å; I190-I193 PolarHBondContact O-N 2.98Å; I190-T194 HydrophobicContact CG2-CG2 3.44Å; I190-T194 VanDerWaalsContact CG2-CG2 3.44Å; I190-E235 HydrophobicContact CD1-CG 4.38Å; I190-Q238 HydrophobicContact CD1-CB 4.27Å; I190-Q238 VanDerWaalsContact CG1-OE1 3.29Å
191	S	42.6	Very low	55.5	Low	78 Å²	78	69 Å²	69	55%	0.545	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-41	-33.1	174.8	-176.4	0	0	0	0	115	N189	N189-S191 PolarHBondContact O-N 2.9Å; N189-S191 VanDerWaalsContact OD1-CB 3.22Å; N189-S191 WeakPolarHBondContact OD1-CB 3.17Å; N189-S191 PolarHBondContact OD1-N 3.3Å
192	L	40.9	Very low	52.6	Low	114 Å²	114	76 Å²	76	60%	0.597	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-80.3	-12.3	-174.6	-81.6	62	0	0	0	114.8	N189 I190	N189-L192 PolarHBondContact O-N 2.81Å; I190-L192 PolarHBondContact O-N 3.44Å
193	I	41	Very low	49.9	Very low	30 Å²	30	82.2 Å²	82.2	15%	0.154	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	7.1	-173.7	-27.9	-172.3	0	0	0	113.7	R30 Y188 I190	R30-I193 PolarHBondContact NH1-O 2.87Å; Y188-I193 HydrophobicContact CE2-CD1 4.45Å; Y188-I193 WeakPolarHBondContact OH-CD1 3.27Å; I190-I193 PolarHBondContact O-N 2.98Å
194	T	37.8	Very low	47.1	Very low	83 Å²	83	88.5 Å²	88.5	51%	0.509	50%	0.502	S	S	.	.	S	Bend	trans	-90.9	-6.5	179.9	44.4	0	0	0	0	114.9	I190 S196	I190-T194 HydrophobicContact CG2-CG2 3.44Å; I190-T194 VanDerWaalsContact CG2-CG2 3.44Å; T194-S196 PolarHBondContact O-N 3.32Å
195	S	32.8	Very low	44.6	Very low	107 Å²	107	96.1 Å²	96.1	75%	0.748	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	13	-168.4	51.4	0	0	0	0	116.1
196	S	33.8	Very low	41.8	Very low	89 Å²	89	103.3 Å²	103.3	62%	0.622	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.9	28	-174.1	72.8	0	0	0	0	116.6	T194	T194-S196 PolarHBondContact O-N 3.32Å
197	S	33.3	Very low	39.2	Very low	77 Å²	77	109.8 Å²	109.8	54%	0.538	61%	0.611	S	S	.	*			trans	-147.1	54.1	178.1	58.2	0	0	0	0	113.4	R30	R30-S197 PolarHBondContact NH2-OG 2.94Å; R30-S197 VanDerWaalsContact NH2-OG 3.07Å
198	S	27.8	Very low	36.7	Very low	115 Å²	115	113.6 Å²	113.6	80%	0.804	64%	0.636	S	S	*	*			trans	-149.9	73.9	173.7	62.2	0	0	0	0	111.4
199	S	31.8	Very low	34.8	Very low	106 Å²	106	118 Å²	118	74%	0.741	67%	0.665	S	S	*	*			trans	-147.8	122.1	166.5	48.7	0	0	0	0	110	Y201	S199-Y201 PolarHBondContact O-N 3.32Å
200	D	27.8	Very low	33.3	Very low	150 Å²	150	119 Å²	119	80%	0.802	68%	0.675	S	S	*	*			trans	-69.9	126.5	-171.8	-56.7	-89.5	0	0	0	112.9
201	Y	32.6	Very low	32.1	Very low	220 Å²	220	120 Å²	120	86%	0.863	69%	0.687	S	S	*	*			trans	-135.4	81.7	160.9	-94.3	-75.9	0	0	0	112.2	S199 N203	S199-Y201 PolarHBondContact O-N 3.32Å; Y201-N203 PolarHBondContact O-N 2.96Å
202	N	28.5	Very low	31.2	Very low	146 Å²	146	123.7 Å²	123.7	78%	0.781	70%	0.701	S	S	*	*			trans	-59.7	113.9	155.1	-88.3	-55.2	0	0	0	109.4
203	N	34.2	Very low	30.6	Very low	134 Å²	134	128.8 Å²	128.8	72%	0.717	71%	0.712	S	S	*	*				179.3	118.7	124.2	-99.5	-64.3	0	0	0	113.3	Y201	Y201-N203 PolarHBondContact O-N 2.96Å
204	N	30.3	Very low	29.8	Very low	132 Å²	132	131.5 Å²	131.5	71%	0.706	73%	0.734	S	S	*	*				24.7	104.6	128.6	-54.3	-53.6	0	0	0	118
205	N	33.3	Very low	29.5	Very low	159 Å²	159	134.3 Å²	134.3	85%	0.85	75%	0.746	S	S	*	*				-173.4	141.9	113.3	-94.2	-38.7	0	0	0	114.2
206	N	26.8	Very low	29.3	Very low	153 Å²	153	137.5 Å²	137.5	82%	0.818	75%	0.749	S	S	*	*			trans	-60.2	137.7	-176.7	-48.5	-56.7	0	0	0	114.3
207	Q	29.1	Very low	29.4	Very low	180 Å²	180	133.9 Å²	133.9	84%	0.841	72%	0.723	S	S	*	*				-166.4	131.3	105.5	-108.6	179.1	-8.2	0	0	112.9
208	V	25.5	Very low	29.2	Very low	132 Å²	132	134.7 Å²	134.7	80%	0.8	72%	0.722	S	S	*	*			trans	-84.6	126.2	172.5	174.9	0	0	0	0	109.2	T210	V208-T210 HydrophobicContact CG1-CG2 4.04Å
209	V	29.1	Very low	29.5	Very low	112 Å²	112	135.5 Å²	135.5	68%	0.679	72%	0.716	S	S	*	*			trans	-124.1	91.6	171	-177.6	0	0	0	0	109.4	S211	V209-S211 PolarHBondContact O-N 2.83Å
210	T	26	Very low	30.1	Very low	126 Å²	126	133.1 Å²	133.1	77%	0.773	70%	0.695	S	S	*	*			trans	-79.2	104	168.6	49.6	0	0	0	0	109.4	V208	V208-T210 HydrophobicContact CG1-CG2 4.04Å
211	S	28.8	Very low	30.9	Very low	76 Å²	76	129.2 Å²	129.2	53%	0.531	67%	0.674	S	S	.	*			trans	-120.9	89.6	179.7	62.2	0	0	0	0	112.9	V209 W213	V209-S211 PolarHBondContact O-N 2.83Å; S211-W213 PolarHBondContact O-N 3.49Å
212	N	24.7	Very low	32	Very low	157 Å²	157	121.9 Å²	121.9	84%	0.84	65%	0.649	S	S	*	*			trans	32.1	85	144.4	-56.5	-3.9	0	0	0	117.8
213	W	27.6	Very low	33.6	Very low	220 Å²	220	116.2 Å²	116.2	83%	0.833	62%	0.619	S	S	*	*			trans	-106.3	100.8	159.3	-66.5	86.1	0	0	0	108.7	S211 S217	S211-W213 PolarHBondContact O-N 3.49Å; W213-S217 VanDerWaalsContact O-CB 3.22Å; W213-S217 WeakPolarHBondContact O-CB 3.24Å; W213-S217 PolarHBondContact O-OG 3.39Å
214	S	24.4	Very low	35.2	Very low	87 Å²	87	111.6 Å²	111.6	61%	0.608	59%	0.593	S	S	*	*			trans	-106.4	147.5	-176.8	53.3	0	0	0	0	113.7	Q216	S214-Q216 VanDerWaalsContact C-N 3.31Å; S214-Q216 PolarHBondContact O-N 3.43Å
215	D	30.4	Very low	37.4	Very low	142 Å²	142	109.9 Å²	109.9	76%	0.759	58%	0.581	S	S	*	*	S	Bend	trans	64.5	-45.4	162.8	-50.4	-26.5	0	0	0	119
216	Q	30.5	Very low	39.7	Very low	174 Å²	174	104 Å²	104	81%	0.813	55%	0.547	S	S	*	.	S	Bend	trans	-86.2	-17.5	165.7	-83.5	-173.6	-29.6	0	0	112.8	S214 N218	S214-Q216 VanDerWaalsContact C-N 3.31Å; S214-Q216 PolarHBondContact O-N 3.43Å; Q216-N218 VanDerWaalsContact C-N 3.32Å; Q216-N218 PolarHBondContact O-N 3.49Å
217	S	34	Very low	42.2	Very low	13 Å²	13	97 Å²	97	9%	0.091	51%	0.51	C	S	.	.	H	α-helix	trans	-60.5	-36	-178.1	54.6	0	0	0	0	113.9	W213 L219 L220 L221	W213-S217 VanDerWaalsContact O-CB 3.22Å; W213-S217 WeakPolarHBondContact O-CB 3.24Å; W213-S217 PolarHBondContact O-OG 3.39Å; S217-L219 PolarHBondContact O-N 2.92Å; S217-L220 PolarHBondContact O-N 3.39Å; S217-L221 WeakPolarHBondContact O-CB 3.3Å; S217-L221 VanDerWaalsContact O-CG 3.28Å; S217-L221 WeakPolarHBondContact O-CG 3.27Å; S217-L221 PolarHBondContact O-N 3.01Å
218	N	30.8	Very low	44.7	Very low	95 Å²	95	90 Å²	90	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-60	-39.1	-170.8	-66.7	-39.9	0	0	0	113.7	Q216 L221 L222	Q216-N218 VanDerWaalsContact C-N 3.32Å; Q216-N218 PolarHBondContact O-N 3.49Å; N218-L221 PolarHBondContact O-N 3.35Å; N218-L222 WeakPolarHBondContact O-CD1 3.37Å; N218-L222 PolarHBondContact O-N 2.83Å
219	L	33.6	Very low	47.6	Very low	132 Å²	132	86.7 Å²	86.7	69%	0.691	45%	0.454	S	S	*	.	H	α-helix	trans	-69.7	-43.8	178	-75.1	169.5	0	0	0	111.7	S217 L221 L222 D223	S217-L219 PolarHBondContact O-N 2.92Å; L219-L221 VanDerWaalsContact C-N 3.34Å; L219-L221 PolarHBondContact O-N 2.87Å; L219-L222 PolarHBondContact O-N 3.45Å; L219-D223 PolarHBondContact O-N 2.99Å
220	L	44.9	Very low	50.4	Low	56 Å²	56	81.6 Å²	81.6	29%	0.293	42%	0.422	S	S	.	.	H	α-helix	trans	-61.2	-41.7	173.9	-88.5	153.1	0	0	0	111.9	T55 S217 D223 Q224	T55-L220 HydrophobicContact CG2-CD2 3.69Å; S217-L220 PolarHBondContact O-N 3.39Å; L220-D223 PolarHBondContact O-N 2.78Å; L220-Q224 WeakPolarHBondContact O-CB 3.2Å; L220-Q224 WeakPolarHBondContact O-CG 3.42Å; L220-Q224 PolarHBondContact O-N 3.31Å
221	L	44.7	Very low	53.2	Low	68 Å²	68	76 Å²	76	36%	0.356	39%	0.387	S	S	.	.	H	α-helix	trans	-65.8	-37.9	176.9	-74.3	166	0	0	0	112.3	S217 N218 L219 Q224 Q225	S217-L221 WeakPolarHBondContact O-CB 3.3Å; S217-L221 VanDerWaalsContact O-CG 3.28Å; S217-L221 WeakPolarHBondContact O-CG 3.27Å; S217-L221 PolarHBondContact O-N 3.01Å; N218-L221 PolarHBondContact O-N 3.35Å; L219-L221 VanDerWaalsContact C-N 3.34Å; L219-L221 PolarHBondContact O-N 2.87Å; L221-Q224 WeakPolarHBondContact O-CB 3.34Å; L221-Q225 WeakPolarHBondContact O-CB 3.32Å; L221-Q225 PolarHBondContact O-N 2.95Å
222	L	54.1	Low	56	Low	66 Å²	66	73.7 Å²	73.7	35%	0.346	37%	0.369	S	S	.	.	H	α-helix	trans	-69.3	-46.3	174.3	-95.3	69.8	0	0	0	111.4	N218 L219 Q224 Q225 Y226 T314	N218-L222 WeakPolarHBondContact O-CD1 3.37Å; N218-L222 PolarHBondContact O-N 2.83Å; L219-L222 PolarHBondContact O-N 3.45Å; L222-Q224 PolarHBondContact O-N 2.98Å; L222-Q225 PolarHBondContact O-N 2.87Å; L222-Y226 HydrophobicContact CB-CE2 4.15Å; L222-Y226 HydrophobicContact CD2-CE2 4.38Å; L222-Y226 HydrophobicContact CG-CE2 4.27Å; L222-Y226 WeakPolarHBondContact O-CD2 3.44Å; L222-Y226 PolarHBondContact O-N 3.06Å; L222-T314 HydrophobicContact CD2-CG2 4.35Å
223	D	62.1	Low	59.1	Low	26 Å²	26	67.2 Å²	67.2	14%	0.139	33%	0.334	C	S	.	.	H	α-helix	trans	-58.3	-38.3	174.4	-78.1	-15.6	0	0	0	111.5	T55 N57 L219 L220 S227 W318	T55-D223 HydrophobicContact CG2-CB 4.31Å; T55-D223 WeakPolarHBondContact CG2-OD2 3.22Å; N57-D223 PolarHBondContact ND2-OD2 2.85Å; L219-D223 PolarHBondContact O-N 2.99Å; L220-D223 PolarHBondContact O-N 2.78Å; D223-S227 VanDerWaalsContact O-CB 3.31Å; D223-S227 WeakPolarHBondContact O-CB 3.31Å; D223-S227 PolarHBondContact O-N 2.93Å; D223-W318 PolarHBondContact O-NE1 2.97Å; D223-W318 VanDerWaalsContact O-NE1 3.1Å
224	Q	69.1	Low	62	Low	38 Å²	38	56.8 Å²	56.8	18%	0.178	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-51.1	174.1	-79.1	168.2	8.5	0	0	111.6	I32 L220 L221 L222 S227 I228	I32-Q224 HydrophobicContact CD1-CB 4.3Å; I32-Q224 HydrophobicContact CD1-CG 3.72Å; I32-Q224 HydrophobicContact CG1-CG 4.09Å; I32-Q224 HydrophobicContact CG2-CB 3.75Å; I32-Q224 HydrophobicContact CG2-CG 3.78Å; L220-Q224 WeakPolarHBondContact O-CB 3.2Å; L220-Q224 WeakPolarHBondContact O-CG 3.42Å; L220-Q224 PolarHBondContact O-N 3.31Å; L221-Q224 WeakPolarHBondContact O-CB 3.34Å; L222-Q224 PolarHBondContact O-N 2.98Å; Q224-S227 PolarHBondContact O-N 2.82Å; Q224-S227 PolarHBondContact O-OG 3.38Å; Q224-I228 PolarHBondContact O-N 2.98Å
225	Q	76.4	Confident	65	Low	96 Å²	96	54.8 Å²	54.8	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-58.5	-49.6	179.7	-178.9	-179.4	-21.1	0	0	112	L221 L222 S227 I228 E229	L221-Q225 WeakPolarHBondContact O-CB 3.32Å; L221-Q225 PolarHBondContact O-N 2.95Å; L222-Q225 PolarHBondContact O-N 2.87Å; Q225-S227 VanDerWaalsContact C-N 3.29Å; Q225-S227 PolarHBondContact O-N 2.91Å; Q225-I228 PolarHBondContact O-N 3.48Å; Q225-E229 HydrophobicContact CG-CG 4.45Å; Q225-E229 WeakPolarHBondContact CG-OE1 3.41Å; Q225-E229 PolarHBondContact NE2-OE1 3.18Å; Q225-E229 PolarHBondContact O-N 3.24Å
226	Y	82.1	Confident	67.8	Low	34 Å²	34	52.3 Å²	52.3	13%	0.133	26%	0.256	C	S	.	.	H	α-helix	trans	-64	-36.1	178.8	-66	-55.2	0	0	0	112.1	L222 I228 E229 F230 T314 W318	L222-Y226 HydrophobicContact CB-CE2 4.15Å; L222-Y226 HydrophobicContact CD2-CE2 4.38Å; L222-Y226 HydrophobicContact CG-CE2 4.27Å; L222-Y226 WeakPolarHBondContact O-CD2 3.44Å; L222-Y226 PolarHBondContact O-N 3.06Å; Y226-I228 VanDerWaalsContact C-N 3.34Å; Y226-I228 PolarHBondContact O-N 2.78Å; Y226-E229 PolarHBondContact O-N 3.48Å; Y226-F230 WeakPolarHBondContact O-CB 3.38Å; Y226-F230 PolarHBondContact O-N 3.49Å; Y226-T314 HydrophobicContact CD2-CG2 4.34Å; Y226-T314 HydrophobicContact CE2-CG2 3.47Å; Y226-T314 VanDerWaalsContact CE2-CG2 3.47Å; Y226-W318 HydrophobicContact CD2-CB 4.44Å
227	S	79.4	Confident	70.6	Confident	7 Å²	7	44.3 Å²	44.3	5%	0.049	22%	0.218	C	C	.	.	H	α-helix	trans	-63.7	-39.6	175.6	86.8	0	0	0	0	112.3	S29 D223 Q224 Q225 Q231 W318	S29-S227 WeakPolarHBondContact CB-O 3.33Å; S29-S227 VanDerWaalsContact OG-C 3.3Å; S29-S227 WeakPolarHBondContact OG-CB 3.33Å; S29-S227 PolarHBondContact OG-O 3.46Å; S29-S227 VanDerWaalsContact OG-O 3.1Å; S29-S227 PolarHBondContact OG-OG 2.86Å; D223-S227 VanDerWaalsContact O-CB 3.31Å; D223-S227 WeakPolarHBondContact O-CB 3.31Å; D223-S227 PolarHBondContact O-N 2.93Å; Q224-S227 PolarHBondContact O-N 2.82Å; Q224-S227 PolarHBondContact O-OG 3.38Å; Q225-S227 VanDerWaalsContact C-N 3.29Å; Q225-S227 PolarHBondContact O-N 2.91Å; S227-Q231 PolarHBondContact O-N 2.83Å; S227-W318 VanDerWaalsContact CA-CZ2 3.45Å
228	I	81.4	Confident	73.2	Confident	32 Å²	32	45 Å²	45	16%	0.164	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-57	172.5	-67.4	170.2	0	0	0	109.6	I32 K33 Q224 Q225 Y226 F230 Q231 D232	I32-I228 HydrophobicContact CB-CD1 4.4Å; I32-I228 HydrophobicContact CG2-CD1 3.77Å; I32-I228 HydrophobicContact CG2-CG1 4.34Å; K33-I228 HydrophobicContact CB-CD1 4.16Å; K33-I228 HydrophobicContact CB-CG1 4.23Å; K33-I228 HydrophobicContact CD-CG2 4.33Å; Q224-I228 PolarHBondContact O-N 2.98Å; Q225-I228 PolarHBondContact O-N 3.48Å; Y226-I228 VanDerWaalsContact C-N 3.34Å; Y226-I228 PolarHBondContact O-N 2.78Å; I228-F230 PolarHBondContact O-N 2.8Å; I228-F230 VanDerWaalsContact O-N 3.14Å; I228-Q231 PolarHBondContact O-N 2.87Å; I228-Q231 VanDerWaalsContact O-N 3.11Å; I228-D232 WeakPolarHBondContact O-CB 3.33Å; I228-D232 PolarHBondContact O-N 2.93Å
229	E	85.7	Confident	75.9	Confident	64 Å²	64	46.3 Å²	46.3	30%	0.299	22%	0.223	S	C	.	.	H	α-helix	trans	-54.9	-36.4	-176.6	-73.9	-176.4	-156.7	0	0	112.9	Q225 Y226 D232 Q233 T309	Q225-E229 HydrophobicContact CG-CG 4.45Å; Q225-E229 WeakPolarHBondContact CG-OE1 3.41Å; Q225-E229 PolarHBondContact NE2-OE1 3.18Å; Q225-E229 PolarHBondContact O-N 3.24Å; Y226-E229 PolarHBondContact O-N 3.48Å; E229-D232 PolarHBondContact O-N 2.96Å; E229-Q233 PolarHBondContact O-N 3.06Å; E229-T309 HydrophobicContact CB-CG2 4.16Å
230	F	86.8	Confident	78.5	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-51.4	175.9	-177.5	-94	0	0	0	112.5	L26 M181 L184 Y226 I228 D232 Q233 L234 W318 L319 F323	L26-F230 HydrophobicContact CD2-CD1 4.42Å; M181-F230 HydrophobicContact CE-CD2 3.31Å; M181-F230 HydrophobicContact CE-CE2 3.66Å; M181-F230 HydrophobicContact CE-CG 4.15Å; L184-F230 HydrophobicContact CD1-CE1 4.27Å; L184-F230 HydrophobicContact CD1-CZ 3.57Å; Y226-F230 WeakPolarHBondContact O-CB 3.38Å; Y226-F230 PolarHBondContact O-N 3.49Å; I228-F230 PolarHBondContact O-N 2.8Å; I228-F230 VanDerWaalsContact O-N 3.14Å; F230-D232 VanDerWaalsContact C-N 3.28Å; F230-D232 PolarHBondContact O-N 3.49Å; F230-Q233 PolarHBondContact O-N 3.28Å; F230-L234 HydrophobicContact CD1-CD1 3.92Å; F230-L234 HydrophobicContact CE1-CD1 3.6Å; F230-L234 HydrophobicContact CE1-CG 4.49Å; F230-L234 HydrophobicContact CZ-CD1 4.29Å; F230-L234 PolarHBondContact O-N 2.86Å; F230-L234 VanDerWaalsContact O-N 3.11Å; F230-W318 HydrophobicContact CB-CH2 4.06Å; F230-W318 HydrophobicContact CB-CZ3 3.93Å; F230-W318 AromaticContact CD1-CH2 3.9Å; F230-W318 HydrophobicContact CD1-CH2 3.9Å; F230-W318 HydrophobicContact CD1-CZ3 4.07Å; F230-W318 HydrophobicContact CD2-CH2 4.37Å; F230-W318 AromaticContact CD2-CZ3 3.71Å; F230-W318 HydrophobicContact CD2-CZ3 3.71Å; F230-W318 HydrophobicContact CE1-CH2 4.38Å; F230-W318 HydrophobicContact CE1-CZ3 4.47Å; F230-W318 HydrophobicContact CE2-CZ3 4.15Å; F230-W318 AromaticContact CG-CH2 3.88Å; F230-W318 HydrophobicContact CG-CH2 3.88Å; F230-W318 AromaticContact CG-CZ3 3.65Å; F230-W318 HydrophobicContact CG-CZ3 3.65Å; F230-W318 HydrophobicContact CZ-CZ3 4.49Å; F230-L319 HydrophobicContact CE2-CD1 3.97Å; F230-F323 AromaticContact CE1-CE2 3.99Å; F230-F323 HydrophobicContact CE1-CE2 3.99Å; F230-F323 AromaticContact CE1-CZ 3.97Å; F230-F323 HydrophobicContact CE1-CZ 3.97Å; F230-F323 HydrophobicContact CE2-CE2 4.4Å; F230-F323 AromaticContact CZ-CE2 3.62Å; F230-F323 HydrophobicContact CZ-CE2 3.62Å; F230-F323 AromaticContact CZ-CZ 3.87Å; F230-F323 HydrophobicContact CZ-CZ 3.87Å
231	Q	86.4	Confident	80.6	Confident	8 Å²	8	43.8 Å²	43.8	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-56.9	-44.9	171.7	177.1	-174.6	-10.4	0	0	110.9	L26 S227 I228 Q233 L234 E235	L26-Q231 HydrophobicContact CD2-CB 3.85Å; L26-Q231 HydrophobicContact CD2-CG 4.09Å; L26-Q231 PolarHBondContact O-OE1 3.47Å; S227-Q231 PolarHBondContact O-N 2.83Å; I228-Q231 PolarHBondContact O-N 2.87Å; I228-Q231 VanDerWaalsContact O-N 3.11Å; Q231-Q233 PolarHBondContact O-N 3.43Å; Q231-L234 PolarHBondContact O-N 3.16Å; Q231-L234 VanDerWaalsContact O-N 3.11Å; Q231-E235 HydrophobicContact CG-CG 4.36Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.4Å; Q231-E235 PolarHBondContact NE2-OE1 3.3Å; Q231-E235 PolarHBondContact O-N 3.11Å
232	D	87.1	Confident	82.9	Confident	28 Å²	28	41.6 Å²	41.6	15%	0.15	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-21.9	-179.2	-120.5	55.1	0	0	0	112.7	K33 I228 E229 F230 R236	K33-D232 IonicContact NZ-OD1 2.7Å; K33-D232 PolarHBondContact NZ-OD1 2.86Å; I228-D232 WeakPolarHBondContact O-CB 3.33Å; I228-D232 PolarHBondContact O-N 2.93Å; E229-D232 PolarHBondContact O-N 2.96Å; F230-D232 VanDerWaalsContact C-N 3.28Å; F230-D232 PolarHBondContact O-N 3.49Å; D232-R236 VanDerWaalsContact CB-NH1 3.32Å; D232-R236 VanDerWaalsContact CG-NH1 3.3Å; D232-R236 WeakPolarHBondContact O-CD 3.36Å; D232-R236 WeakPolarHBondContact O-CG 3.46Å; D232-R236 PolarHBondContact O-NH1 2.96Å; D232-R236 IonicContact OD2-CZ 3.7Å; D232-R236 IonicContact OD2-NH1 3.2Å; D232-R236 PolarHBondContact OD2-NH1 3.4Å; D232-R236 IonicContact OD2-NH2 3.91Å; D232-R236 PolarHBondContact OD2-NH2 2.96Å
233	Q	89.5	Confident	84.6	Confident	21 Å²	21	40 Å²	40	10%	0.098	19%	0.191	C	C	.	.	H	α-helix	trans	-84.7	-43.7	168.3	-65.6	-32.1	-67.9	0	0	112.5	M181 E229 F230 Q231 E235 R236 I237 T309	M181-Q233 HydrophobicContact CE-CB 4.27Å; M181-Q233 HydrophobicContact SD-CB 3.82Å; M181-Q233 HydrophobicContact SD-CG 4.4Å; E229-Q233 PolarHBondContact O-N 3.06Å; F230-Q233 PolarHBondContact O-N 3.28Å; Q231-Q233 PolarHBondContact O-N 3.43Å; Q233-E235 VanDerWaalsContact C-N 3.34Å; Q233-E235 PolarHBondContact O-N 2.86Å; Q233-R236 CarbonylContact O-C 3.59Å; Q233-R236 PolarHBondContact O-N 3.08Å; Q233-R236 VanDerWaalsContact O-N 3.08Å; Q233-I237 VanDerWaalsContact O-CG1 3.3Å; Q233-I237 WeakPolarHBondContact O-CG1 3.42Å; Q233-I237 PolarHBondContact O-N 2.92Å; Q233-T309 HydrophobicContact CG-CG2 3.92Å; Q233-T309 VanDerWaalsContact CG-OG1 3.26Å; Q233-T309 WeakPolarHBondContact CG-OG1 3.3Å
234	L	88.6	Confident	86	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-56.4	-47.7	178.5	-68.4	174.2	0	0	0	111.5	L26 M181 L184 A185 F230 Q231 R236 I237 Q238	L26-L234 HydrophobicContact CD1-CD1 4.35Å; L26-L234 HydrophobicContact CD2-CD1 3.83Å; M181-L234 HydrophobicContact CG-CD2 3.89Å; M181-L234 WeakPolarHBondContact O-CD2 3.4Å; L184-L234 HydrophobicContact CB-CD2 3.91Å; A185-L234 HydrophobicContact CB-CD2 3.84Å; F230-L234 HydrophobicContact CD1-CD1 3.92Å; F230-L234 HydrophobicContact CE1-CD1 3.6Å; F230-L234 HydrophobicContact CE1-CG 4.49Å; F230-L234 HydrophobicContact CZ-CD1 4.29Å; F230-L234 PolarHBondContact O-N 2.86Å; F230-L234 VanDerWaalsContact O-N 3.11Å; Q231-L234 PolarHBondContact O-N 3.16Å; Q231-L234 VanDerWaalsContact O-N 3.11Å; L234-R236 VanDerWaalsContact C-N 3.32Å; L234-R236 PolarHBondContact O-N 3.05Å; L234-I237 PolarHBondContact O-N 2.83Å; L234-Q238 WeakPolarHBondContact O-CG 3.18Å; L234-Q238 PolarHBondContact O-N 3.47Å
235	E	87	Confident	87.2	Confident	45 Å²	45	41.4 Å²	41.4	21%	0.21	20%	0.199	C	C	.	.	H	α-helix	trans	-59.7	-41.1	175.4	-69.8	179.5	-172.7	0	0	112.1	I190 Q231 Q233 Q238 Q239	I190-E235 HydrophobicContact CD1-CG 4.38Å; Q231-E235 HydrophobicContact CG-CG 4.36Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.4Å; Q231-E235 PolarHBondContact NE2-OE1 3.3Å; Q231-E235 PolarHBondContact O-N 3.11Å; Q233-E235 VanDerWaalsContact C-N 3.34Å; Q233-E235 PolarHBondContact O-N 2.86Å; E235-Q238 PolarHBondContact O-N 3.28Å; E235-Q239 WeakPolarHBondContact O-CB 3.31Å; E235-Q239 WeakPolarHBondContact O-CG 3.29Å; E235-Q239 PolarHBondContact O-N 3.4Å
236	R	89.3	Confident	88	Confident	91 Å²	91	36.9 Å²	36.9	34%	0.343	18%	0.178	S	C	.	.	H	α-helix	trans	-72.5	-27.5	179.3	-75.3	-176.4	-172.2	102.8	3.4	114.2	D232 Q233 L234	D232-R236 VanDerWaalsContact CB-NH1 3.32Å; D232-R236 VanDerWaalsContact CG-NH1 3.3Å; D232-R236 WeakPolarHBondContact O-CD 3.36Å; D232-R236 WeakPolarHBondContact O-CG 3.46Å; D232-R236 PolarHBondContact O-NH1 2.96Å; D232-R236 IonicContact OD2-CZ 3.7Å; D232-R236 IonicContact OD2-NH1 3.2Å; D232-R236 PolarHBondContact OD2-NH1 3.4Å; D232-R236 IonicContact OD2-NH2 3.91Å; D232-R236 PolarHBondContact OD2-NH2 2.96Å; Q233-R236 CarbonylContact O-C 3.59Å; Q233-R236 PolarHBondContact O-N 3.08Å; Q233-R236 VanDerWaalsContact O-N 3.08Å; L234-R236 VanDerWaalsContact C-N 3.32Å; L234-R236 PolarHBondContact O-N 3.05Å
237	I	90.1	Very high	88.5	Confident	6 Å²	6	36.1 Å²	36.1	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-69.7	-45	171.3	-66.5	158.6	0	0	0	108.8	M181 L182 A185 Q233 L234 Q239 L240 L242 L306	M181-I237 HydrophobicContact CG-CD1 4.18Å; M181-I237 HydrophobicContact SD-CD1 4.35Å; L182-I237 HydrophobicContact CD2-CD1 4.33Å; L182-I237 HydrophobicContact CD2-CG2 4.12Å; A185-I237 HydrophobicContact CB-CB 3.96Å; A185-I237 HydrophobicContact CB-CD1 4.2Å; A185-I237 HydrophobicContact CB-CG2 3.57Å; Q233-I237 VanDerWaalsContact O-CG1 3.3Å; Q233-I237 WeakPolarHBondContact O-CG1 3.42Å; Q233-I237 PolarHBondContact O-N 2.92Å; L234-I237 PolarHBondContact O-N 2.83Å; I237-Q239 PolarHBondContact O-N 3.12Å; I237-L240 VanDerWaalsContact O-CB 3.27Å; I237-L240 WeakPolarHBondContact O-CB 3.26Å; I237-L240 WeakPolarHBondContact O-CD1 3.3Å; I237-L240 WeakPolarHBondContact O-CG 3.14Å; I237-L240 PolarHBondContact O-N 3.26Å; I237-L242 HydrophobicContact CG2-CD1 3.87Å; I237-L306 HydrophobicContact CD1-CD1 3.88Å; I237-L306 HydrophobicContact CD1-CG 4.29Å
238	Q	87.1	Confident	89.3	Confident	27 Å²	27	35.9 Å²	35.9	13%	0.126	17%	0.173	C	C	.	.	H	α-helix	trans	-67.4	-35.5	-179.7	-68.5	-179.8	-17.4	0	0	113.2	A185 Y188 I190 L234 E235 L240 N241	A185-Q238 HydrophobicContact CB-CG 4.45Å; A185-Q238 PolarHBondContact O-NE2 3.2Å; Y188-Q238 PolarHBondContact O-NE2 3.07Å; I190-Q238 HydrophobicContact CD1-CB 4.27Å; I190-Q238 VanDerWaalsContact CG1-OE1 3.29Å; L234-Q238 WeakPolarHBondContact O-CG 3.18Å; L234-Q238 PolarHBondContact O-N 3.47Å; E235-Q238 PolarHBondContact O-N 3.28Å; Q238-L240 PolarHBondContact O-N 3.22Å; Q238-N241 PolarHBondContact O-N 3.44Å
239	Q	88.6	Confident	90	Very high	122 Å²	122	35.1 Å²	35.1	57%	0.57	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.3	173	-75.6	164.4	15.7	0	0	114.5	E235 I237 N241	E235-Q239 WeakPolarHBondContact O-CB 3.31Å; E235-Q239 WeakPolarHBondContact O-CG 3.29Å; E235-Q239 PolarHBondContact O-N 3.4Å; I237-Q239 PolarHBondContact O-N 3.12Å; Q239-N241 VanDerWaalsContact C-N 3.28Å; Q239-N241 PolarHBondContact O-ND2 3.47Å
240	L	88.8	Confident	90.5	Very high	9 Å²	9	32.3 Å²	32.3	5%	0.047	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-24	172.6	-55.6	163.4	0	0	0	112.1	I237 Q238 L242 R295 L299 R302	I237-L240 VanDerWaalsContact O-CB 3.27Å; I237-L240 WeakPolarHBondContact O-CB 3.26Å; I237-L240 WeakPolarHBondContact O-CD1 3.3Å; I237-L240 WeakPolarHBondContact O-CG 3.14Å; I237-L240 PolarHBondContact O-N 3.26Å; Q238-L240 PolarHBondContact O-N 3.22Å; L240-L242 HydrophobicContact CB-CD2 3.74Å; L240-L242 HydrophobicContact CB-CG 3.98Å; L240-L242 HydrophobicContact CD1-CD1 4.3Å; L240-L242 HydrophobicContact CD1-CD2 3.89Å; L240-L242 HydrophobicContact CD1-CG 4.17Å; L240-L242 HydrophobicContact CG-CD2 4.46Å; L240-R295 PolarHBondContact O-NH1 3.07Å; L240-R295 PolarHBondContact O-NH2 3.3Å; L240-L299 HydrophobicContact CD1-CD2 4.4Å; L240-R302 HydrophobicContact CD1-CG 3.65Å; L240-R302 HydrophobicContact CD2-CG 4.16Å; L240-R302 HydrophobicContact CG-CG 4.49Å
241	N	89.3	Confident	90.9	Very high	127 Å²	127	32.1 Å²	32.1	68%	0.679	16%	0.156	S	C	*	.			trans	50.9	65.9	-167.4	-60.4	-85.5	0	0	0	110.5	Q238 Q239 R295	Q238-N241 PolarHBondContact O-N 3.44Å; Q239-N241 VanDerWaalsContact C-N 3.28Å; Q239-N241 PolarHBondContact O-ND2 3.47Å; N241-R295 PolarHBondContact O-NH2 3.34Å
242	L	91.5	Very high	91.4	Very high	21 Å²	21	31.7 Å²	31.7	11%	0.11	16%	0.155	C	C	.	.			trans	-70.3	136.6	-179.9	-60.6	178	0	0	0	111.3	I237 L240 E246 Y247 L250 L299	I237-L242 HydrophobicContact CG2-CD1 3.87Å; L240-L242 HydrophobicContact CB-CD2 3.74Å; L240-L242 HydrophobicContact CB-CG 3.98Å; L240-L242 HydrophobicContact CD1-CD1 4.3Å; L240-L242 HydrophobicContact CD1-CD2 3.89Å; L240-L242 HydrophobicContact CD1-CG 4.17Å; L240-L242 HydrophobicContact CG-CD2 4.46Å; L242-E246 VanDerWaalsContact CA-OE2 3.25Å; L242-E246 WeakPolarHBondContact CA-OE2 3.47Å; L242-E246 HydrophobicContact CD2-CB 4.31Å; L242-Y247 HydrophobicContact CB-CD2 3.69Å; L242-Y247 HydrophobicContact CB-CE1 4.43Å; L242-Y247 HydrophobicContact CB-CE2 3.51Å; L242-Y247 HydrophobicContact CB-CG 4.24Å; L242-Y247 HydrophobicContact CD1-CD1 3.93Å; L242-Y247 HydrophobicContact CD1-CD2 4.49Å; L242-Y247 HydrophobicContact CD1-CE1 3.65Å; L242-Y247 HydrophobicContact CD1-CE2 4.26Å; L242-Y247 HydrophobicContact CD1-CG 4.34Å; L242-Y247 HydrophobicContact CG-CE2 4.46Å; L242-L250 HydrophobicContact CD1-CD1 3.79Å; L242-L250 HydrophobicContact CD2-CD1 3.98Å; L242-L299 HydrophobicContact CD2-CD2 3.37Å
243	D	91.1	Very high	91.9	Very high	33 Å²	33	30.8 Å²	30.8	18%	0.176	15%	0.149	C	C	.	.			trans	-86.5	171.3	166.2	82.5	69.9	0	0	0	112.2	S245 E246 Y247 Y283 Y288	D243-S245 VanDerWaalsContact C-N 3.27Å; D243-S245 PolarHBondContact O-N 2.91Å; D243-S245 WeakPolarHBondContact OD1-CA 3.25Å; D243-S245 WeakPolarHBondContact OD1-CB 3.42Å; D243-S245 PolarHBondContact OD1-N 3.13Å; D243-S245 PolarHBondContact OD1-OG 3.48Å; D243-E246 PolarHBondContact N-OE2 3.34Å; D243-E246 PolarHBondContact O-N 2.77Å; D243-E246 PolarHBondContact OD1-N 3.21Å; D243-E246 WeakPolarHBondContact OD2-CG 3.3Å; D243-Y247 WeakPolarHBondContact O-CD2 3.18Å; D243-Y247 PolarHBondContact O-N 3.39Å; D243-Y283 PolarHBondContact OD1-OH 2.95Å; D243-Y283 VanDerWaalsContact OD2-CE1 3.28Å; D243-Y283 WeakPolarHBondContact OD2-CE1 3.48Å; D243-Y283 PolarHBondContact OD2-OH 2.76Å; D243-Y288 PolarHBondContact OD2-OH 3.09Å; D243-Y288 VanDerWaalsContact OD2-OH 3.13Å
244	Q	91	Very high	92.2	Very high	75 Å²	75	30.1 Å²	30.1	35%	0.35	15%	0.146	S	C	.	.	H	α-helix	trans	-65.9	-26.8	-173.4	-169.5	56.8	79.7	0	0	113.7	L3 E6 Q186 V248	L3-Q244 HydrophobicContact CD2-CB 4.34Å; L3-Q244 HydrophobicContact CD2-CG 3.86Å; L3-Q244 WeakPolarHBondContact CD2-O 3.42Å; E6-Q244 PolarHBondContact OE1-NE2 3.34Å; E6-Q244 VanDerWaalsContact OE1-NE2 3.11Å; Q186-Q244 VanDerWaalsContact NE2-OE1 3.08Å; Q244-V248 WeakPolarHBondContact O-CG1 3.48Å; Q244-V248 PolarHBondContact O-N 3.16Å
245	S	93.3	Very high	92.6	Very high	19 Å²	19	30 Å²	30	13%	0.133	15%	0.146	C	C	.	.	H	α-helix	trans	-73.2	-47.9	176.3	-29.3	0	0	0	0	110.3	D243 V248 C249 Y283	D243-S245 VanDerWaalsContact C-N 3.27Å; D243-S245 PolarHBondContact O-N 2.91Å; D243-S245 WeakPolarHBondContact OD1-CA 3.25Å; D243-S245 WeakPolarHBondContact OD1-CB 3.42Å; D243-S245 PolarHBondContact OD1-N 3.13Å; D243-S245 PolarHBondContact OD1-OG 3.48Å; S245-V248 VanDerWaalsContact O-CG2 3.23Å; S245-V248 WeakPolarHBondContact O-CG2 3.44Å; S245-V248 PolarHBondContact O-N 3.13Å; S245-C249 WeakPolarHBondContact O-CB 3.44Å; S245-C249 PolarHBondContact O-N 3.44Å; S245-Y283 VanDerWaalsContact OG-CZ 3.25Å; S245-Y283 PolarHBondContact OG-OH 3.21Å
246	E	94.6	Very high	93.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-43.3	175.8	-61.4	173.2	130.1	0	0	111.3	L242 D243 V248 C249 L250 L280 Y283 R295 L299	L242-E246 VanDerWaalsContact CA-OE2 3.25Å; L242-E246 WeakPolarHBondContact CA-OE2 3.47Å; L242-E246 HydrophobicContact CD2-CB 4.31Å; D243-E246 PolarHBondContact N-OE2 3.34Å; D243-E246 PolarHBondContact O-N 2.77Å; D243-E246 PolarHBondContact OD1-N 3.21Å; D243-E246 WeakPolarHBondContact OD2-CG 3.3Å; E246-V248 PolarHBondContact O-N 3.36Å; E246-C249 PolarHBondContact O-N 2.87Å; E246-L250 WeakPolarHBondContact O-CB 3.34Å; E246-L250 VanDerWaalsContact O-CG 3.31Å; E246-L250 WeakPolarHBondContact O-CG 3.41Å; E246-L250 PolarHBondContact O-N 3.14Å; E246-L280 HydrophobicContact CB-CD1 4.49Å; E246-L280 HydrophobicContact CG-CD1 4.19Å; E246-Y283 HydrophobicContact CG-CE1 4.32Å; E246-R295 IonicContact OE1-CZ 3.09Å; E246-R295 IonicContact OE1-NE 3.69Å; E246-R295 PolarHBondContact OE1-NE 3.44Å; E246-R295 IonicContact OE1-NH2 2.7Å; E246-R295 PolarHBondContact OE1-NH2 3.38Å; E246-R295 IonicContact OE2-CZ 2.68Å; E246-R295 IonicContact OE2-NE 2.6Å; E246-R295 IonicContact OE2-NH2 2.69Å; E246-R295 PolarHBondContact OE2-NH2 2.65Å; E246-L299 HydrophobicContact CB-CD1 4.34Å; E246-L299 HydrophobicContact CG-CD1 4.14Å
247	Y	93	Very high	93.4	Very high	19 Å²	19	25 Å²	25	8%	0.075	13%	0.127	C	C	.	.	H	α-helix	trans	-55.5	-49.2	174	-94.3	-63.5	0	0	0	111.9	A185 Q186 L242 D243 L250 K251	A185-Y247 PolarHBondContact O-OH 2.87Å; Q186-Y247 HydrophobicContact CB-CD1 4.31Å; Q186-Y247 HydrophobicContact CB-CE1 3.87Å; Q186-Y247 HydrophobicContact CB-CE2 4.36Å; Q186-Y247 HydrophobicContact CG-CD1 4.41Å; Q186-Y247 HydrophobicContact CG-CD2 4.22Å; Q186-Y247 HydrophobicContact CG-CE1 4.31Å; Q186-Y247 HydrophobicContact CG-CE2 4.08Å; Q186-Y247 HydrophobicContact CG-CG 4.38Å; L242-Y247 HydrophobicContact CB-CD2 3.69Å; L242-Y247 HydrophobicContact CB-CE1 4.43Å; L242-Y247 HydrophobicContact CB-CE2 3.51Å; L242-Y247 HydrophobicContact CB-CG 4.24Å; L242-Y247 HydrophobicContact CD1-CD1 3.93Å; L242-Y247 HydrophobicContact CD1-CD2 4.49Å; L242-Y247 HydrophobicContact CD1-CE1 3.65Å; L242-Y247 HydrophobicContact CD1-CE2 4.26Å; L242-Y247 HydrophobicContact CD1-CG 4.34Å; L242-Y247 HydrophobicContact CG-CE2 4.46Å; D243-Y247 WeakPolarHBondContact O-CD2 3.18Å; D243-Y247 PolarHBondContact O-N 3.39Å; Y247-L250 PolarHBondContact O-N 3.24Å; Y247-K251 WeakPolarHBondContact O-CB 3.48Å; Y247-K251 VanDerWaalsContact O-CG 3.28Å; Y247-K251 WeakPolarHBondContact O-CG 3.23Å; Y247-K251 PolarHBondContact O-N 2.86Å
248	V	94.6	Very high	93.6	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-71.8	-30.3	-179.2	-59.7	0	0	0	0	113.1	L2 L3 E6 Q244 S245 E246 A252	L2-V248 HydrophobicContact CB-CB 3.93Å; L2-V248 HydrophobicContact CB-CG2 3.61Å; L3-V248 HydrophobicContact CD2-CG1 4.33Å; L3-V248 HydrophobicContact CD2-CG2 3.85Å; L3-V248 HydrophobicContact CG-CG2 3.96Å; E6-V248 HydrophobicContact CB-CG1 3.64Å; E6-V248 HydrophobicContact CG-CG1 3.7Å; E6-V248 WeakPolarHBondContact OE2-CG1 3.29Å; Q244-V248 WeakPolarHBondContact O-CG1 3.48Å; Q244-V248 PolarHBondContact O-N 3.16Å; S245-V248 VanDerWaalsContact O-CG2 3.23Å; S245-V248 WeakPolarHBondContact O-CG2 3.44Å; S245-V248 PolarHBondContact O-N 3.13Å; E246-V248 PolarHBondContact O-N 3.36Å; V248-A252 VanDerWaalsContact O-CB 3.28Å; V248-A252 WeakPolarHBondContact O-CB 3.38Å; V248-A252 PolarHBondContact O-N 3.05Å
249	C	96.3	Very high	93.9	Very high	16 Å²	16	31 Å²	31	11%	0.108	16%	0.157	C	C	.	.	H	α-helix	trans	-66.7	-45	171.4	-79.1	0	0	0	0	111.6	S245 E246 A252 L253 I276 L280	S245-C249 WeakPolarHBondContact O-CB 3.44Å; S245-C249 PolarHBondContact O-N 3.44Å; E246-C249 PolarHBondContact O-N 2.87Å; C249-A252 PolarHBondContact O-N 3.4Å; C249-A252 VanDerWaalsContact O-N 3.15Å; C249-L253 WeakPolarHBondContact O-CG 3.47Å; C249-L253 PolarHBondContact O-N 2.91Å; C249-I276 HydrophobicContact CB-CG2 4.34Å; C249-L280 HydrophobicContact CB-CB 4.18Å; C249-L280 HydrophobicContact CB-CD1 3.88Å; C249-L280 HydrophobicContact CB-CD2 4.16Å; C249-L280 HydrophobicContact CB-CG 4.29Å
250	L	96.3	Very high	94.1	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-65.4	-42.5	176.9	-69.5	169.3	0	0	0	111.9	L182 L242 E246 Y247 A252 L253 I254 L299 L303	L182-L250 HydrophobicContact CD1-CB 3.99Å; L242-L250 HydrophobicContact CD1-CD1 3.79Å; L242-L250 HydrophobicContact CD2-CD1 3.98Å; E246-L250 WeakPolarHBondContact O-CB 3.34Å; E246-L250 VanDerWaalsContact O-CG 3.31Å; E246-L250 WeakPolarHBondContact O-CG 3.41Å; E246-L250 PolarHBondContact O-N 3.14Å; Y247-L250 PolarHBondContact O-N 3.24Å; L250-A252 VanDerWaalsContact C-N 3.27Å; L250-A252 PolarHBondContact O-N 3.45Å; L250-L253 HydrophobicContact CD2-CD1 4.49Å; L250-L253 PolarHBondContact O-N 3.45Å; L250-I254 WeakPolarHBondContact O-CD1 3.26Å; L250-I254 WeakPolarHBondContact O-CG1 3.5Å; L250-I254 PolarHBondContact O-N 3.29Å; L250-I254 VanDerWaalsContact O-N 3.1Å; L250-L299 HydrophobicContact CD2-CB 4.33Å; L250-L303 HydrophobicContact CD2-CD1 4.16Å; L250-L303 HydrophobicContact CD2-CD2 3.84Å; L250-L303 HydrophobicContact CD2-CG 4.1Å
251	K	95.3	Very high	94.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-55.5	-43.8	169.6	-70.5	175	-170.7	-178.2	0	111.1	E6 W153 L179 L182 Y183 Q186 Y247 I254 L255	E6-K251 IonicContact OE1-NZ 2.63Å; E6-K251 PolarHBondContact OE1-NZ 2.81Å; E6-K251 IonicContact OE2-NZ 2.95Å; E6-K251 PolarHBondContact OE2-NZ 2.95Å; W153-K251 HydrophobicContact CH2-CB 3.44Å; W153-K251 VanDerWaalsContact CH2-CB 3.44Å; W153-K251 HydrophobicContact CZ2-CB 3.59Å; W153-K251 HydrophobicContact CZ2-CD 4.27Å; W153-K251 HydrophobicContact CZ3-CB 4.12Å; L179-K251 HydrophobicContact CD2-CB 3.86Å; L179-K251 HydrophobicContact CD2-CG 4.18Å; L179-K251 WeakPolarHBondContact CD2-O 3.5Å; L182-K251 HydrophobicContact CB-CG 4.49Å; L182-K251 HydrophobicContact CD1-CB 4.48Å; L182-K251 HydrophobicContact CD1-CG 3.83Å; Y183-K251 HydrophobicContact CE2-CD 3.94Å; Y183-K251 PolarHBondContact OH-NZ 2.86Å; Q186-K251 VanDerWaalsContact OE1-CE 3.27Å; Y247-K251 WeakPolarHBondContact O-CB 3.48Å; Y247-K251 VanDerWaalsContact O-CG 3.28Å; Y247-K251 WeakPolarHBondContact O-CG 3.23Å; Y247-K251 PolarHBondContact O-N 2.86Å; K251-I254 PolarHBondContact O-N 3.2Å; K251-L255 WeakPolarHBondContact O-CB 3.42Å; K251-L255 PolarHBondContact O-N 3.36Å
252	A	97	Very high	94.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70	-37.7	-179.1	0	0	0	0	0	113	L2 W153 V248 C249 L250 I254 L255 F256 I276	L2-A252 HydrophobicContact CD1-CB 3.66Å; L2-A252 HydrophobicContact CD2-CB 3.81Å; L2-A252 HydrophobicContact CG-CB 4.4Å; W153-A252 HydrophobicContact CH2-CB 4.33Å; V248-A252 VanDerWaalsContact O-CB 3.28Å; V248-A252 WeakPolarHBondContact O-CB 3.38Å; V248-A252 PolarHBondContact O-N 3.05Å; C249-A252 PolarHBondContact O-N 3.4Å; C249-A252 VanDerWaalsContact O-N 3.15Å; L250-A252 VanDerWaalsContact C-N 3.27Å; L250-A252 PolarHBondContact O-N 3.45Å; A252-I254 VanDerWaalsContact C-N 3.26Å; A252-I254 PolarHBondContact O-N 3.06Å; A252-L255 PolarHBondContact O-N 2.95Å; A252-F256 HydrophobicContact CB-CD2 4.37Å; A252-F256 VanDerWaalsContact O-CD2 3.27Å; A252-F256 WeakPolarHBondContact O-CD2 3.29Å; A252-F256 PolarHBondContact O-N 2.95Å; A252-I276 HydrophobicContact CB-CD1 3.75Å; A252-I276 HydrophobicContact CB-CG1 4.39Å; A252-I276 HydrophobicContact CB-CG2 4.17Å
253	L	97.2	Very high	94.6	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.042	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-32.7	173.6	-68.2	173.6	0	0	0	112.6	C249 L250 Q273 I276 Q277 L280 L300 L303	C249-L253 WeakPolarHBondContact O-CG 3.47Å; C249-L253 PolarHBondContact O-N 2.91Å; L250-L253 HydrophobicContact CD2-CD1 4.49Å; L250-L253 PolarHBondContact O-N 3.45Å; L253-Q273 HydrophobicContact CD2-CG 3.58Å; L253-I276 HydrophobicContact CD2-CB 3.89Å; L253-I276 HydrophobicContact CD2-CG2 3.65Å; L253-I276 HydrophobicContact CG-CG2 3.73Å; L253-Q277 HydrophobicContact CD1-CG 4.49Å; L253-Q277 HydrophobicContact CD2-CG 3.54Å; L253-L280 HydrophobicContact CD1-CD2 4.21Å; L253-L300 HydrophobicContact CD1-CD2 3.63Å; L253-L303 HydrophobicContact CB-CD1 3.89Å; L253-L303 HydrophobicContact CD1-CD1 4.03Å
254	I	96.7	Very high	94.8	Very high	7 Å²	7	31 Å²	31	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-73.7	-42.6	174.1	-70.8	165.1	0	0	0	111.5	S175 E178 L179 L182 L250 K251 A252 L303 L306	S175-I254 WeakPolarHBondContact CB-O 3.48Å; E178-I254 HydrophobicContact CB-CD1 4.25Å; E178-I254 HydrophobicContact CB-CG1 4.49Å; E178-I254 HydrophobicContact CB-CG2 3.44Å; E178-I254 VanDerWaalsContact CB-CG2 3.44Å; E178-I254 HydrophobicContact CG-CG2 4.41Å; L179-I254 HydrophobicContact CD2-CB 4.02Å; L179-I254 HydrophobicContact CD2-CG2 3.72Å; L179-I254 HydrophobicContact CG-CG2 3.81Å; L182-I254 HydrophobicContact CD1-CD1 3.5Å; L182-I254 HydrophobicContact CG-CD1 4.03Å; L250-I254 WeakPolarHBondContact O-CD1 3.26Å; L250-I254 WeakPolarHBondContact O-CG1 3.5Å; L250-I254 PolarHBondContact O-N 3.29Å; L250-I254 VanDerWaalsContact O-N 3.1Å; K251-I254 PolarHBondContact O-N 3.2Å; A252-I254 VanDerWaalsContact C-N 3.26Å; A252-I254 PolarHBondContact O-N 3.06Å; I254-L303 HydrophobicContact CD1-CD2 3.74Å; I254-L303 HydrophobicContact CG1-CD2 3.75Å; I254-L306 HydrophobicContact CD1-CD1 4.26Å
255	L	97.1	Very high	95	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.5	-47.2	178.7	179.8	65.9	0	0	0	111.9	W153 A154 I157 F160 L171 L172 L179 K251 A252 N257	W153-L255 HydrophobicContact CE3-CD2 4.49Å; W153-L255 HydrophobicContact CH2-CB 4.41Å; W153-L255 HydrophobicContact CH2-CD2 4.18Å; W153-L255 HydrophobicContact CZ3-CB 4.17Å; W153-L255 HydrophobicContact CZ3-CD2 3.7Å; W153-L255 HydrophobicContact CZ3-CG 4.46Å; A154-L255 HydrophobicContact CB-CD1 4.45Å; A154-L255 HydrophobicContact CB-CD2 3.88Å; I157-L255 HydrophobicContact CD1-CD2 4.28Å; F160-L255 HydrophobicContact CD2-CD1 4.3Å; F160-L255 HydrophobicContact CD2-CD2 3.77Å; F160-L255 HydrophobicContact CD2-CG 4.17Å; F160-L255 HydrophobicContact CE2-CD1 3.93Å; F160-L255 HydrophobicContact CE2-CD2 4.21Å; F160-L255 HydrophobicContact CE2-CG 4.31Å; F160-L255 HydrophobicContact CG-CD2 4.39Å; L171-L255 HydrophobicContact CB-CD1 4.38Å; L171-L255 WeakPolarHBondContact CD2-O 3.36Å; L172-L255 HydrophobicContact CD2-CD1 4Å; L172-L255 HydrophobicContact CG-CD1 4.41Å; L179-L255 HydrophobicContact CD1-CD1 4.35Å; K251-L255 WeakPolarHBondContact O-CB 3.42Å; K251-L255 PolarHBondContact O-N 3.36Å; A252-L255 PolarHBondContact O-N 2.95Å; L255-N257 VanDerWaalsContact C-N 3.29Å; L255-N257 PolarHBondContact O-N 2.87Å; L255-N257 VanDerWaalsContact O-N 3.11Å
256	F	97.1	Very high	95.2	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	-88.3	63	-179.2	-64.2	-74.1	0	0	0	111.2	I157 L159 F160 L163 L171 A252 V269 I272 Q273 I276	I157-F256 HydrophobicContact CG2-CE2 4.31Å; I157-F256 HydrophobicContact CG2-CZ 4.08Å; L159-F256 HydrophobicContact CB-CZ 4.2Å; F160-F256 HydrophobicContact CB-CE1 4.16Å; F160-F256 HydrophobicContact CB-CZ 3.83Å; F160-F256 HydrophobicContact CD2-CE1 4.32Å; L163-F256 HydrophobicContact CD1-CD1 4.29Å; L163-F256 HydrophobicContact CD1-CE1 3.97Å; L171-F256 HydrophobicContact CD1-CD1 4.23Å; A252-F256 HydrophobicContact CB-CD2 4.37Å; A252-F256 VanDerWaalsContact O-CD2 3.27Å; A252-F256 WeakPolarHBondContact O-CD2 3.29Å; A252-F256 PolarHBondContact O-N 2.95Å; F256-V269 VanDerWaalsContact C-CG1 3.49Å; F256-V269 HydrophobicContact CB-CG1 3.95Å; F256-V269 HydrophobicContact CD1-CG1 4.46Å; F256-I272 HydrophobicContact CB-CG2 4.27Å; F256-I272 HydrophobicContact CD1-CB 4.29Å; F256-I272 HydrophobicContact CD1-CD1 4.25Å; F256-I272 HydrophobicContact CD1-CG2 3.69Å; F256-I272 HydrophobicContact CD2-CG2 3.69Å; F256-I272 HydrophobicContact CE1-CD1 4.06Å; F256-I272 HydrophobicContact CE1-CG2 3.83Å; F256-I272 HydrophobicContact CE2-CG2 3.84Å; F256-I272 HydrophobicContact CG-CB 4.44Å; F256-I272 HydrophobicContact CG-CG2 3.61Å; F256-I272 HydrophobicContact CZ-CG2 3.9Å; F256-Q273 PolarHBondContact O-NE2 3.24Å; F256-I276 HydrophobicContact CD2-CD1 3.53Å; F256-I276 HydrophobicContact CE2-CD1 4.09Å; F256-I276 HydrophobicContact CG-CD1 4.33Å
257	N	94.9	Very high	95.3	Very high	29 Å²	29	36.7 Å²	36.7	16%	0.155	21%	0.213	C	C	.	.			trans	-92.9	101	174.6	174.4	92	0	0	0	110.6	L171 L255 E259 A260 K307	L171-N257 WeakPolarHBondContact CD2-O 3.48Å; L255-N257 VanDerWaalsContact C-N 3.29Å; L255-N257 PolarHBondContact O-N 2.87Å; L255-N257 VanDerWaalsContact O-N 3.11Å; N257-E259 VanDerWaalsContact C-N 3.26Å; N257-E259 PolarHBondContact O-N 3Å; N257-A260 PolarHBondContact ND2-N 3.47Å; N257-A260 VanDerWaalsContact O-CB 3.27Å; N257-A260 WeakPolarHBondContact O-CB 3.1Å; N257-A260 PolarHBondContact O-N 2.87Å; N257-K307 PolarHBondContact OD1-NZ 3.29Å
258	S	95.5	Very high	95.4	Very high	16 Å²	16	39 Å²	39	11%	0.112	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.8	177.5	45.1	0	0	0	0	114	A260 L263 D270	S258-A260 PolarHBondContact O-N 3.44Å; S258-L263 WeakPolarHBondContact O-CD1 3.48Å; S258-D270 WeakPolarHBondContact CB-OD1 3.45Å; S258-D270 PolarHBondContact OG-OD1 3.49Å
259	E	93.6	Very high	95.5	Very high	143 Å²	143	38.9 Å²	38.9	67%	0.668	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	18.9	172.5	-60.7	-73.3	-176.7	0	0	113.2	N257	N257-E259 VanDerWaalsContact C-N 3.26Å; N257-E259 PolarHBondContact O-N 3Å
260	A	92.6	Very high	95.6	Very high	6 Å²	6	41.3 Å²	41.3	5%	0.05	24%	0.238	C	C	.	.			trans	-84.1	128.8	178.2	0	0	0	0	0	110.2	I170 L171 N174 N257 S258 G262 L263	I170-A260 HydrophobicContact CG2-CB 4.02Å; L171-A260 HydrophobicContact CD2-CB 4.17Å; N174-A260 HydrophobicContact CB-CB 4.43Å; N257-A260 PolarHBondContact ND2-N 3.47Å; N257-A260 VanDerWaalsContact O-CB 3.27Å; N257-A260 WeakPolarHBondContact O-CB 3.1Å; N257-A260 PolarHBondContact O-N 2.87Å; S258-A260 PolarHBondContact O-N 3.44Å; A260-G262 PolarHBondContact O-N 3.46Å; A260-L263 HydrophobicContact CB-CD1 3.98Å; A260-L263 HydrophobicContact CB-CG 4.08Å; A260-L263 WeakPolarHBondContact O-CG 3.49Å
261	P	92.1	Very high	95.6	Very high	95 Å²	95	43.2 Å²	43.2	62%	0.617	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	127.8	-175.5	26.9	-34.3	0	0	0	111.5	I170	I170-P261 WeakPolarHBondContact CG2-O 3.34Å
262	G	92.7	Very high	95.7	Very high	60 Å²	60	43.4 Å²	43.4	62%	0.619	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	1.9	173.7	0	0	0	0	0	116.3	I170 A260	I170-G262 WeakPolarHBondContact CD1-O 3.44Å; A260-G262 PolarHBondContact O-N 3.46Å
263	L	95.5	Very high	95.6	Very high	23 Å²	23	45.4 Å²	45.4	12%	0.12	26%	0.261	C	S	.	.			trans	-57.5	144.5	170.9	-65.5	177.5	0	0	0	111.7	D167 I170 L171 S258 A260 P266 V269	D167-L263 HydrophobicContact CB-CD2 3.77Å; I170-L263 HydrophobicContact CB-CD2 4.18Å; I170-L263 HydrophobicContact CG2-CD2 3.78Å; I170-L263 HydrophobicContact CG2-CG 4.21Å; L171-L263 HydrophobicContact CD2-CD1 4.07Å; L171-L263 HydrophobicContact CD2-CD2 3.94Å; L171-L263 HydrophobicContact CG-CD2 4.02Å; S258-L263 WeakPolarHBondContact O-CD1 3.48Å; A260-L263 HydrophobicContact CB-CD1 3.98Å; A260-L263 HydrophobicContact CB-CG 4.08Å; A260-L263 WeakPolarHBondContact O-CG 3.49Å; L263-P266 HydrophobicContact CB-CB 4.45Å; L263-P266 HydrophobicContact CD1-CB 4.33Å; L263-V269 HydrophobicContact CD1-CG2 4.23Å
264	K	95.5	Very high	95.6	Very high	129 Å²	129	51.2 Å²	51.2	56%	0.561	29%	0.288	S	S	*	.	S	Bend	trans	-89.3	-36.2	175.5	-67.9	171.5	175.5	159.1	0	112.2	H164 S166 D167	H164-K264 PolarHBondContact CE1-NZ 3.16Å; H164-K264 PolarHBondContact ND1-NZ 3.19Å; H164-K264 PolarHBondContact NE2-NZ 2.93Å; S166-K264 WeakPolarHBondContact OG-CE 3.1Å; S166-K264 PolarHBondContact OG-NZ 3.05Å; D167-K264 WeakPolarHBondContact OD2-CA 3.34Å; D167-K264 WeakPolarHBondContact OD2-CB 3.47Å; D167-K264 PolarHBondContact OD2-N 3.19Å
265	D	94.8	Very high	95.6	Very high	66 Å²	66	58.2 Å²	58.2	35%	0.353	31%	0.314	S	S	.	.			trans	-128.9	74.8	174.8	-165.3	-13.7	0	0	0	111.4	D167 T267 L268 V269	D167-D265 PolarHBondContact OD2-N 3.14Å; D265-T267 PolarHBondContact O-N 3.16Å; D265-T267 PolarHBondContact OD1-N 3.33Å; D265-T267 VanDerWaalsContact OD1-N 3.16Å; D265-T267 PolarHBondContact OD1-OG1 3.49Å; D265-L268 HydrophobicContact CB-CB 4.16Å; D265-L268 VanDerWaalsContact CG-CB 3.42Å; D265-L268 PolarHBondContact O-N 2.91Å; D265-L268 PolarHBondContact OD1-N 3.42Å; D265-L268 WeakPolarHBondContact OD2-CB 3.25Å; D265-V269 PolarHBondContact O-N 3.43Å
266	P	96.2	Very high	95.6	Very high	48 Å²	48	58.6 Å²	58.6	31%	0.312	32%	0.316	S	S	.	.	H	α-helix	trans	-61.4	-28.7	171.6	26.5	-34.2	0	0	0	111.9	L263 L268 V269 D270	L263-P266 HydrophobicContact CB-CB 4.45Å; L263-P266 HydrophobicContact CD1-CB 4.33Å; P266-L268 PolarHBondContact O-N 3.23Å; P266-V269 CarbonylContact O-C 3.57Å; P266-V269 WeakPolarHBondContact O-CA 3.36Å; P266-V269 WeakPolarHBondContact O-CB 3.46Å; P266-V269 PolarHBondContact O-N 3.04Å; P266-V269 VanDerWaalsContact O-N 3.09Å; P266-D270 PolarHBondContact O-N 3.12Å
267	T	96.7	Very high	95.5	Very high	100 Å²	100	61.7 Å²	61.7	61%	0.613	33%	0.331	S	S	*	.	H	α-helix	trans	-69.1	-32.5	-177.7	59.4	0	0	0	0	113.3	D265 S271	D265-T267 PolarHBondContact O-N 3.16Å; D265-T267 PolarHBondContact OD1-N 3.33Å; D265-T267 VanDerWaalsContact OD1-N 3.16Å; D265-T267 PolarHBondContact OD1-OG1 3.49Å; T267-S271 PolarHBondContact O-N 2.92Å; T267-S271 VanDerWaalsContact O-N 3.11Å
268	L	96.5	Very high	95.6	Very high	66 Å²	66	64.2 Å²	64.2	35%	0.346	35%	0.349	S	S	.	.	H	α-helix	trans	-66.9	-42.1	169.3	179.4	57.1	0	0	0	110.8	L163 D265 P266 S271 I272	L163-L268 HydrophobicContact CD2-CD2 3.63Å; L163-L268 HydrophobicContact CD2-CG 3.85Å; D265-L268 HydrophobicContact CB-CB 4.16Å; D265-L268 VanDerWaalsContact CG-CB 3.42Å; D265-L268 PolarHBondContact O-N 2.91Å; D265-L268 PolarHBondContact OD1-N 3.42Å; D265-L268 WeakPolarHBondContact OD2-CB 3.25Å; P266-L268 PolarHBondContact O-N 3.23Å; L268-S271 PolarHBondContact O-N 3.31Å; L268-S271 PolarHBondContact O-OG 2.91Å; L268-I272 HydrophobicContact CD1-CD1 4.32Å; L268-I272 HydrophobicContact CG-CD1 4.17Å; L268-I272 WeakPolarHBondContact O-CG1 3.43Å; L268-I272 PolarHBondContact O-N 2.94Å
269	V	97.1	Very high	95.7	Very high	1 Å²	1	65.9 Å²	65.9	1%	0.006	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-43.4	176.6	-178.9	0	0	0	0	111.4	L163 L171 F256 L263 D265 P266 S271 I272 Q273	L163-V269 HydrophobicContact CD1-CG2 4.29Å; L163-V269 HydrophobicContact CD2-CG2 4.32Å; L171-V269 HydrophobicContact CD1-CG2 4.24Å; L171-V269 HydrophobicContact CD2-CG1 4.37Å; F256-V269 VanDerWaalsContact C-CG1 3.49Å; F256-V269 HydrophobicContact CB-CG1 3.95Å; F256-V269 HydrophobicContact CD1-CG1 4.46Å; L263-V269 HydrophobicContact CD1-CG2 4.23Å; D265-V269 PolarHBondContact O-N 3.43Å; P266-V269 CarbonylContact O-C 3.57Å; P266-V269 WeakPolarHBondContact O-CA 3.36Å; P266-V269 WeakPolarHBondContact O-CB 3.46Å; P266-V269 PolarHBondContact O-N 3.04Å; P266-V269 VanDerWaalsContact O-N 3.09Å; V269-S271 PolarHBondContact O-N 3.19Å; V269-I272 PolarHBondContact O-N 3.29Å; V269-Q273 PolarHBondContact O-N 2.96Å
270	D	96.6	Very high	95.8	Very high	67 Å²	67	59.1 Å²	59.1	36%	0.358	33%	0.333	S	S	.	.	H	α-helix	trans	-54.7	-50.4	171.5	-74.3	-49	0	0	0	111.2	S258 P266 I272 Q273 E274	S258-D270 WeakPolarHBondContact CB-OD1 3.45Å; S258-D270 PolarHBondContact OG-OD1 3.49Å; P266-D270 PolarHBondContact O-N 3.12Å; D270-I272 PolarHBondContact O-N 3.5Å; D270-Q273 CarbonylContact O-C 3.56Å; D270-Q273 WeakPolarHBondContact O-CA 3.45Å; D270-Q273 WeakPolarHBondContact O-CB 3.4Å; D270-Q273 PolarHBondContact O-N 3.49Å; D270-E274 PolarHBondContact O-N 2.89Å
271	S	97	Very high	96	Very high	43 Å²	43	62.2 Å²	62.2	30%	0.301	35%	0.346	S	S	.	.	H	α-helix	trans	-64	-27.6	-179	81.4	0	0	0	0	113.5	T267 L268 V269 R275	T267-S271 PolarHBondContact O-N 2.92Å; T267-S271 VanDerWaalsContact O-N 3.11Å; L268-S271 PolarHBondContact O-N 3.31Å; L268-S271 PolarHBondContact O-OG 2.91Å; V269-S271 PolarHBondContact O-N 3.19Å; S271-R275 VanDerWaalsContact O-CD 3.24Å; S271-R275 WeakPolarHBondContact O-CD 3.4Å; S271-R275 WeakPolarHBondContact O-CG 3.46Å; S271-R275 PolarHBondContact O-N 2.81Å
272	I	96.8	Very high	96.1	Very high	4 Å²	4	64.6 Å²	64.6	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-74.5	-43.3	172	-67.5	161.8	0	0	0	109.6	L159 L163 F256 L268 V269 D270 R275 I276	L159-I272 HydrophobicContact CB-CD1 4.22Å; L159-I272 HydrophobicContact CB-CG1 4.38Å; L159-I272 HydrophobicContact CB-CG2 4.28Å; L159-I272 HydrophobicContact CD1-CG1 4.39Å; L159-I272 HydrophobicContact CD1-CG2 3.99Å; L159-I272 WeakPolarHBondContact O-CD1 3.37Å; L163-I272 HydrophobicContact CD2-CD1 3.93Å; F256-I272 HydrophobicContact CB-CG2 4.27Å; F256-I272 HydrophobicContact CD1-CB 4.29Å; F256-I272 HydrophobicContact CD1-CD1 4.25Å; F256-I272 HydrophobicContact CD1-CG2 3.69Å; F256-I272 HydrophobicContact CD2-CG2 3.69Å; F256-I272 HydrophobicContact CE1-CD1 4.06Å; F256-I272 HydrophobicContact CE1-CG2 3.83Å; F256-I272 HydrophobicContact CE2-CG2 3.84Å; F256-I272 HydrophobicContact CG-CB 4.44Å; F256-I272 HydrophobicContact CG-CG2 3.61Å; F256-I272 HydrophobicContact CZ-CG2 3.9Å; L268-I272 HydrophobicContact CD1-CD1 4.32Å; L268-I272 HydrophobicContact CG-CD1 4.17Å; L268-I272 WeakPolarHBondContact O-CG1 3.43Å; L268-I272 PolarHBondContact O-N 2.94Å; V269-I272 PolarHBondContact O-N 3.29Å; D270-I272 PolarHBondContact O-N 3.5Å; I272-R275 PolarHBondContact O-N 2.78Å; I272-I276 HydrophobicContact CG2-CD1 3.81Å; I272-I276 WeakPolarHBondContact O-CD1 3.42Å; I272-I276 WeakPolarHBondContact O-CG1 3.34Å; I272-I276 PolarHBondContact O-N 2.7Å; I272-I276 VanDerWaalsContact O-N 3.09Å
273	Q	96.1	Very high	96.3	Very high	42 Å²	42	65.2 Å²	65.2	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-45.4	178.6	-156.6	-165.7	90.3	0	0	111.8	L253 F256 V269 D270 R275 I276 Q277	L253-Q273 HydrophobicContact CD2-CG 3.58Å; F256-Q273 PolarHBondContact O-NE2 3.24Å; V269-Q273 PolarHBondContact O-N 2.96Å; D270-Q273 CarbonylContact O-C 3.56Å; D270-Q273 WeakPolarHBondContact O-CA 3.45Å; D270-Q273 WeakPolarHBondContact O-CB 3.4Å; D270-Q273 PolarHBondContact O-N 3.49Å; Q273-R275 VanDerWaalsContact C-N 3.29Å; Q273-R275 PolarHBondContact O-N 3.06Å; Q273-I276 PolarHBondContact O-N 2.97Å; Q273-I276 VanDerWaalsContact O-N 3.09Å; Q273-Q277 WeakPolarHBondContact O-CG 3.32Å; Q273-Q277 PolarHBondContact O-N 2.64Å
274	E	96.4	Very high	96.2	Very high	131 Å²	131	64.4 Å²	64.4	61%	0.612	33%	0.329	S	S	*	.	H	α-helix	trans	-52.7	-46.4	173	-74.6	-170.9	162.6	0	0	111.7	D270 I276 Q277 C278	D270-E274 PolarHBondContact O-N 2.89Å; E274-I276 VanDerWaalsContact C-N 3.31Å; E274-I276 PolarHBondContact O-N 3.13Å; E274-Q277 PolarHBondContact O-N 2.79Å; E274-C278 PolarHBondContact O-N 3.27Å; E274-C278 PolarHBondContact O-SG 3Å; E274-C278 VanDerWaalsContact O-SG 3.37Å
275	R	96.6	Very high	96.1	Very high	153 Å²	153	63.9 Å²	63.9	58%	0.577	33%	0.327	S	S	*	.	H	α-helix	trans	-65.1	-33.8	179.7	-70.9	167.8	66.8	-169.1	0.5	112.5	S271 I272 Q273 A279	S271-R275 VanDerWaalsContact O-CD 3.24Å; S271-R275 WeakPolarHBondContact O-CD 3.4Å; S271-R275 WeakPolarHBondContact O-CG 3.46Å; S271-R275 PolarHBondContact O-N 2.81Å; I272-R275 PolarHBondContact O-N 2.78Å; Q273-R275 VanDerWaalsContact C-N 3.29Å; Q273-R275 PolarHBondContact O-N 3.06Å; R275-A279 WeakPolarHBondContact O-CB 3.47Å; R275-A279 PolarHBondContact O-N 3.47Å; R275-A279 VanDerWaalsContact O-N 3.16Å
276	I	96.8	Very high	96	Very high	9 Å²	9	69.9 Å²	69.9	5%	0.046	35%	0.346	C	S	.	.	H	α-helix	trans	-72.6	-41.5	174.9	-62.5	156.7	0	0	0	110.6	C249 A252 L253 F256 I272 Q273 E274 A279 L280	C249-I276 HydrophobicContact CB-CG2 4.34Å; A252-I276 HydrophobicContact CB-CD1 3.75Å; A252-I276 HydrophobicContact CB-CG1 4.39Å; A252-I276 HydrophobicContact CB-CG2 4.17Å; L253-I276 HydrophobicContact CD2-CB 3.89Å; L253-I276 HydrophobicContact CD2-CG2 3.65Å; L253-I276 HydrophobicContact CG-CG2 3.73Å; F256-I276 HydrophobicContact CD2-CD1 3.53Å; F256-I276 HydrophobicContact CE2-CD1 4.09Å; F256-I276 HydrophobicContact CG-CD1 4.33Å; I272-I276 HydrophobicContact CG2-CD1 3.81Å; I272-I276 WeakPolarHBondContact O-CD1 3.42Å; I272-I276 WeakPolarHBondContact O-CG1 3.34Å; I272-I276 PolarHBondContact O-N 2.7Å; I272-I276 VanDerWaalsContact O-N 3.09Å; Q273-I276 PolarHBondContact O-N 2.97Å; Q273-I276 VanDerWaalsContact O-N 3.09Å; E274-I276 VanDerWaalsContact C-N 3.31Å; E274-I276 PolarHBondContact O-N 3.13Å; I276-A279 PolarHBondContact O-N 3.1Å; I276-L280 WeakPolarHBondContact O-CB 3.48Å; I276-L280 PolarHBondContact O-N 3.23Å
277	Q	96.5	Very high	95.8	Very high	65 Å²	65	70.8 Å²	70.8	30%	0.304	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-48.1	175.9	-68.3	-172.6	31.9	0	0	111.2	L253 Q273 E274 A279 L280 E281 F296	L253-Q277 HydrophobicContact CD1-CG 4.49Å; L253-Q277 HydrophobicContact CD2-CG 3.54Å; Q273-Q277 WeakPolarHBondContact O-CG 3.32Å; Q273-Q277 PolarHBondContact O-N 2.64Å; E274-Q277 PolarHBondContact O-N 2.79Å; Q277-A279 PolarHBondContact O-N 3.43Å; Q277-L280 PolarHBondContact O-N 2.92Å; Q277-E281 WeakPolarHBondContact O-CB 3.2Å; Q277-E281 PolarHBondContact O-N 3.32Å; Q277-F296 HydrophobicContact CB-CZ 4.42Å; Q277-F296 WeakPolarHBondContact O-CE2 3.44Å
278	C	97	Very high	95.6	Very high	81 Å²	81	68.6 Å²	68.6	55%	0.547	33%	0.329	S	S	.	.	H	α-helix	trans	-58.5	-44.6	175.7	-71.6	0	0	0	0	112.4	E274 L280 E281 E282	E274-C278 PolarHBondContact O-N 3.27Å; E274-C278 PolarHBondContact O-SG 3Å; E274-C278 VanDerWaalsContact O-SG 3.37Å; C278-L280 PolarHBondContact O-N 3.2Å; C278-E281 PolarHBondContact O-N 3.16Å; C278-E282 WeakPolarHBondContact O-CB 3.29Å; C278-E282 PolarHBondContact O-N 3.28Å
279	A	96.1	Very high	95	Very high	51 Å²	51	68.2 Å²	68.2	42%	0.421	33%	0.332	S	S	.	.	H	α-helix	trans	-65.7	-37.1	179.1	0	0	0	0	0	112.9	R275 I276 Q277 Y283	R275-A279 WeakPolarHBondContact O-CB 3.47Å; R275-A279 PolarHBondContact O-N 3.47Å; R275-A279 VanDerWaalsContact O-N 3.16Å; I276-A279 PolarHBondContact O-N 3.1Å; Q277-A279 PolarHBondContact O-N 3.43Å; A279-Y283 VanDerWaalsContact O-CB 3.29Å; A279-Y283 WeakPolarHBondContact O-CB 3.45Å; A279-Y283 PolarHBondContact O-N 3.41Å
280	L	96.4	Very high	94.4	Very high	1 Å²	1	76 Å²	76	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-70.2	-40	174.3	-178	61.9	0	0	0	111.5	E246 C249 L253 I276 Q277 C278 Y283 D284 F296 L299	E246-L280 HydrophobicContact CB-CD1 4.49Å; E246-L280 HydrophobicContact CG-CD1 4.19Å; C249-L280 HydrophobicContact CB-CB 4.18Å; C249-L280 HydrophobicContact CB-CD1 3.88Å; C249-L280 HydrophobicContact CB-CD2 4.16Å; C249-L280 HydrophobicContact CB-CG 4.29Å; L253-L280 HydrophobicContact CD1-CD2 4.21Å; I276-L280 WeakPolarHBondContact O-CB 3.48Å; I276-L280 PolarHBondContact O-N 3.23Å; Q277-L280 PolarHBondContact O-N 2.92Å; C278-L280 PolarHBondContact O-N 3.2Å; L280-Y283 PolarHBondContact O-N 2.95Å; L280-D284 WeakPolarHBondContact O-CB 3.43Å; L280-D284 PolarHBondContact O-N 2.98Å; L280-F296 HydrophobicContact CB-CD2 4.39Å; L280-F296 HydrophobicContact CB-CE2 4.18Å; L280-F296 HydrophobicContact CD2-CD2 4.24Å; L280-F296 HydrophobicContact CD2-CE2 4.28Å; L280-F296 HydrophobicContact CG-CD2 3.99Å; L280-F296 HydrophobicContact CG-CE2 4.2Å; L280-L299 HydrophobicContact CD1-CD1 4.16Å; L280-L299 HydrophobicContact CD2-CD1 4.26Å
281	E	96.2	Very high	94.1	Very high	72 Å²	72	82.3 Å²	82.3	34%	0.336	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-41.2	177.4	-157.8	-155.1	-173.9	0	0	111.9	Q277 C278 K285 F296	Q277-E281 WeakPolarHBondContact O-CB 3.2Å; Q277-E281 PolarHBondContact O-N 3.32Å; C278-E281 PolarHBondContact O-N 3.16Å; E281-K285 HydrophobicContact CG-CD 4.3Å; E281-K285 WeakPolarHBondContact O-CB 3.43Å; E281-K285 WeakPolarHBondContact O-CD 3.4Å; E281-K285 WeakPolarHBondContact O-CG 3.33Å; E281-K285 PolarHBondContact O-N 2.84Å; E281-K285 WeakPolarHBondContact OE1-CE 3.32Å; E281-K285 IonicContact OE1-NZ 3.46Å; E281-K285 PolarHBondContact OE1-NZ 3.21Å; E281-K285 IonicContact OE2-NZ 2.86Å; E281-K285 PolarHBondContact OE2-NZ 2.98Å; E281-F296 HydrophobicContact CB-CD1 4.32Å; E281-F296 HydrophobicContact CB-CD2 3.83Å; E281-F296 HydrophobicContact CB-CE1 4.14Å; E281-F296 HydrophobicContact CB-CE2 3.65Å; E281-F296 HydrophobicContact CB-CG 4.16Å; E281-F296 HydrophobicContact CB-CZ 3.79Å; E281-F296 HydrophobicContact CG-CD1 3.75Å; E281-F296 HydrophobicContact CG-CD2 4.08Å; E281-F296 HydrophobicContact CG-CE1 3.84Å; E281-F296 HydrophobicContact CG-CE2 4.17Å; E281-F296 HydrophobicContact CG-CG 3.87Å; E281-F296 HydrophobicContact CG-CZ 4.04Å
282	E	95.1	Very high	93.7	Very high	144 Å²	144	83.3 Å²	83.3	67%	0.673	39%	0.388	S	S	*	.	H	α-helix	trans	-64.4	-43.1	174.5	-173.3	175.5	-172.2	0	0	111.6	C278 K285 Y286	C278-E282 WeakPolarHBondContact O-CB 3.29Å; C278-E282 PolarHBondContact O-N 3.28Å; E282-K285 PolarHBondContact O-N 3.46Å; E282-Y286 WeakPolarHBondContact O-CB 3.26Å; E282-Y286 PolarHBondContact O-N 3.45Å
283	Y	95.7	Very high	93.2	Very high	73 Å²	73	87.4 Å²	87.4	29%	0.286	42%	0.415	S	S	.	.	H	α-helix	trans	-60.7	-45.8	175.7	-174.3	-90.1	0	0	0	112.3	D243 S245 E246 A279 L280 Y286 N287 Y288	D243-Y283 PolarHBondContact OD1-OH 2.95Å; D243-Y283 VanDerWaalsContact OD2-CE1 3.28Å; D243-Y283 WeakPolarHBondContact OD2-CE1 3.48Å; D243-Y283 PolarHBondContact OD2-OH 2.76Å; S245-Y283 VanDerWaalsContact OG-CZ 3.25Å; S245-Y283 PolarHBondContact OG-OH 3.21Å; E246-Y283 HydrophobicContact CG-CE1 4.32Å; A279-Y283 VanDerWaalsContact O-CB 3.29Å; A279-Y283 WeakPolarHBondContact O-CB 3.45Å; A279-Y283 PolarHBondContact O-N 3.41Å; L280-Y283 PolarHBondContact O-N 2.95Å; Y283-Y286 PolarHBondContact O-N 3.42Å; Y283-N287 WeakPolarHBondContact CD2-ND2 3.32Å; Y283-N287 HydrophobicContact CE1-CB 4.46Å; Y283-N287 WeakPolarHBondContact CE1-ND2 3.43Å; Y283-N287 VanDerWaalsContact CE2-ND2 3.28Å; Y283-N287 WeakPolarHBondContact CE2-ND2 3.3Å; Y283-N287 VanDerWaalsContact CZ-ND2 3.3Å; Y283-N287 PolarHBondContact O-N 3.33Å; Y283-N287 PolarHBondContact O-ND2 3.47Å; Y283-Y288 HydrophobicContact CE1-CE2 4.26Å
284	D	94.7	Very high	93	Very high	7 Å²	7	91.5 Å²	91.5	4%	0.037	43%	0.432	C	S	.	.	H	α-helix	trans	-66.7	-40.5	178	-84.1	21.7	0	0	0	112.2	L280 Y286 Y288 S289 F296	L280-D284 WeakPolarHBondContact O-CB 3.43Å; L280-D284 PolarHBondContact O-N 2.98Å; D284-Y286 VanDerWaalsContact C-N 3.28Å; D284-Y286 PolarHBondContact O-N 2.92Å; D284-Y288 WeakPolarHBondContact O-CA 3.44Å; D284-Y288 WeakPolarHBondContact O-CB 3.35Å; D284-Y288 PolarHBondContact O-N 2.92Å; D284-S289 PolarHBondContact O-N 3.19Å; D284-F296 HydrophobicContact CB-CB 4.22Å; D284-F296 WeakPolarHBondContact OD2-CA 3.48Å; D284-F296 WeakPolarHBondContact OD2-CB 3.31Å; D284-F296 PolarHBondContact OD2-N 3.21Å
285	K	92.9	Very high	92.9	Very high	117 Å²	117	85.4 Å²	85.4	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-60.3	-38.6	173.8	-77.9	166.4	179.5	170	0	111.8	E281 E282 S289	E281-K285 HydrophobicContact CG-CD 4.3Å; E281-K285 WeakPolarHBondContact O-CB 3.43Å; E281-K285 WeakPolarHBondContact O-CD 3.4Å; E281-K285 WeakPolarHBondContact O-CG 3.33Å; E281-K285 PolarHBondContact O-N 2.84Å; E281-K285 WeakPolarHBondContact OE1-CE 3.32Å; E281-K285 IonicContact OE1-NZ 3.46Å; E281-K285 PolarHBondContact OE1-NZ 3.21Å; E281-K285 IonicContact OE2-NZ 2.86Å; E281-K285 PolarHBondContact OE2-NZ 2.98Å; E282-K285 PolarHBondContact O-N 3.46Å; K285-S289 WeakPolarHBondContact O-CB 3.42Å
286	Y	92.9	Very high	92.8	Very high	193 Å²	193	80.2 Å²	80.2	76%	0.757	39%	0.385	S	S	*	.	H	α-helix	trans	-74.9	-47.2	179.7	-173.7	-94.4	0	0	0	112.8	E282 Y283 D284	E282-Y286 WeakPolarHBondContact O-CB 3.26Å; E282-Y286 PolarHBondContact O-N 3.45Å; Y283-Y286 PolarHBondContact O-N 3.42Å; D284-Y286 VanDerWaalsContact C-N 3.28Å; D284-Y286 PolarHBondContact O-N 2.92Å
287	N	93.1	Very high	92.7	Very high	67 Å²	67	81.4 Å²	81.4	36%	0.358	40%	0.4	S	S	.	.	H	α-helix	trans	-90.2	-32.3	-171.3	-64.7	-75.6	0	0	0	114.1	Y283	Y283-N287 WeakPolarHBondContact CD2-ND2 3.32Å; Y283-N287 HydrophobicContact CE1-CB 4.46Å; Y283-N287 WeakPolarHBondContact CE1-ND2 3.43Å; Y283-N287 VanDerWaalsContact CE2-ND2 3.28Å; Y283-N287 WeakPolarHBondContact CE2-ND2 3.3Å; Y283-N287 VanDerWaalsContact CZ-ND2 3.3Å; Y283-N287 PolarHBondContact O-N 3.33Å; Y283-N287 PolarHBondContact O-ND2 3.47Å
288	Y	91.6	Very high	92.5	Very high	53 Å²	53	83.3 Å²	83.3	21%	0.208	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-13	-163.4	-66.8	-63.9	0	0	0	115.8	D243 Y283 D284 H290 Y291 Q292 R295	D243-Y288 PolarHBondContact OD2-OH 3.09Å; D243-Y288 VanDerWaalsContact OD2-OH 3.13Å; Y283-Y288 HydrophobicContact CE1-CE2 4.26Å; D284-Y288 WeakPolarHBondContact O-CA 3.44Å; D284-Y288 WeakPolarHBondContact O-CB 3.35Å; D284-Y288 PolarHBondContact O-N 2.92Å; Y288-H290 VanDerWaalsContact C-N 3.26Å; Y288-H290 PolarHBondContact O-N 3.39Å; Y288-Y291 PolarHBondContact O-N 3.35Å; Y288-Q292 PolarHBondContact O-N 3.27Å; Y288-R295 VanDerWaalsContact CD2-CD 3.47Å; Y288-R295 VanDerWaalsContact CG-CD 3.44Å
289	S	83.3	Confident	92.4	Very high	59 Å²	59	79.5 Å²	79.5	41%	0.413	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-42.2	-176.5	176.3	0	0	0	0	114.9	D284 K285 Y291	D284-S289 PolarHBondContact O-N 3.19Å; K285-S289 WeakPolarHBondContact O-CB 3.42Å; S289-Y291 VanDerWaalsContact C-N 3.31Å; S289-Y291 PolarHBondContact O-N 3.31Å
290	H	85.7	Confident	92.4	Very high	164 Å²	164	79.1 Å²	79.1	76%	0.759	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.8	-178	-61.8	-51.1	0	0	0	115.4	Y288	Y288-H290 VanDerWaalsContact C-N 3.26Å; Y288-H290 PolarHBondContact O-N 3.39Å
291	Y	89.6	Confident	92.3	Very high	199 Å²	199	84.8 Å²	84.8	78%	0.78	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-27.1	-172.6	-56.4	-72.8	0	0	0	113.7	Y288 S289	Y288-Y291 PolarHBondContact O-N 3.35Å; S289-Y291 VanDerWaalsContact C-N 3.31Å; S289-Y291 PolarHBondContact O-N 3.31Å
292	Q	88.5	Confident	92.1	Very high	65 Å²	65	85.1 Å²	85.1	30%	0.304	40%	0.397	S	S	.	.			trans	-139.6	67.3	-180	-59.1	-173.6	38.1	0	0	109.9	Y288 F294 R295	Y288-Q292 PolarHBondContact O-N 3.27Å; Q292-F294 PolarHBondContact O-N 3.14Å; Q292-R295 HydrophobicContact CB-CB 3.94Å; Q292-R295 VanDerWaalsContact O-CB 3.3Å; Q292-R295 WeakPolarHBondContact O-CB 3.37Å; Q292-R295 PolarHBondContact O-N 3.14Å
293	P	86.5	Confident	92	Very high	89 Å²	89	79.7 Å²	79.7	58%	0.578	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.3	-174.9	24.2	-35.4	0	0	0	114.6
294	F	91.7	Very high	91.9	Very high	128 Å²	128	80.1 Å²	80.1	56%	0.561	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	19.6	176.6	-51.6	-62.2	0	0	0	113.4	Q292 G297 R298	Q292-F294 PolarHBondContact O-N 3.14Å; F294-G297 PolarHBondContact O-N 3.49Å; F294-R298 WeakPolarHBondContact O-CG 3.28Å; F294-R298 PolarHBondContact O-N 3.02Å
295	R	94	Very high	91.7	Very high	4 Å²	4	84.6 Å²	84.6	2%	0.015	40%	0.403	C	S	.	.	H	α-helix	trans	-58.5	-53.7	-176.1	-168.4	162.3	172.6	91.4	0.8	111.9	L240 N241 E246 Y288 Q292 G297 R298 L299	L240-R295 PolarHBondContact O-NH1 3.07Å; L240-R295 PolarHBondContact O-NH2 3.3Å; N241-R295 PolarHBondContact O-NH2 3.34Å; E246-R295 IonicContact OE1-CZ 3.09Å; E246-R295 IonicContact OE1-NE 3.69Å; E246-R295 PolarHBondContact OE1-NE 3.44Å; E246-R295 IonicContact OE1-NH2 2.7Å; E246-R295 PolarHBondContact OE1-NH2 3.38Å; E246-R295 IonicContact OE2-CZ 2.68Å; E246-R295 IonicContact OE2-NE 2.6Å; E246-R295 IonicContact OE2-NH2 2.69Å; E246-R295 PolarHBondContact OE2-NH2 2.65Å; Y288-R295 VanDerWaalsContact CD2-CD 3.47Å; Y288-R295 VanDerWaalsContact CG-CD 3.44Å; Q292-R295 HydrophobicContact CB-CB 3.94Å; Q292-R295 VanDerWaalsContact O-CB 3.3Å; Q292-R295 WeakPolarHBondContact O-CB 3.37Å; Q292-R295 PolarHBondContact O-N 3.14Å; R295-G297 VanDerWaalsContact C-N 3.31Å; R295-G297 PolarHBondContact O-N 2.98Å; R295-R298 CarbonylContact O-C 3.59Å; R295-R298 WeakPolarHBondContact O-CA 3.22Å; R295-R298 VanDerWaalsContact O-CB 3.31Å; R295-R298 WeakPolarHBondContact O-CB 2.99Å; R295-R298 PolarHBondContact O-N 3.4Å; R295-L299 HydrophobicContact CG-CG 4.28Å; R295-L299 WeakPolarHBondContact O-CG 3.38Å; R295-L299 PolarHBondContact O-N 3.08Å
296	F	94.6	Very high	91.6	Very high	44 Å²	44	79.2 Å²	79.2	19%	0.193	38%	0.38	C	S	.	.	H	α-helix	trans	-48	-50	176.7	177.7	-108.1	0	0	0	113	Q277 L280 E281 D284 R298 L299 L300	Q277-F296 HydrophobicContact CB-CZ 4.42Å; Q277-F296 WeakPolarHBondContact O-CE2 3.44Å; L280-F296 HydrophobicContact CB-CD2 4.39Å; L280-F296 HydrophobicContact CB-CE2 4.18Å; L280-F296 HydrophobicContact CD2-CD2 4.24Å; L280-F296 HydrophobicContact CD2-CE2 4.28Å; L280-F296 HydrophobicContact CG-CD2 3.99Å; L280-F296 HydrophobicContact CG-CE2 4.2Å; E281-F296 HydrophobicContact CB-CD1 4.32Å; E281-F296 HydrophobicContact CB-CD2 3.83Å; E281-F296 HydrophobicContact CB-CE1 4.14Å; E281-F296 HydrophobicContact CB-CE2 3.65Å; E281-F296 HydrophobicContact CB-CG 4.16Å; E281-F296 HydrophobicContact CB-CZ 3.79Å; E281-F296 HydrophobicContact CG-CD1 3.75Å; E281-F296 HydrophobicContact CG-CD2 4.08Å; E281-F296 HydrophobicContact CG-CE1 3.84Å; E281-F296 HydrophobicContact CG-CE2 4.17Å; E281-F296 HydrophobicContact CG-CG 3.87Å; E281-F296 HydrophobicContact CG-CZ 4.04Å; D284-F296 HydrophobicContact CB-CB 4.22Å; D284-F296 WeakPolarHBondContact OD2-CA 3.48Å; D284-F296 WeakPolarHBondContact OD2-CB 3.31Å; D284-F296 PolarHBondContact OD2-N 3.21Å; F296-R298 PolarHBondContact O-N 3.27Å; F296-L299 WeakPolarHBondContact O-CB 3.31Å; F296-L299 PolarHBondContact O-N 2.99Å; F296-L300 HydrophobicContact CD1-CD1 4.26Å; F296-L300 HydrophobicContact CE1-CD1 3.64Å; F296-L300 HydrophobicContact CE2-CD1 4.04Å; F296-L300 HydrophobicContact CE2-CG 4.32Å; F296-L300 HydrophobicContact CZ-CD1 3.52Å; F296-L300 HydrophobicContact CZ-CG 4.28Å; F296-L300 PolarHBondContact O-N 3.47Å
297	G	94.4	Very high	91.6	Very high	34 Å²	34	73.3 Å²	73.3	35%	0.351	36%	0.358	S	S	.	.	H	α-helix	trans	-63.6	-40	175.6	0	0	0	0	0	113.2	F294 R295 L299 L301	F294-G297 PolarHBondContact O-N 3.49Å; R295-G297 VanDerWaalsContact C-N 3.31Å; R295-G297 PolarHBondContact O-N 2.98Å; G297-L299 VanDerWaalsContact C-N 3.31Å; G297-L299 PolarHBondContact O-N 3.37Å; G297-L301 VanDerWaalsContact O-CB 3.31Å; G297-L301 WeakPolarHBondContact O-CB 3.37Å; G297-L301 WeakPolarHBondContact O-CD1 3.28Å; G297-L301 WeakPolarHBondContact O-CG 3.47Å; G297-L301 PolarHBondContact O-N 3.4Å; G297-L301 VanDerWaalsContact O-N 3.08Å
298	R	93.2	Very high	91.4	Very high	104 Å²	104	75.9 Å²	75.9	39%	0.392	37%	0.368	S	S	.	.	H	α-helix	trans	-63.6	-34.8	173.5	-73.5	174.2	63.6	-136.5	-0.4	112.6	F294 R295 F296 R302	F294-R298 WeakPolarHBondContact O-CG 3.28Å; F294-R298 PolarHBondContact O-N 3.02Å; R295-R298 CarbonylContact O-C 3.59Å; R295-R298 WeakPolarHBondContact O-CA 3.22Å; R295-R298 VanDerWaalsContact O-CB 3.31Å; R295-R298 WeakPolarHBondContact O-CB 2.99Å; R295-R298 PolarHBondContact O-N 3.4Å; F296-R298 PolarHBondContact O-N 3.27Å; R298-R302 WeakPolarHBondContact O-CG 3.44Å
299	L	94.8	Very high	91.3	Very high	1 Å²	1	74 Å²	74	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-68.7	-55.4	176.5	-62.3	-171.5	0	0	0	111	L240 L242 E246 L250 L280 R295 F296 G297 L301 R302	L240-L299 HydrophobicContact CD1-CD2 4.4Å; L242-L299 HydrophobicContact CD2-CD2 3.37Å; E246-L299 HydrophobicContact CB-CD1 4.34Å; E246-L299 HydrophobicContact CG-CD1 4.14Å; L250-L299 HydrophobicContact CD2-CB 4.33Å; L280-L299 HydrophobicContact CD1-CD1 4.16Å; L280-L299 HydrophobicContact CD2-CD1 4.26Å; R295-L299 HydrophobicContact CG-CG 4.28Å; R295-L299 WeakPolarHBondContact O-CG 3.38Å; R295-L299 PolarHBondContact O-N 3.08Å; F296-L299 WeakPolarHBondContact O-CB 3.31Å; F296-L299 PolarHBondContact O-N 2.99Å; G297-L299 VanDerWaalsContact C-N 3.31Å; G297-L299 PolarHBondContact O-N 3.37Å; L299-L301 VanDerWaalsContact C-N 3.27Å; L299-L301 PolarHBondContact O-N 3.49Å; L299-R302 VanDerWaalsContact O-CB 3.29Å; L299-R302 WeakPolarHBondContact O-CB 3.42Å; L299-R302 PolarHBondContact O-N 3.44Å
300	L	95.1	Very high	91.5	Very high	44 Å²	44	71.2 Å²	71.2	23%	0.23	34%	0.343	C	S	.	.	H	α-helix	trans	-58.7	-37.9	-180	-67	-174.3	0	0	0	112.3	L253 F296 R302 L303 P304	L253-L300 HydrophobicContact CD1-CD2 3.63Å; F296-L300 HydrophobicContact CD1-CD1 4.26Å; F296-L300 HydrophobicContact CE1-CD1 3.64Å; F296-L300 HydrophobicContact CE2-CD1 4.04Å; F296-L300 HydrophobicContact CE2-CG 4.32Å; F296-L300 HydrophobicContact CZ-CD1 3.52Å; F296-L300 HydrophobicContact CZ-CG 4.28Å; F296-L300 PolarHBondContact O-N 3.47Å; L300-R302 PolarHBondContact O-N 3.39Å; L300-L303 HydrophobicContact CD2-CD1 4.26Å; L300-L303 PolarHBondContact O-N 2.87Å; L300-L303 VanDerWaalsContact O-N 3.14Å; L300-P304 WeakPolarHBondContact O-CD 3.4Å
301	L	94.2	Very high	91.5	Very high	120 Å²	120	66.8 Å²	66.8	63%	0.628	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-4.2	175.8	-73.7	171.2	0	0	0	114.8	G297 L299	G297-L301 VanDerWaalsContact O-CB 3.31Å; G297-L301 WeakPolarHBondContact O-CB 3.37Å; G297-L301 WeakPolarHBondContact O-CD1 3.28Å; G297-L301 WeakPolarHBondContact O-CG 3.47Å; G297-L301 PolarHBondContact O-N 3.4Å; G297-L301 VanDerWaalsContact O-N 3.08Å; L299-L301 VanDerWaalsContact C-N 3.27Å; L299-L301 PolarHBondContact O-N 3.49Å
302	R	92.4	Very high	91.3	Very high	79 Å²	79	59.2 Å²	59.2	30%	0.298	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-36.8	170.7	-59.3	-67.7	110.8	-164.5	1.6	112.5	L240 R298 L299 L300 K305 L306	L240-R302 HydrophobicContact CD1-CG 3.65Å; L240-R302 HydrophobicContact CD2-CG 4.16Å; L240-R302 HydrophobicContact CG-CG 4.49Å; R298-R302 WeakPolarHBondContact O-CG 3.44Å; L299-R302 VanDerWaalsContact O-CB 3.29Å; L299-R302 WeakPolarHBondContact O-CB 3.42Å; L299-R302 PolarHBondContact O-N 3.44Å; L300-R302 PolarHBondContact O-N 3.39Å; R302-K305 PolarHBondContact O-N 3.04Å; R302-L306 PolarHBondContact O-N 3.23Å
303	L	93.8	Very high	91	Very high	29 Å²	29	61.3 Å²	61.3	15%	0.152	33%	0.325	C	S	.	.	H	α-helix	trans	-55.7	-45.8	-173.1	-59.7	179.3	0	0	0	112.4	L250 L253 I254 L300 K305 L306 K307	L250-L303 HydrophobicContact CD2-CD1 4.16Å; L250-L303 HydrophobicContact CD2-CD2 3.84Å; L250-L303 HydrophobicContact CD2-CG 4.1Å; L253-L303 HydrophobicContact CB-CD1 3.89Å; L253-L303 HydrophobicContact CD1-CD1 4.03Å; I254-L303 HydrophobicContact CD1-CD2 3.74Å; I254-L303 HydrophobicContact CG1-CD2 3.75Å; L300-L303 HydrophobicContact CD2-CD1 4.26Å; L300-L303 PolarHBondContact O-N 2.87Å; L300-L303 VanDerWaalsContact O-N 3.14Å; L303-K305 PolarHBondContact O-N 2.92Å; L303-L306 PolarHBondContact O-N 2.87Å; L303-K307 VanDerWaalsContact O-CB 3.31Å; L303-K307 WeakPolarHBondContact O-CB 3.39Å; L303-K307 PolarHBondContact O-N 3.41Å
304	P	92.6	Very high	90.7	Very high	83 Å²	83	60 Å²	60	54%	0.539	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-26.5	176.5	-23.5	34.8	0	0	0	114.6	L300 Q308	L300-P304 WeakPolarHBondContact O-CD 3.4Å; P304-Q308 VanDerWaalsContact O-CB 3.3Å; P304-Q308 WeakPolarHBondContact O-CB 3.35Å; P304-Q308 PolarHBondContact O-N 3.46Å
305	K	90.5	Very high	90.3	Very high	101 Å²	101	54.1 Å²	54.1	44%	0.439	29%	0.291	S	S	.	.	H	α-helix	trans	-84.3	-39.3	178.8	-76.6	-72.2	167.7	-167.5	0	112.3	R302 L303 Q308 T309	R302-K305 PolarHBondContact O-N 3.04Å; L303-K305 PolarHBondContact O-N 2.92Å; K305-Q308 PolarHBondContact O-N 2.9Å; K305-T309 PolarHBondContact O-N 2.93Å; K305-T309 VanDerWaalsContact O-N 3.12Å; K305-T309 PolarHBondContact O-OG1 3.33Å
306	L	92.1	Very high	89.9	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-52.2	170.6	-161.8	167.2	0	0	0	109.6	E178 M181 L182 I237 I254 R302 L303 Q308 T309 V310	E178-L306 VanDerWaalsContact CA-CD2 3.49Å; E178-L306 HydrophobicContact CB-CD2 3.58Å; E178-L306 HydrophobicContact CG-CD2 3.75Å; M181-L306 HydrophobicContact CB-CD2 4.25Å; M181-L306 HydrophobicContact CG-CD2 4.45Å; M181-L306 HydrophobicContact CG-CG 4.44Å; M181-L306 HydrophobicContact SD-CD2 3.98Å; M181-L306 HydrophobicContact SD-CG 3.81Å; L182-L306 HydrophobicContact CD2-CD1 3.58Å; L182-L306 HydrophobicContact CG-CD1 3.82Å; I237-L306 HydrophobicContact CD1-CD1 3.88Å; I237-L306 HydrophobicContact CD1-CG 4.29Å; I254-L306 HydrophobicContact CD1-CD1 4.26Å; R302-L306 PolarHBondContact O-N 3.23Å; L303-L306 PolarHBondContact O-N 2.87Å; L306-Q308 PolarHBondContact O-N 3.49Å; L306-T309 PolarHBondContact O-N 2.88Å; L306-V310 PolarHBondContact O-N 3.06Å
307	K	91.8	Very high	89.2	Confident	68 Å²	68	59.1 Å²	59.1	30%	0.296	32%	0.315	S	S	.	.	H	α-helix	trans	-52.7	-51.7	172	-168.1	154.9	-165.1	161.8	0	112.4	E178 N257 L303 T309 V310 S311	E178-K307 VanDerWaalsContact OE1-CD 3.26Å; E178-K307 WeakPolarHBondContact OE1-CD 3.33Å; E178-K307 WeakPolarHBondContact OE1-CE 3.46Å; E178-K307 VanDerWaalsContact OE1-CG 3.24Å; E178-K307 WeakPolarHBondContact OE1-CG 3.24Å; E178-K307 IonicContact OE1-NZ 2.74Å; E178-K307 WeakPolarHBondContact OE2-CB 3.09Å; N257-K307 PolarHBondContact OD1-NZ 3.29Å; L303-K307 VanDerWaalsContact O-CB 3.31Å; L303-K307 WeakPolarHBondContact O-CB 3.39Å; L303-K307 PolarHBondContact O-N 3.41Å; K307-T309 VanDerWaalsContact C-N 3.29Å; K307-T309 PolarHBondContact O-N 3.07Å; K307-V310 PolarHBondContact O-N 3.49Å; K307-V310 VanDerWaalsContact O-N 3.13Å; K307-S311 VanDerWaalsContact CG-OG 3.26Å; K307-S311 WeakPolarHBondContact CG-OG 3.46Å; K307-S311 VanDerWaalsContact O-CB 3.32Å; K307-S311 WeakPolarHBondContact O-CB 3.32Å; K307-S311 PolarHBondContact O-N 2.85Å; K307-S311 PolarHBondContact O-OG 3.14Å
308	Q	90	Very high	88.8	Confident	121 Å²	121	58.3 Å²	58.3	57%	0.565	30%	0.301	S	S	*	.	H	α-helix	trans	-54.7	-40.6	-179.5	-177.1	173.5	13.5	0	0	113.4	P304 K305 L306 V310	P304-Q308 VanDerWaalsContact O-CB 3.3Å; P304-Q308 WeakPolarHBondContact O-CB 3.35Å; P304-Q308 PolarHBondContact O-N 3.46Å; K305-Q308 PolarHBondContact O-N 2.9Å; L306-Q308 PolarHBondContact O-N 3.49Å; Q308-V310 VanDerWaalsContact C-N 3.34Å; Q308-V310 PolarHBondContact O-N 3.36Å
309	T	88.4	Confident	88.4	Confident	13 Å²	13	53.5 Å²	53.5	8%	0.08	28%	0.283	C	S	.	.	H	α-helix	trans	-74.4	-19.7	-177.4	-63.8	0	0	0	0	113.7	M181 E229 Q233 K305 L306 K307 S315	M181-T309 HydrophobicContact CE-CG2 3.96Å; E229-T309 HydrophobicContact CB-CG2 4.16Å; Q233-T309 HydrophobicContact CG-CG2 3.92Å; Q233-T309 VanDerWaalsContact CG-OG1 3.26Å; Q233-T309 WeakPolarHBondContact CG-OG1 3.3Å; K305-T309 PolarHBondContact O-N 2.93Å; K305-T309 VanDerWaalsContact O-N 3.12Å; K305-T309 PolarHBondContact O-OG1 3.33Å; L306-T309 PolarHBondContact O-N 2.88Å; K307-T309 VanDerWaalsContact C-N 3.29Å; K307-T309 PolarHBondContact O-N 3.07Å; T309-S315 WeakPolarHBondContact O-CB 3.17Å; T309-S315 PolarHBondContact O-OG 2.87Å
310	V	88.2	Confident	87.9	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-111.4	-23.8	-179.7	-57.8	0	0	0	0	114.8	P177 E178 M181 L306 K307 Q308 S312 S315 L319	P177-V310 HydrophobicContact CB-CB 3.85Å; P177-V310 HydrophobicContact CB-CG1 4.48Å; P177-V310 HydrophobicContact CB-CG2 3.87Å; E178-V310 HydrophobicContact CB-CG2 4.39Å; E178-V310 HydrophobicContact CG-CG2 3.44Å; E178-V310 VanDerWaalsContact CG-CG2 3.44Å; M181-V310 HydrophobicContact CE-CG1 3.59Å; M181-V310 HydrophobicContact SD-CG1 4.29Å; L306-V310 PolarHBondContact O-N 3.06Å; K307-V310 PolarHBondContact O-N 3.49Å; K307-V310 VanDerWaalsContact O-N 3.13Å; Q308-V310 VanDerWaalsContact C-N 3.34Å; Q308-V310 PolarHBondContact O-N 3.36Å; V310-S312 VanDerWaalsContact C-N 3.33Å; V310-S312 PolarHBondContact O-N 2.93Å; V310-S315 PolarHBondContact O-OG 3.17Å; V310-S315 VanDerWaalsContact O-OG 3.13Å; V310-L319 HydrophobicContact CG1-CD1 4.2Å
311	S	85	Confident	87.1	Confident	70 Å²	70	55.2 Å²	55.2	49%	0.49	29%	0.29	S	S	.	.	S	Bend	trans	-72.7	-11.9	-175.6	-62.8	0	0	0	0	116	K307	K307-S311 VanDerWaalsContact CG-OG 3.26Å; K307-S311 WeakPolarHBondContact CG-OG 3.46Å; K307-S311 VanDerWaalsContact O-CB 3.32Å; K307-S311 WeakPolarHBondContact O-CB 3.32Å; K307-S311 PolarHBondContact O-N 2.85Å; K307-S311 PolarHBondContact O-OG 3.14Å
312	S	84.5	Confident	86.4	Confident	40 Å²	40	50.7 Å²	50.7	28%	0.28	27%	0.268	S	S	.	.	S	Bend	trans	-71.2	136.4	175.8	175.5	0	0	0	0	110.1	V310 T314 S315 L316	V310-S312 VanDerWaalsContact C-N 3.33Å; V310-S312 PolarHBondContact O-N 2.93Å; S312-T314 PolarHBondContact O-N 3.5Å; S312-T314 PolarHBondContact OG-N 3.07Å; S312-S315 WeakPolarHBondContact CA-OG 3.23Å; S312-S315 VanDerWaalsContact CB-OG 3.3Å; S312-S315 WeakPolarHBondContact CB-OG 3.48Å; S312-S315 PolarHBondContact N-OG 3.22Å; S312-S315 VanDerWaalsContact N-OG 3.16Å; S312-S315 PolarHBondContact O-N 3.25Å; S312-S315 PolarHBondContact O-OG 3.15Å; S312-L316 WeakPolarHBondContact O-CB 3.29Å; S312-L316 PolarHBondContact O-N 3.45Å
313	P	83.2	Confident	85.8	Confident	109 Å²	109	47 Å²	47	71%	0.708	25%	0.254	S	S	*	.	H	α-helix	trans	-53.5	-31.7	175	-27.9	35.6	0	0	0	113.2	K317	P313-K317 WeakPolarHBondContact O-CB 3.23Å; P313-K317 PolarHBondContact O-N 3.24Å
314	T	79.6	Confident	85.1	Confident	63 Å²	63	45.7 Å²	45.7	39%	0.387	25%	0.248	S	C	.	.	H	α-helix	trans	-76.8	-39.4	177.5	-35	0	0	0	0	112.7	L222 Y226 S312 K317 W318	L222-T314 HydrophobicContact CD2-CG2 4.35Å; Y226-T314 HydrophobicContact CD2-CG2 4.34Å; Y226-T314 HydrophobicContact CE2-CG2 3.47Å; Y226-T314 VanDerWaalsContact CE2-CG2 3.47Å; S312-T314 PolarHBondContact O-N 3.5Å; S312-T314 PolarHBondContact OG-N 3.07Å; T314-K317 PolarHBondContact O-N 3.25Å; T314-W318 WeakPolarHBondContact O-CB 3.14Å; T314-W318 PolarHBondContact O-N 2.85Å
315	S	83.8	Confident	83.9	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.028	23%	0.226	C	C	.	.	H	α-helix	trans	-68.8	-37.5	175	58.4	0	0	0	0	111.5	T309 V310 S312 W318 L319	T309-S315 WeakPolarHBondContact O-CB 3.17Å; T309-S315 PolarHBondContact O-OG 2.87Å; V310-S315 PolarHBondContact O-OG 3.17Å; V310-S315 VanDerWaalsContact O-OG 3.13Å; S312-S315 WeakPolarHBondContact CA-OG 3.23Å; S312-S315 VanDerWaalsContact CB-OG 3.3Å; S312-S315 WeakPolarHBondContact CB-OG 3.48Å; S312-S315 PolarHBondContact N-OG 3.22Å; S312-S315 VanDerWaalsContact N-OG 3.16Å; S312-S315 PolarHBondContact O-N 3.25Å; S312-S315 PolarHBondContact O-OG 3.15Å; S315-W318 PolarHBondContact O-N 3.05Å; S315-L319 WeakPolarHBondContact O-CB 3.36Å; S315-L319 PolarHBondContact O-N 3.43Å
316	L	85	Confident	82.7	Confident	51 Å²	51	38.2 Å²	38.2	27%	0.267	21%	0.21	S	C	.	.	H	α-helix	trans	-61	-46.6	173.3	-167.7	80.4	0	0	0	110.8	W176 P177 S312 L319 Q320	W176-L316 HydrophobicContact CH2-CD1 4.31Å; W176-L316 HydrophobicContact CZ2-CD1 3.73Å; W176-L316 HydrophobicContact CZ2-CG 4.46Å; P177-L316 HydrophobicContact CB-CD1 4.03Å; P177-L316 HydrophobicContact CG-CD1 3.53Å; S312-L316 WeakPolarHBondContact O-CB 3.29Å; S312-L316 PolarHBondContact O-N 3.45Å; L316-L319 PolarHBondContact O-N 3.29Å; L316-Q320 WeakPolarHBondContact O-CB 3.45Å; L316-Q320 VanDerWaalsContact O-CG 3.3Å; L316-Q320 WeakPolarHBondContact O-CG 3.37Å; L316-Q320 PolarHBondContact O-N 2.95Å
317	K	80.6	Confident	81.4	Confident	102 Å²	102	39.7 Å²	39.7	44%	0.443	22%	0.217	S	C	.	.	H	α-helix	trans	-61.2	-45.9	175.1	-177	-176	173.1	-170.4	0	111.7	P313 T314 L319 Q320 Q321	P313-K317 WeakPolarHBondContact O-CB 3.23Å; P313-K317 PolarHBondContact O-N 3.24Å; T314-K317 PolarHBondContact O-N 3.25Å; K317-L319 VanDerWaalsContact C-N 3.33Å; K317-L319 PolarHBondContact O-N 2.84Å; K317-Q320 PolarHBondContact O-N 3.37Å; K317-Q321 HydrophobicContact CG-CG 4.37Å; K317-Q321 WeakPolarHBondContact O-CB 3.31Å; K317-Q321 WeakPolarHBondContact O-CG 3.42Å; K317-Q321 PolarHBondContact O-N 3Å
318	W	85	Confident	79.7	Confident	17 Å²	17	41.5 Å²	41.5	6%	0.064	23%	0.227	C	C	.	.	H	α-helix	trans	-58.8	-43.5	176.7	175	90	0	0	0	111.8	I25 D223 Y226 S227 F230 T314 S315 Q321 S322	I25-W318 HydrophobicContact CG2-CH2 4.13Å; I25-W318 HydrophobicContact CG2-CZ2 4.26Å; D223-W318 PolarHBondContact O-NE1 2.97Å; D223-W318 VanDerWaalsContact O-NE1 3.1Å; Y226-W318 HydrophobicContact CD2-CB 4.44Å; S227-W318 VanDerWaalsContact CA-CZ2 3.45Å; F230-W318 HydrophobicContact CB-CH2 4.06Å; F230-W318 HydrophobicContact CB-CZ3 3.93Å; F230-W318 AromaticContact CD1-CH2 3.9Å; F230-W318 HydrophobicContact CD1-CH2 3.9Å; F230-W318 HydrophobicContact CD1-CZ3 4.07Å; F230-W318 HydrophobicContact CD2-CH2 4.37Å; F230-W318 AromaticContact CD2-CZ3 3.71Å; F230-W318 HydrophobicContact CD2-CZ3 3.71Å; F230-W318 HydrophobicContact CE1-CH2 4.38Å; F230-W318 HydrophobicContact CE1-CZ3 4.47Å; F230-W318 HydrophobicContact CE2-CZ3 4.15Å; F230-W318 AromaticContact CG-CH2 3.88Å; F230-W318 HydrophobicContact CG-CH2 3.88Å; F230-W318 AromaticContact CG-CZ3 3.65Å; F230-W318 HydrophobicContact CG-CZ3 3.65Å; F230-W318 HydrophobicContact CZ-CZ3 4.49Å; T314-W318 WeakPolarHBondContact O-CB 3.14Å; T314-W318 PolarHBondContact O-N 2.85Å; S315-W318 PolarHBondContact O-N 3.05Å; W318-Q321 PolarHBondContact O-N 3.15Å; W318-S322 VanDerWaalsContact O-CB 3.25Å; W318-S322 WeakPolarHBondContact O-CB 3.28Å; W318-S322 PolarHBondContact O-N 2.72Å; W318-S322 PolarHBondContact O-OG 3.31Å
319	L	86.5	Confident	77.6	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-65.4	-44	177.8	-171	159.4	0	0	0	110.9	W176 F180 F230 V310 S315 L316 K317 S322 F323 F324	W176-L319 HydrophobicContact CH2-CD2 3.73Å; W176-L319 HydrophobicContact CZ3-CD2 3.64Å; F180-L319 HydrophobicContact CD1-CD2 4.04Å; F180-L319 HydrophobicContact CE1-CD2 4.21Å; F230-L319 HydrophobicContact CE2-CD1 3.97Å; V310-L319 HydrophobicContact CG1-CD1 4.2Å; S315-L319 WeakPolarHBondContact O-CB 3.36Å; S315-L319 PolarHBondContact O-N 3.43Å; L316-L319 PolarHBondContact O-N 3.29Å; K317-L319 VanDerWaalsContact C-N 3.33Å; K317-L319 PolarHBondContact O-N 2.84Å; L319-S322 PolarHBondContact O-N 2.75Å; L319-F323 HydrophobicContact CD2-CD2 4.48Å; L319-F323 HydrophobicContact CG-CD2 4.23Å; L319-F323 PolarHBondContact O-N 3.39Å; L319-F324 HydrophobicContact CD2-CE2 4.44Å
320	Q	83.4	Confident	75.5	Confident	51 Å²	51	46.5 Å²	46.5	24%	0.238	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-45.5	174.1	-75.1	173.7	-9	0	0	112.1	W176 L316 K317 F324 L335	W176-Q320 HydrophobicContact CH2-CG 4.09Å; W176-Q320 HydrophobicContact CZ2-CG 4.44Å; L316-Q320 WeakPolarHBondContact O-CB 3.45Å; L316-Q320 VanDerWaalsContact O-CG 3.3Å; L316-Q320 WeakPolarHBondContact O-CG 3.37Å; L316-Q320 PolarHBondContact O-N 2.95Å; K317-Q320 PolarHBondContact O-N 3.37Å; Q320-F324 CarbonylContact O-C 3.2Å; Q320-F324 WeakPolarHBondContact O-CA 3.48Å; Q320-F324 WeakPolarHBondContact O-CB 3.47Å; Q320-F324 PolarHBondContact O-N 2.92Å; Q320-L335 HydrophobicContact CG-CD1 4.08Å
321	Q	78.8	Confident	73.3	Confident	31 Å²	31	48.6 Å²	48.6	15%	0.145	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-36	177.5	-72.5	-176.8	-44.4	0	0	112.6	N57 K317 W318 H328	N57-Q321 PolarHBondContact OD1-NE2 3.3Å; N57-Q321 VanDerWaalsContact OD1-NE2 3.14Å; K317-Q321 HydrophobicContact CG-CG 4.37Å; K317-Q321 WeakPolarHBondContact O-CB 3.31Å; K317-Q321 WeakPolarHBondContact O-CG 3.42Å; K317-Q321 PolarHBondContact O-N 3Å; W318-Q321 PolarHBondContact O-N 3.15Å; Q321-H328 VanDerWaalsContact CG-CD2 3.42Å; Q321-H328 WeakPolarHBondContact CG-CD2 3.49Å; Q321-H328 PolarHBondContact NE2-NE2 3.43Å
322	S	78.4	Confident	71.2	Confident	25 Å²	25	55.2 Å²	55.2	18%	0.175	28%	0.281	C	S	.	.	H	α-helix	trans	-76.6	-35.3	-177.5	-61	0	0	0	0	113.6	H21 W318 L319	H21-S322 PolarHBondContact NE2-O 3.45Å; W318-S322 VanDerWaalsContact O-CB 3.25Å; W318-S322 WeakPolarHBondContact O-CB 3.28Å; W318-S322 PolarHBondContact O-N 2.72Å; W318-S322 PolarHBondContact O-OG 3.31Å; L319-S322 PolarHBondContact O-N 2.75Å
323	F	80.4	Confident	69.6	Low	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-113.1	-18.3	-173.9	-68	-82	0	0	0	114.9	F18 L22 I25 T143 F180 L184 F230 L319	F18-F323 HydrophobicContact CE2-CD1 4.11Å; F18-F323 HydrophobicContact CZ-CD1 4.3Å; F18-F323 HydrophobicContact CZ-CE1 4.44Å; L22-F323 HydrophobicContact CD1-CE1 4.03Å; L22-F323 HydrophobicContact CD1-CZ 3.93Å; I25-F323 HydrophobicContact CD1-CD1 4.31Å; I25-F323 HydrophobicContact CD1-CE1 3.77Å; I25-F323 HydrophobicContact CD1-CE2 4.07Å; I25-F323 HydrophobicContact CD1-CZ 3.63Å; T143-F323 VanDerWaalsContact CB-O 3.29Å; T143-F323 WeakPolarHBondContact CB-O 3.36Å; T143-F323 HydrophobicContact CG2-CB 3.77Å; T143-F323 PolarHBondContact OG1-O 2.96Å; F180-F323 HydrophobicContact CE1-CB 4.17Å; F180-F323 HydrophobicContact CE1-CD1 4.07Å; F180-F323 AromaticContact CE1-CD2 3.9Å; F180-F323 HydrophobicContact CE1-CD2 3.9Å; F180-F323 HydrophobicContact CE1-CE1 4.44Å; F180-F323 HydrophobicContact CE1-CE2 4.28Å; F180-F323 AromaticContact CE1-CG 3.78Å; F180-F323 HydrophobicContact CE1-CG 3.78Å; F180-F323 HydrophobicContact CZ-CB 4.17Å; F180-F323 AromaticContact CZ-CD1 3.86Å; F180-F323 HydrophobicContact CZ-CD1 3.86Å; F180-F323 HydrophobicContact CZ-CD2 4.49Å; F180-F323 HydrophobicContact CZ-CE1 4.37Å; F180-F323 AromaticContact CZ-CG 3.93Å; F180-F323 HydrophobicContact CZ-CG 3.93Å; L184-F323 HydrophobicContact CD1-CE1 4.17Å; L184-F323 HydrophobicContact CD1-CE2 4.38Å; L184-F323 HydrophobicContact CD1-CZ 3.87Å; F230-F323 AromaticContact CE1-CE2 3.99Å; F230-F323 HydrophobicContact CE1-CE2 3.99Å; F230-F323 AromaticContact CE1-CZ 3.97Å; F230-F323 HydrophobicContact CE1-CZ 3.97Å; F230-F323 HydrophobicContact CE2-CE2 4.4Å; F230-F323 AromaticContact CZ-CE2 3.62Å; F230-F323 HydrophobicContact CZ-CE2 3.62Å; F230-F323 AromaticContact CZ-CZ 3.87Å; F230-F323 HydrophobicContact CZ-CZ 3.87Å; L319-F323 HydrophobicContact CD2-CD2 4.48Å; L319-F323 HydrophobicContact CG-CD2 4.23Å; L319-F323 PolarHBondContact O-N 3.39Å
324	F	78.3	Confident	68.9	Low	3 Å²	3	54.3 Å²	54.3	1%	0.013	27%	0.267	C	S	.	.			trans	-124.4	48	177.5	-54.5	-99.9	0	0	0	113.1	T140 T143 L144 L147 W176 L319 Q320 S326 L327 L335	T140-F324 HydrophobicContact CG2-CB 4.46Å; T143-F324 HydrophobicContact CG2-CD1 3.86Å; T143-F324 HydrophobicContact CG2-CD2 3.93Å; T143-F324 HydrophobicContact CG2-CE1 3.45Å; T143-F324 VanDerWaalsContact CG2-CE1 3.45Å; T143-F324 HydrophobicContact CG2-CE2 3.53Å; T143-F324 HydrophobicContact CG2-CG 4.1Å; T143-F324 HydrophobicContact CG2-CZ 3.29Å; L144-F324 HydrophobicContact CD2-CD1 4.13Å; L144-F324 HydrophobicContact CD2-CE1 3.91Å; L144-F324 HydrophobicContact CG-CD1 4.41Å; L144-F324 HydrophobicContact CG-CE1 4.39Å; L147-F324 HydrophobicContact CD2-CE1 4.28Å; L147-F324 HydrophobicContact CD2-CZ 4.4Å; W176-F324 HydrophobicContact CH2-CE2 4.25Å; W176-F324 AromaticContact CZ3-CE2 3.85Å; W176-F324 HydrophobicContact CZ3-CE2 3.85Å; W176-F324 HydrophobicContact CZ3-CZ 4.2Å; L319-F324 HydrophobicContact CD2-CE2 4.44Å; Q320-F324 CarbonylContact O-C 3.2Å; Q320-F324 WeakPolarHBondContact O-CA 3.48Å; Q320-F324 WeakPolarHBondContact O-CB 3.47Å; Q320-F324 PolarHBondContact O-N 2.92Å; F324-S326 VanDerWaalsContact C-N 3.27Å; F324-S326 PolarHBondContact O-N 3.05Å; F324-S326 VanDerWaalsContact O-N 3.13Å; F324-L327 HydrophobicContact CB-CB 4.31Å; F324-L327 HydrophobicContact CB-CD1 3.76Å; F324-L327 HydrophobicContact CB-CG 4.02Å; F324-L327 HydrophobicContact CD1-CD1 3.71Å; F324-L327 HydrophobicContact CG-CD1 4.04Å; F324-L327 PolarHBondContact O-N 3.3Å; F324-L335 HydrophobicContact CD1-CD1 4.39Å; F324-L335 HydrophobicContact CD2-CD1 4.07Å; F324-L335 HydrophobicContact CE1-CD1 4.18Å; F324-L335 HydrophobicContact CE2-CD1 3.85Å; F324-L335 HydrophobicContact CG-CD1 4.32Å; F324-L335 HydrophobicContact CZ-CD1 3.89Å
325	P	68.7	Low	68.7	Low	14 Å²	14	52 Å²	52	9%	0.091	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-34.5	-170.2	23.8	-35.3	0	0	0	113.9	L136 T140 L327	L136-P325 HydrophobicContact CB-CG 4.36Å; L136-P325 HydrophobicContact CD2-CB 4.01Å; L136-P325 HydrophobicContact CD2-CG 3.77Å; T140-P325 WeakPolarHBondContact OG1-CD 3.49Å; P325-L327 PolarHBondContact O-N 3.36Å
326	S	64.9	Low	68.4	Low	13 Å²	13	56.7 Å²	56.7	9%	0.091	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-25.7	179.9	-59.3	0	0	0	0	114	L136 N137 T140 F324 H329	L136-S326 WeakPolarHBondContact CB-OG 3.2Å; L136-S326 PolarHBondContact O-OG 3.09Å; N137-S326 VanDerWaalsContact OD1-CB 3.27Å; N137-S326 WeakPolarHBondContact OD1-CB 3.25Å; N137-S326 PolarHBondContact OD1-OG 3.02Å; T140-S326 WeakPolarHBondContact OG1-CB 3.46Å; T140-S326 PolarHBondContact OG1-N 2.98Å; T140-S326 PolarHBondContact OG1-OG 3.41Å; F324-S326 VanDerWaalsContact C-N 3.27Å; F324-S326 PolarHBondContact O-N 3.05Å; F324-S326 VanDerWaalsContact O-N 3.13Å; S326-H329 PolarHBondContact O-N 2.95Å
327	L	65.1	Low	68.1	Low	35 Å²	35	57.8 Å²	57.8	18%	0.183	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-43.5	176.8	-64.9	-174.5	0	0	0	111	T140 F324 P325 H329 Y330 S331 L338	T140-L327 HydrophobicContact CG2-CD2 4.5Å; T140-L327 HydrophobicContact CG2-CG 4.13Å; F324-L327 HydrophobicContact CB-CB 4.31Å; F324-L327 HydrophobicContact CB-CD1 3.76Å; F324-L327 HydrophobicContact CB-CG 4.02Å; F324-L327 HydrophobicContact CD1-CD1 3.71Å; F324-L327 HydrophobicContact CG-CD1 4.04Å; F324-L327 PolarHBondContact O-N 3.3Å; P325-L327 PolarHBondContact O-N 3.36Å; L327-H329 PolarHBondContact O-N 3.26Å; L327-H329 VanDerWaalsContact O-N 3.13Å; L327-Y330 PolarHBondContact O-N 3.44Å; L327-S331 PolarHBondContact O-N 2.94Å; L327-L338 HydrophobicContact CD1-CD2 3.47Å; L327-L338 VanDerWaalsContact CD1-CD2 3.47Å; L327-L338 HydrophobicContact CD2-CD2 3.93Å; L327-L338 HydrophobicContact CG-CD2 4.38Å
328	H	55	Low	68.1	Low	106 Å²	106	53.7 Å²	53.7	49%	0.491	26%	0.262	S	S	.	.	H	α-helix	trans	-68.3	-10.1	-177.9	-160.5	-51.6	0	0	0	112.9	Q321	Q321-H328 VanDerWaalsContact CG-CD2 3.42Å; Q321-H328 WeakPolarHBondContact CG-CD2 3.49Å; Q321-H328 PolarHBondContact NE2-NE2 3.43Å
329	H	47.7	Very low	68	Low	101 Å²	101	52.9 Å²	52.9	47%	0.468	26%	0.259	S	S	.	.	H	α-helix	trans	-102.5	-20.9	-177.1	-133.1	57.7	0	0	0	114.3	S326 L327	S326-H329 PolarHBondContact O-N 2.95Å; L327-H329 PolarHBondContact O-N 3.26Å; L327-H329 VanDerWaalsContact O-N 3.13Å
330	Y	43.2	Very low	67.9	Low	137 Å²	137	56 Å²	56	54%	0.537	27%	0.274	S	S	.	.	H	α-helix	trans	-135.4	4.2	-167.4	-67.3	-63.6	0	0	0	117.3	L133 L327	L133-Y330 HydrophobicContact CD2-CE2 4.37Å; L327-Y330 PolarHBondContact O-N 3.44Å
331	S	41.5	Very low	67.9	Low	47 Å²	47	56 Å²	56	33%	0.329	27%	0.273	S	S	.	.			trans	-151.9	139.5	176.2	64.1	0	0	0	0	115	L327 K333	L327-S331 PolarHBondContact O-N 2.94Å; S331-K333 PolarHBondContact O-N 3.33Å
332	H	41.3	Very low	68	Low	208 Å²	208	54.9 Å²	54.9	96%	0.963	27%	0.268	S	S	*	.			trans	-74.8	11.9	166.5	-75.9	-80.8	0	0	0	113.7
333	K	52	Low	68.3	Low	88 Å²	88	54.9 Å²	54.9	38%	0.383	27%	0.266	S	S	.	.			trans	-74.4	128.3	172	-86.1	-163.4	163.4	-156.4	0	109.2	S331 L337 E341	S331-K333 PolarHBondContact O-N 3.33Å; K333-L337 HydrophobicContact CB-CB 4.32Å; K333-L337 HydrophobicContact CD-CB 4.07Å; K333-L337 HydrophobicContact CG-CB 4.1Å; K333-L337 HydrophobicContact CG-CD1 4.2Å; K333-L337 PolarHBondContact NZ-O 2.65Å; K333-E341 IonicContact NZ-OE2 2.66Å; K333-E341 PolarHBondContact NZ-OE2 2.92Å
334	S	68	Low	68.3	Low	43 Å²	43	61.6 Å²	61.6	30%	0.301	30%	0.297	S	S	.	.			trans	-65.4	159	159.7	63.4	0	0	0	0	109.8	E336 L337 L338	S334-E336 WeakPolarHBondContact CB-OE2 3.47Å; S334-E336 PolarHBondContact O-N 2.82Å; S334-E336 PolarHBondContact OG-OE2 3.24Å; S334-L337 PolarHBondContact O-N 2.96Å; S334-L338 PolarHBondContact O-N 3.3Å
335	L	74.5	Confident	67.7	Low	13 Å²	13	68 Å²	68	7%	0.068	32%	0.324	C	S	.	.	S	Bend	trans	-64.4	-23.5	176.7	-167.1	151.6	0	0	0	111.3	L147 W176 Q320 F324 L338 I339	L147-L335 HydrophobicContact CD2-CD2 4.24Å; W176-L335 HydrophobicContact CD2-CD2 3.83Å; W176-L335 VanDerWaalsContact CE2-CD2 3.47Å; W176-L335 HydrophobicContact CE3-CD2 4.32Å; W176-L335 HydrophobicContact CG-CD2 4.34Å; W176-L335 HydrophobicContact CH2-CD1 3.69Å; W176-L335 HydrophobicContact CH2-CD2 4.21Å; W176-L335 HydrophobicContact CZ2-CD1 3.84Å; W176-L335 HydrophobicContact CZ2-CD2 3.7Å; W176-L335 HydrophobicContact CZ2-CG 4.31Å; W176-L335 HydrophobicContact CZ3-CD1 4.19Å; W176-L335 HydrophobicContact CZ3-CD2 4.49Å; Q320-L335 HydrophobicContact CG-CD1 4.08Å; F324-L335 HydrophobicContact CD1-CD1 4.39Å; F324-L335 HydrophobicContact CD2-CD1 4.07Å; F324-L335 HydrophobicContact CE1-CD1 4.18Å; F324-L335 HydrophobicContact CE2-CD1 3.85Å; F324-L335 HydrophobicContact CG-CD1 4.32Å; F324-L335 HydrophobicContact CZ-CD1 3.89Å; L335-L338 CarbonylContact O-C 3.56Å; L335-L338 WeakPolarHBondContact O-CA 3.2Å; L335-L338 WeakPolarHBondContact O-CB 3.34Å; L335-L338 PolarHBondContact O-N 3.11Å; L335-L338 VanDerWaalsContact O-N 3.09Å; L335-I339 HydrophobicContact CD2-CD1 3.51Å; L335-I339 HydrophobicContact CD2-CG1 3.84Å; L335-I339 PolarHBondContact O-N 3.33Å
336	E	78.2	Confident	67	Low	103 Å²	103	70.5 Å²	70.5	48%	0.481	34%	0.335	S	S	.	.	H	α-helix	trans	-59.6	-50.2	172.1	-52.7	138.8	153.3	0	0	111.3	N173 S334 L338 I339 E340	N173-E336 WeakPolarHBondContact OD1-CA 3.36Å; S334-E336 WeakPolarHBondContact CB-OE2 3.47Å; S334-E336 PolarHBondContact O-N 2.82Å; S334-E336 PolarHBondContact OG-OE2 3.24Å; E336-L338 PolarHBondContact O-N 2.82Å; E336-L338 VanDerWaalsContact O-N 3.09Å; E336-I339 PolarHBondContact O-N 2.89Å; E336-I339 VanDerWaalsContact O-N 3.09Å; E336-E340 WeakPolarHBondContact O-CG 3.43Å; E336-E340 PolarHBondContact O-N 3.3Å
337	L	77.9	Confident	65.7	Low	75 Å²	75	76.8 Å²	76.8	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-64.9	-11.7	175.2	-68.5	173.7	0	0	0	113.6	K333 S334 E341	K333-L337 HydrophobicContact CB-CB 4.32Å; K333-L337 HydrophobicContact CD-CB 4.07Å; K333-L337 HydrophobicContact CG-CB 4.1Å; K333-L337 HydrophobicContact CG-CD1 4.2Å; K333-L337 PolarHBondContact NZ-O 2.65Å; S334-L337 PolarHBondContact O-N 2.96Å; L337-E341 WeakPolarHBondContact O-CB 3.43Å
338	L	81.7	Confident	64.1	Low	15 Å²	15	84.6 Å²	84.6	8%	0.079	40%	0.395	C	S	.	.	H	α-helix	trans	-92.7	-40.9	171.9	-169.4	66.5	0	0	0	111.1	L144 L327 S334 L335 E336 E340 E341 L342	L144-L338 HydrophobicContact CD2-CD2 3.51Å; L144-L338 HydrophobicContact CD2-CG 4.4Å; L327-L338 HydrophobicContact CD1-CD2 3.47Å; L327-L338 VanDerWaalsContact CD1-CD2 3.47Å; L327-L338 HydrophobicContact CD2-CD2 3.93Å; L327-L338 HydrophobicContact CG-CD2 4.38Å; S334-L338 PolarHBondContact O-N 3.3Å; L335-L338 CarbonylContact O-C 3.56Å; L335-L338 WeakPolarHBondContact O-CA 3.2Å; L335-L338 WeakPolarHBondContact O-CB 3.34Å; L335-L338 PolarHBondContact O-N 3.11Å; L335-L338 VanDerWaalsContact O-N 3.09Å; E336-L338 PolarHBondContact O-N 2.82Å; E336-L338 VanDerWaalsContact O-N 3.09Å; L338-E340 VanDerWaalsContact C-N 3.33Å; L338-E340 PolarHBondContact O-N 2.77Å; L338-E341 PolarHBondContact O-N 3.32Å; L338-L342 HydrophobicContact CG-CD1 4.15Å; L338-L342 HydrophobicContact CG-CG 4.41Å; L338-L342 WeakPolarHBondContact O-CB 3.35Å; L338-L342 WeakPolarHBondContact O-CG 3.49Å; L338-L342 PolarHBondContact O-N 3.3Å
339	I	83	Confident	62.9	Low	1 Å²	1	84.2 Å²	84.2	1%	0.005	40%	0.404	C	S	.	.	H	α-helix	trans	-58.9	-46.1	171	-74.3	171.7	0	0	0	110.1	L147 I151 L172 N173 W176 L335 E336 E341 L342 F343	L147-I339 HydrophobicContact CD1-CD1 4.23Å; L147-I339 HydrophobicContact CD1-CG1 4.15Å; L147-I339 HydrophobicContact CD2-CG1 3.96Å; L147-I339 HydrophobicContact CG-CG1 4.36Å; I151-I339 HydrophobicContact CD1-CG2 4.41Å; L172-I339 HydrophobicContact CB-CG2 4.05Å; N173-I339 WeakPolarHBondContact OD1-CB 3.36Å; N173-I339 WeakPolarHBondContact OD1-CG2 3.31Å; W176-I339 HydrophobicContact CB-CD1 3.9Å; W176-I339 HydrophobicContact CD2-CD1 4.31Å; W176-I339 HydrophobicContact CG-CD1 3.56Å; L335-I339 HydrophobicContact CD2-CD1 3.51Å; L335-I339 HydrophobicContact CD2-CG1 3.84Å; L335-I339 PolarHBondContact O-N 3.33Å; E336-I339 PolarHBondContact O-N 2.89Å; E336-I339 VanDerWaalsContact O-N 3.09Å; I339-E341 PolarHBondContact O-N 2.91Å; I339-L342 PolarHBondContact O-N 3.4Å; I339-F343 WeakPolarHBondContact O-CB 3.47Å; I339-F343 PolarHBondContact O-N 2.83Å
340	E	84.3	Confident	61.9	Low	68 Å²	68	85 Å²	85	32%	0.318	41%	0.412	S	S	.	.	H	α-helix	trans	-56.5	-48.3	174	-71.1	171.1	-172.2	0	0	111.5	L169 E336 L338 L342 F343 E344	L169-E340 HydrophobicContact CD1-CG 4.26Å; L169-E340 HydrophobicContact CD2-CB 4.49Å; L169-E340 HydrophobicContact CD2-CG 3.99Å; E336-E340 WeakPolarHBondContact O-CG 3.43Å; E336-E340 PolarHBondContact O-N 3.3Å; L338-E340 VanDerWaalsContact C-N 3.33Å; L338-E340 PolarHBondContact O-N 2.77Å; E340-L342 PolarHBondContact O-N 3.27Å; E340-F343 PolarHBondContact O-N 3.11Å; E340-E344 WeakPolarHBondContact O-CG 3.16Å; E340-E344 PolarHBondContact O-N 3.01Å
341	E	82.8	Confident	61.3	Low	49 Å²	49	86.8 Å²	86.8	23%	0.229	42%	0.423	C	S	.	.	H	α-helix	trans	-64.8	-39.2	179	176	171	-161.4	0	0	113.2	K333 L337 L338 I339 K345	K333-E341 IonicContact NZ-OE2 2.66Å; K333-E341 PolarHBondContact NZ-OE2 2.92Å; L337-E341 WeakPolarHBondContact O-CB 3.43Å; L338-E341 PolarHBondContact O-N 3.32Å; I339-E341 PolarHBondContact O-N 2.91Å; E341-K345 HydrophobicContact CG-CD 3.75Å; E341-K345 HydrophobicContact CG-CG 4.43Å; E341-K345 WeakPolarHBondContact O-CB 3.46Å; E341-K345 WeakPolarHBondContact O-CG 3.22Å; E341-K345 PolarHBondContact O-N 3.36Å; E341-K345 VanDerWaalsContact O-N 3.14Å; E341-K345 WeakPolarHBondContact OE1-CE 3.45Å; E341-K345 IonicContact OE1-NZ 3.83Å; E341-K345 PolarHBondContact OE1-NZ 2.68Å
342	L	81.9	Confident	60.7	Low	8 Å²	8	89.7 Å²	89.7	4%	0.042	44%	0.443	C	S	.	.	H	α-helix	trans	-69.2	-41.5	175.6	-66.4	169	0	0	0	110.7	L144 L147 L148 I151 L338 I339 E340 K345 F356	L144-L342 HydrophobicContact CD2-CD1 4.34Å; L147-L342 HydrophobicContact CD2-CD1 3.85Å; L147-L342 HydrophobicContact CG-CD1 4.19Å; L148-L342 HydrophobicContact CD1-CD2 4.38Å; L148-L342 HydrophobicContact CD2-CB 4.1Å; L148-L342 HydrophobicContact CD2-CD2 3.84Å; L148-L342 HydrophobicContact CD2-CG 4.4Å; L148-L342 HydrophobicContact CG-CD2 4.09Å; I151-L342 HydrophobicContact CD1-CB 3.72Å; I151-L342 HydrophobicContact CD1-CD1 4.25Å; L338-L342 HydrophobicContact CG-CD1 4.15Å; L338-L342 HydrophobicContact CG-CG 4.41Å; L338-L342 WeakPolarHBondContact O-CB 3.35Å; L338-L342 WeakPolarHBondContact O-CG 3.49Å; L338-L342 PolarHBondContact O-N 3.3Å; I339-L342 PolarHBondContact O-N 3.4Å; E340-L342 PolarHBondContact O-N 3.27Å; L342-K345 PolarHBondContact O-N 2.9Å; L342-F356 HydrophobicContact CD2-CZ 3.73Å
343	F	84.3	Confident	60.1	Low	26 Å²	26	83.4 Å²	83.4	11%	0.114	42%	0.423	C	S	.	.	H	α-helix	trans	-62.2	-43.6	179.7	-173.2	-95	0	0	0	112.3	I151 K155 F160 Q168 L169 L172 I339 E340	I151-F343 HydrophobicContact CG2-CD2 4.05Å; K155-F343 HydrophobicContact CD-CD2 3.86Å; K155-F343 HydrophobicContact CD-CE2 3.74Å; K155-F343 HydrophobicContact CD-CZ 4.49Å; K155-F343 HydrophobicContact CG-CD2 4.33Å; K155-F343 HydrophobicContact CG-CE2 3.74Å; K155-F343 HydrophobicContact CG-CZ 4.42Å; K155-F343 PolarHBondContact NZ-O 2.97Å; F160-F343 AromaticContact CE1-CE2 3.96Å; F160-F343 HydrophobicContact CE1-CE2 3.96Å; F160-F343 HydrophobicContact CE1-CZ 4.33Å; F160-F343 HydrophobicContact CZ-CE2 4.28Å; Q168-F343 HydrophobicContact CB-CZ 4.04Å; L169-F343 HydrophobicContact CD2-CB 3.85Å; L169-F343 HydrophobicContact CD2-CD1 3.55Å; L169-F343 HydrophobicContact CD2-CD2 4.32Å; L169-F343 HydrophobicContact CD2-CE1 4.16Å; L169-F343 HydrophobicContact CD2-CG 3.65Å; L169-F343 HydrophobicContact CG-CD1 4.18Å; L169-F343 HydrophobicContact CG-CE1 4.35Å; L172-F343 HydrophobicContact CD1-CD2 3.45Å; L172-F343 VanDerWaalsContact CD1-CD2 3.45Å; L172-F343 HydrophobicContact CD1-CE2 3.6Å; I339-F343 WeakPolarHBondContact O-CB 3.47Å; I339-F343 PolarHBondContact O-N 2.83Å; E340-F343 PolarHBondContact O-N 3.11Å
344	E	80.4	Confident	59.2	Low	140 Å²	140	83.9 Å²	83.9	65%	0.654	43%	0.429	S	S	*	.	H	α-helix	trans	-72.9	-40.6	177.3	-71.4	-170.6	157.7	0	0	113.6	E340 E346	E340-E344 WeakPolarHBondContact O-CG 3.16Å; E340-E344 PolarHBondContact O-N 3.01Å; E344-E346 PolarHBondContact O-N 3.06Å
345	K	65.7	Low	57.4	Low	137 Å²	137	86.2 Å²	86.2	60%	0.596	45%	0.445	S	S	*	.	H	α-helix	trans	-72.2	-18.4	-165.6	-83.7	-177.7	171.5	-177.9	0	116.5	E341 L342 L347	E341-K345 HydrophobicContact CG-CD 3.75Å; E341-K345 HydrophobicContact CG-CG 4.43Å; E341-K345 WeakPolarHBondContact O-CB 3.46Å; E341-K345 WeakPolarHBondContact O-CG 3.22Å; E341-K345 PolarHBondContact O-N 3.36Å; E341-K345 VanDerWaalsContact O-N 3.14Å; E341-K345 WeakPolarHBondContact OE1-CE 3.45Å; E341-K345 IonicContact OE1-NZ 3.83Å; E341-K345 PolarHBondContact OE1-NZ 2.68Å; L342-K345 PolarHBondContact O-N 2.9Å; K345-L347 PolarHBondContact O-N 3.43Å; K345-L347 VanDerWaalsContact O-N 3.07Å
346	E	54.1	Low	55.5	Low	68 Å²	68	88.6 Å²	88.6	32%	0.318	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-9	-175.3	-71.8	177.4	155.4	0	0	114.9	L148 K155 E344 Y348	L148-E346 WeakPolarHBondContact CD2-OE1 3.26Å; K155-E346 WeakPolarHBondContact CE-OE2 3.14Å; K155-E346 IonicContact NZ-OE2 2.61Å; K155-E346 PolarHBondContact NZ-OE2 3.38Å; E344-E346 PolarHBondContact O-N 3.06Å; E346-Y348 VanDerWaalsContact C-N 3.26Å; E346-Y348 PolarHBondContact O-N 2.98Å
347	L	36.8	Very low	53	Low	144 Å²	144	93.8 Å²	93.8	75%	0.754	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-0.8	-178.7	-71.8	174.1	0	0	0	115.4	K345	K345-L347 PolarHBondContact O-N 3.43Å; K345-L347 VanDerWaalsContact O-N 3.07Å
348	Y	32.2	Very low	50.9	Low	200 Å²	200	97.2 Å²	97.2	78%	0.784	48%	0.479	S	S	*	.	S	Bend	trans	-129.1	89.9	178.5	-71.2	-80.2	0	0	0	114.5	E346	E346-Y348 VanDerWaalsContact C-N 3.26Å; E346-Y348 PolarHBondContact O-N 2.98Å
349	S	29.3	Very low	48.2	Very low	97 Å²	97	101.3 Å²	101.3	68%	0.678	50%	0.501	S	S	*	.			trans	34.2	94.1	144.7	62.4	0	0	0	0	118.9
350	N	27.1	Very low	45.6	Very low	118 Å²	118	108.5 Å²	108.5	63%	0.631	53%	0.534	S	S	*	.				177.2	118.3	116	-88.4	-32.5	0	0	0	111.8	S352	N350-S352 PolarHBondContact O-N 2.81Å
351	K	30.5	Very low	42.9	Very low	175 Å²	175	112.5 Å²	112.5	76%	0.761	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	40.5	177.3	-68.7	-160.2	168.1	-146.1	0	113.9	Y12	Y12-K351 PolarHBondContact OH-NZ 3.01Å
352	S	29.3	Very low	40.2	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.4	5.7	-175.2	55.3	0	0	0	0	114.3	N350	N350-S352 PolarHBondContact O-N 2.81Å
353	S	28.1	Very low	37.4	Very low	76 Å²	76	122.9 Å²	122.9	53%	0.531	62%	0.618	S	S	.	*			trans	-137.9	40.5	-172.3	63	0	0	0	0	115.4	S355	S353-S355 PolarHBondContact O-N 3.44Å
354	L	32.1	Very low	34.7	Very low	97 Å²	97	132.6 Å²	132.6	51%	0.508	66%	0.655	S	S	.	*			trans	-79	25.9	162.5	-74	175.8	0	0	0	113.1	L148 F356	L148-L354 HydrophobicContact CD1-CD1 3.99Å; L148-L354 HydrophobicContact CD1-CD2 3.78Å; L354-F356 HydrophobicContact CD2-CE2 4.3Å; L354-F356 PolarHBondContact O-N 3.18Å
355	S	30.4	Very low	32	Very low	92 Å²	92	130.6 Å²	130.6	64%	0.643	66%	0.662	S	S	*	*			trans	-77.7	93.1	158.8	-179.2	0	0	0	0	107.8	S353 R357	S353-S355 PolarHBondContact O-N 3.44Å; S355-R357 PolarHBondContact O-N 3.09Å
356	F	34.6	Very low	30.1	Very low	63 Å²	63	130.1 Å²	130.1	28%	0.276	67%	0.671	S	S	.	*			trans	-60.4	103.5	170.7	-84.1	-83.1	0	0	0	109.5	L148 L342 L354 Y358	L148-F356 HydrophobicContact CD1-CE2 4.34Å; L342-F356 HydrophobicContact CD2-CZ 3.73Å; L354-F356 HydrophobicContact CD2-CE2 4.3Å; L354-F356 PolarHBondContact O-N 3.18Å; F356-Y358 PolarHBondContact O-N 3.1Å
357	R	26.6	Very low	28.7	Very low	212 Å²	212	134.5 Å²	134.5	80%	0.8	70%	0.697	S	S	*	*			trans	-73.8	59.8	173.9	-69.5	-170.5	-179.3	-179.9	1	111.9	S355	S355-R357 PolarHBondContact O-N 3.09Å
358	Y	33	Very low	28.5	Very low	147 Å²	147	134.8 Å²	134.8	58%	0.576	71%	0.705	S	S	*	*			trans	-72.9	-19.7	163.7	-103.6	-84.2	0	0	0	112.1	F356 H360	F356-Y358 PolarHBondContact O-N 3.1Å; Y358-H360 PolarHBondContact O-N 3.4Å
359	N	26.1	Very low	28.2	Very low	101 Å²	101	128.6 Å²	128.6	54%	0.54	70%	0.702	S	S	.	*	S	Bend	trans	-84.8	95.4	167.4	-69.4	-11.4	0	0	0	110.8	N137	N137-N359 PolarHBondContact ND2-OD1 3.46Å
360	H	28.2	Very low	28.1	Very low	153 Å²	153	132 Å²	132	71%	0.708	71%	0.707	S	S	*	*	S	Bend	trans	-165.5	-21.9	148.3	-120	-62.3	0	0	0	118.1	Y358	Y358-H360 PolarHBondContact O-N 3.4Å
361	N	26.8	Very low	28.2	Very low	152 Å²	152	135.3 Å²	135.3	81%	0.813	71%	0.712	S	S	*	*	S	Bend	trans	-104.7	6.7	-165.9	-79.2	7.4	0	0	0	116.7
362	M	26.8	Very low	28	Very low	190 Å²	190	131 Å²	131	94%	0.936	70%	0.704	S	S	*	*			trans	-125.4	81.1	177.4	-83.6	-66.8	170.3	0	0	112.5
363	S	23.9	Very low	28.3	Very low	85 Å²	85	134.5 Å²	134.5	59%	0.594	71%	0.708	S	S	*	*			trans	-147.3	153.7	159.6	56	0	0	0	0	108.8
364	Y	26.3	Very low	28.4	Very low	230 Å²	230	137.1 Å²	137.1	90%	0.902	72%	0.721	S	S	*	*			trans	69.6	71.6	-179.6	-44.7	-72.9	0	0	0	117.1
365	A	24.2	Very low	28.6	Very low	97 Å²	97	137.1 Å²	137.1	80%	0.802	73%	0.727	S	S	*	*			trans	-148.9	23.9	166.7	0	0	0	0	0	115.7
366	T	25	Very low	28.9	Very low	127 Å²	127	140.6 Å²	140.6	78%	0.779	73%	0.732	S	S	*	*	S	Bend	trans	-136.5	114.2	-179	54.8	0	0	0	0	113.9
367	N	26.2	Very low	28.7	Very low	160 Å²	160	142.1 Å²	142.1	86%	0.856	75%	0.751	S	S	*	*			trans	53.1	96.7	152.1	-59.7	-9.2	0	0	0	119.7
368	T	31.8	Very low	29.1	Very low	151 Å²	151	139.4 Å²	139.4	93%	0.926	75%	0.752	S	S	*	*			trans	-126.1	109.6	133.2	54.5	0	0	0	0	108.2
369	G	25.9	Very low	29	Very low	70 Å²	70	139.5 Å²	139.5	72%	0.722	76%	0.761	S	S	*	*			trans	-115	127.6	168.7	0	0	0	0	0	109.3
370	E	26.7	Very low	30.1	Very low	167 Å²	167	139.9 Å²	139.9	78%	0.78	77%	0.769	S	S	*	*			trans	-173.1	150.1	151.5	-111.3	168.4	-158.2	0	0	112.2
371	Y	29.4	Very low	30.7	Very low	189 Å²	189	138.2 Å²	138.2	74%	0.741	77%	0.772	S	S	*	*			trans	53.1	98.9	164.5	-57.5	-60.7	0	0	0	122.4
372	S	27.1	Very low	31.2	Very low	85 Å²	85	136.3 Å²	136.3	59%	0.594	77%	0.768	S	S	*	*				40	124	127	56.9	0	0	0	0	119.9
373	H	34.4	Very low	32.2	Very low	181 Å²	181	132.8 Å²	132.8	84%	0.838	76%	0.759	S	S	*	*				-162.5	173.7	72.1	-91.9	-78	0	0	0	113.6
374	T	31.4	Very low	33.1	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	77%	0.766	S	S	*	*			trans	-116	-178.1	-168.8	51.2	0	0	0	0	112.6
375	P	36.8	Very low	33.4	Very low	97 Å²	97	131.5 Å²	131.5	63%	0.63	77%	0.767	S	S	*	*				-129.4	-172.9	-52.3	38.4	-23.4	0	0	0	111.7
376	H	34.9	Very low	33.7	Very low	165 Å²	165	132 Å²	132	76%	0.764	76%	0.764	S	S	*	*				170.3	136.2	128.1	-95.4	-64.2	0	0	0	115.1
377	S	32.4	Very low	34.2	Very low	95 Å²	95	134.1 Å²	134.1	66%	0.664	77%	0.77	S	S	*	*			trans	50.8	131.6	131.5	-55.8	0	0	0	0	121.6
378	L	35	Very low	34.6	Very low	155 Å²	155	131.4 Å²	131.4	81%	0.812	76%	0.761	S	S	*	*			cis	-157.7	-173.1	-8.8	-35.7	85.7	0	0	0	107.2
379	L	30.6	Very low	34.6	Very low	148 Å²	148	129.6 Å²	129.6	78%	0.775	75%	0.754	S	S	*	*			cis	-159.7	145	-12.1	-161	73.5	0	0	0	109.1
380	P	47.9	Very low	34.9	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	75%	0.754	S	S	*	*			trans	-96.4	160.4	165.8	38.1	-34.6	0	0	0	112.4
381	P	40.5	Very low	35.2	Very low	119 Å²	119	130 Å²	130	77%	0.773	75%	0.752	S	S	*	*				-158.8	-144.8	84	45.8	-24.1	0	0	0	112.2
382	P	37.9	Very low	35.3	Very low	112 Å²	112	125.9 Å²	125.9	73%	0.727	75%	0.751	S	S	*	*			cis	-125.7	178.6	-32.8	37.9	-21.6	0	0	0	114.2
383	P	47.6	Very low	35.5	Very low	116 Å²	116	125.9 Å²	125.9	75%	0.753	76%	0.756	S	S	*	*			trans	-110.8	158.4	172.6	39.5	-32	0	0	0	115.7
384	P	42.5	Very low	35.4	Very low	115 Å²	115	122.6 Å²	122.6	75%	0.747	75%	0.754	S	S	*	*			trans	-105.5	127.3	160.4	35.2	-25.9	0	0	0	111.3
385	L	32.6	Very low	35.4	Very low	173 Å²	173	121.1 Å²	121.1	91%	0.906	75%	0.749	S	S	*	*				89.2	129.5	65.6	-81	169.2	0	0	0	114.3
386	S	30.6	Very low	35.1	Very low	106 Å²	106	124 Å²	124	74%	0.741	76%	0.758	S	S	*	*			trans	-109.3	159.4	-172.3	52.8	0	0	0	0	112.8
387	L	36.3	Very low	35.1	Very low	173 Å²	173	121.2 Å²	121.2	91%	0.906	76%	0.755	S	S	*	*			trans	-139	155.8	158.4	-92.6	110.5	0	0	0	111.7
388	P	34.9	Very low	34.9	Very low	103 Å²	103	121 Å²	121	67%	0.669	75%	0.753	S	S	*	*			trans	-129.8	-178.9	-155	40.8	-24	0	0	0	115.4
389	S	31.6	Very low	34.4	Very low	113 Å²	113	121.7 Å²	121.7	79%	0.79	75%	0.752	S	S	*	*			trans	64.4	148.1	159.9	47.9	0	0	0	0	117.6
390	S	31.1	Very low	34.3	Very low	101 Å²	101	123.8 Å²	123.8	71%	0.706	76%	0.755	S	S	*	*			cis	-160.8	175.1	-10.9	51.2	0	0	0	0	107.2
391	L	33.5	Very low	33.2	Very low	144 Å²	144	125.8 Å²	125.8	75%	0.754	76%	0.759	S	S	*	*				-177.5	147.1	51.6	-128.9	167.7	0	0	0	109.3
392	S	30.9	Very low	32.5	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	76%	0.756	S	S	*	*			trans	45.7	143.2	148.4	57.7	0	0	0	0	123.2
393	A	32.8	Very low	32	Very low	85 Å²	85	129.9 Å²	129.9	70%	0.702	76%	0.758	S	S	*	*			cis	-172.5	163.2	-9	0	0	0	0	0	112
394	S	30.9	Very low	30.9	Very low	113 Å²	113	130 Å²	130	79%	0.79	76%	0.756	S	S	*	*			trans	56.6	143.8	152.3	51.4	0	0	0	0	120.7
395	S	32.7	Very low	30.2	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	76%	0.761	S	S	*	*			cis	-169.7	134	-8.6	43.1	0	0	0	0	107.3
396	L	29.5	Very low	29.8	Very low	157 Å²	157	129 Å²	129	82%	0.822	75%	0.754	S	S	*	*				48.8	145.7	79	-81.1	103.2	0	0	0	116.2
397	P	34.7	Very low	29.5	Very low	107 Å²	107	128.9 Å²	128.9	70%	0.695	75%	0.75	S	S	*	*			cis	-147.1	-160.3	-33.8	42.2	-22.5	0	0	0	114.6
398	S	27.8	Very low	28.8	Very low	89 Å²	89	128.2 Å²	128.2	62%	0.622	75%	0.747	S	S	*	*			trans	87.7	115.1	150.3	-78.2	0	0	0	0	123.5
399	E	25.6	Very low	28.3	Very low	170 Å²	170	132 Å²	132	79%	0.794	75%	0.753	S	S	*	*				47.2	111.9	121.8	-58.8	168.7	115.2	0	0	122.1
400	K	29.2	Very low	28	Very low	193 Å²	193	131.6 Å²	131.6	84%	0.839	75%	0.746	S	S	*	*				-175.7	132.2	107.6	-93.8	166.2	-178.4	-178	0	108.8
401	L	24.6	Very low	27.6	Very low	151 Å²	151	131.2 Å²	131.2	79%	0.791	74%	0.744	S	S	*	*				67.8	132.5	76.7	-98.6	169.2	0	0	0	114.8
402	E	24.9	Very low	27.2	Very low	151 Å²	151	131 Å²	131	71%	0.706	74%	0.739	S	S	*	*			trans	89.7	141.5	157	-68.5	178	162.4	0	0	122.5
403	H	27.2	Very low	27	Very low	165 Å²	165	132.1 Å²	132.1	76%	0.764	74%	0.741	S	S	*	*			trans	74.3	94.2	154.1	-59.3	-33.8	0	0	0	122.9
404	T	23.9	Very low	26.6	Very low	118 Å²	118	133.5 Å²	133.5	72%	0.724	74%	0.736	S	S	*	*				52.4	117	122.8	58.7	0	0	0	0	120.8
405	S	28	Very low	26.4	Very low	122 Å²	122	137.7 Å²	137.7	85%	0.853	74%	0.736	S	S	*	*			trans	-161.4	137.1	134.7	-83.5	0	0	0	0	111.4
406	I	24.3	Very low	26.1	Very low	147 Å²	147	140.4 Å²	140.4	75%	0.754	74%	0.742	S	S	*	*			trans	-115.1	130.8	171.2	-63.5	168.8	0	0	0	108	L408	I406-L408 HydrophobicContact CG2-CB 4.04Å; I406-L408 HydrophobicContact CG2-CD1 4.02Å; I406-L408 HydrophobicContact CG2-CG 4.07Å
407	P	26	Very low	25.9	Very low	102 Å²	102	141.4 Å²	141.4	66%	0.662	74%	0.742	S	S	*	*			trans	-126.9	143.2	130.7	33.5	-24.3	0	0	0	110	F409	P407-F409 HydrophobicContact CB-CD2 4.2Å
408	L	21.7	Very low	25.5	Very low	159 Å²	159	141.4 Å²	141.4	83%	0.832	75%	0.745	S	S	*	*			cis	62.6	51.1	15.4	-82.7	175	0	0	0	116.6	I406	I406-L408 HydrophobicContact CG2-CB 4.04Å; I406-L408 HydrophobicContact CG2-CD1 4.02Å; I406-L408 HydrophobicContact CG2-CG 4.07Å
409	F	24.5	Very low	25.5	Very low	182 Å²	182	143.4 Å²	143.4	80%	0.798	75%	0.753	S	S	*	*			trans	-154.6	143.8	153.8	-88.6	-83.8	0	0	0	107.1	P407	P407-F409 HydrophobicContact CB-CD2 4.2Å
410	T	25.1	Very low	25.5	Very low	106 Å²	106	140.3 Å²	140.3	65%	0.65	75%	0.751	S	S	*	*			cis	-177.4	157.5	-16.2	16.9	0	0	0	0	105.9
411	S	22.8	Very low	25.3	Very low	93 Å²	93	140 Å²	140	65%	0.65	75%	0.749	S	S	*	*			trans	-50.5	132.3	167.7	50.4	0	0	0	0	116.2
412	H	25.1	Very low	25.5	Very low	140 Å²	140	141.5 Å²	141.5	65%	0.648	75%	0.752	S	S	*	*			trans	-151	126.1	148.7	-84.5	-91.6	0	0	0	105.9	D414	H412-D414 IonicContact CE1-OD1 2.65Å; H412-D414 IonicContact CE1-OD2 2.97Å; H412-D414 IonicContact CG-OD1 3.91Å; H412-D414 IonicContact CG-OD2 2.64Å; H412-D414 IonicContact ND1-OD1 2.77Å; H412-D414 PolarHBondContact ND1-OD1 3.35Å; H412-D414 IonicContact ND1-OD2 3.88Å; H412-D414 PolarHBondContact ND1-OD2 3.34Å
413	T	25.4	Very low	25.6	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	76%	0.76	S	S	*	*			cis	75.2	20	12.7	70.8	0	0	0	0	118.4
414	D	24.8	Very low	25.5	Very low	114 Å²	114	139.8 Å²	139.8	61%	0.61	76%	0.761	S	S	*	*			trans	-111.6	53.6	-179.6	-68.4	-11.3	0	0	0	114.5	H412	H412-D414 IonicContact CE1-OD1 2.65Å; H412-D414 IonicContact CE1-OD2 2.97Å; H412-D414 IonicContact CG-OD1 3.91Å; H412-D414 IonicContact CG-OD2 2.64Å; H412-D414 IonicContact ND1-OD1 2.77Å; H412-D414 PolarHBondContact ND1-OD1 3.35Å; H412-D414 IonicContact ND1-OD2 3.88Å; H412-D414 PolarHBondContact ND1-OD2 3.34Å
415	Y	26.6	Very low	25.7	Very low	201 Å²	201	139.1 Å²	139.1	79%	0.788	76%	0.761	S	S	*	*	S	Bend	trans	-132.6	21.4	166	-135.7	-85.9	0	0	0	113.7
416	L	26.9	Very low	25.7	Very low	158 Å²	158	139.1 Å²	139.1	83%	0.827	76%	0.756	S	S	*	*	S	Bend	trans	-132.7	27.3	178.4	-71.8	176.9	0	0	0	113.1
417	H	25.8	Very low	25.9	Very low	177 Å²	177	141.8 Å²	141.8	82%	0.819	76%	0.758	S	S	*	*	S	Bend	trans	-135.5	17.7	-172.9	-108.1	40.3	0	0	0	117
418	S	26.3	Very low	26	Very low	108 Å²	108	142 Å²	142	76%	0.755	76%	0.758	S	S	*	*	S	Bend	trans	-97.2	-14.3	174.1	50.8	0	0	0	0	114.9
419	V	27.2	Very low	26.3	Very low	131 Å²	131	140.7 Å²	140.7	79%	0.794	75%	0.751	S	S	*	*	S	Bend	trans	-114.5	43.4	-168.1	-160.9	0	0	0	0	112.7
420	S	25	Very low	26.4	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	75%	0.75	S	S	*	*	S	Bend	trans	-145.1	29.5	-177.7	-68.7	0	0	0	0	115.3
421	K	25.9	Very low	26.6	Very low	187 Å²	187	139 Å²	139	81%	0.813	75%	0.752	S	S	*	*			trans	-137.6	145.7	163.4	-70.4	-176.8	-179.1	170	0	109.1
422	H	27.2	Very low	26.9	Very low	181 Å²	181	142.5 Å²	142.5	84%	0.838	76%	0.762	S	S	*	*			trans	67.9	125.6	-161.2	-51.5	-86.1	0	0	0	112.1
423	L	27	Very low	26.7	Very low	168 Å²	168	145.6 Å²	145.6	88%	0.88	77%	0.77	S	S	*	*			cis	-126.2	160	4.7	-68.4	92	0	0	0	112.4
424	S	25.4	Very low	26.9	Very low	112 Å²	112	148.1 Å²	148.1	78%	0.783	77%	0.773	S	S	*	*			trans	-120.8	164.3	168.2	-60.8	0	0	0	0	109.7
425	S	28.7	Very low	26.8	Very low	104 Å²	104	148.7 Å²	148.7	73%	0.727	78%	0.776	S	S	*	*			trans	75.3	107.8	176.2	74.7	0	0	0	0	114.5
426	T	29.2	Very low	26.8	Very low	122 Å²	122	146.5 Å²	146.5	75%	0.748	77%	0.772	S	S	*	*				89.6	137.6	83.5	59.4	0	0	0	0	112.8
427	Y	27.5	Very low	26.7	Very low	204 Å²	204	143.9 Å²	143.9	80%	0.8	77%	0.767	S	S	*	*			cis	-168.9	169.6	-12	-133.1	-78.8	0	0	0	107.6
428	T	28.1	Very low	26.8	Very low	107 Å²	107	146.6 Å²	146.6	66%	0.656	77%	0.77	S	S	*	*			trans	60.8	146	160.7	54	0	0	0	0	119.1
429	D	28.2	Very low	26.9	Very low	130 Å²	130	148 Å²	148	70%	0.695	77%	0.769	S	S	*	*			cis	-158.3	143.8	-8.4	-108.2	-19.8	0	0	0	113.6
430	N	26.3	Very low	26.8	Very low	144 Å²	144	148.6 Å²	148.6	77%	0.77	77%	0.768	S	S	*	*			trans	45.4	145.8	151.9	-65.3	-50.3	0	0	0	125.4
431	P	30.2	Very low	26.9	Very low	108 Å²	108	151 Å²	151	70%	0.701	77%	0.773	S	S	*	*			trans	-114.5	173.3	-177.9	43.8	-35.3	0	0	0	115.8
432	I	27.1	Very low	27	Very low	167 Å²	167	151.4 Å²	151.4	86%	0.856	78%	0.777	S	S	*	*			trans	-138.4	145.6	164.3	-62.9	-176.8	0	0	0	110.4
433	Y	22.8	Very low	26.8	Very low	206 Å²	206	153 Å²	153	81%	0.808	78%	0.783	S	S	*	*			trans	-88	150.7	178.7	-77.4	-107	0	0	0	113.7
434	H	28	Very low	26.7	Very low	177 Å²	177	151.3 Å²	151.3	82%	0.819	78%	0.779	S	S	*	*			trans	169.5	118.5	136.8	-92.3	-68.6	0	0	0	107.5
435	N	24.2	Very low	26.9	Very low	126 Å²	126	154.9 Å²	154.9	67%	0.674	78%	0.783	S	S	*	*				98.6	146.3	68.7	-115.4	41.9	0	0	0	113.6
436	E	26.3	Very low	26.8	Very low	154 Å²	154	157.3 Å²	157.3	72%	0.72	79%	0.787	S	S	*	*			trans	67.6	85.1	156.4	-71.5	157.8	-115.9	0	0	120.7
437	S	24.3	Very low	26.5	Very low	103 Å²	103	159.5 Å²	159.5	72%	0.72	79%	0.792	S	S	*	*				33.4	120	120.7	62	0	0	0	0	120.8
438	R	26.7	Very low	26.5	Very low	234 Å²	234	157.2 Å²	157.2	88%	0.883	79%	0.789	S	S	*	*				-165.6	145.6	128.8	-113.6	162.1	178.3	160.6	-0	114.7
439	N	29.2	Very low	26.5	Very low	137 Å²	137	158.2 Å²	158.2	73%	0.733	79%	0.79	S	S	*	*			trans	42.5	110.7	153.1	-62.5	2.2	0	0	0	120.7
440	N	24.5	Very low	26.3	Very low	144 Å²	144	157.2 Å²	157.2	77%	0.77	79%	0.794	S	S	*	*				11.9	145.4	115.6	-54.8	0.4	0	0	0	119
441	N	27.6	Very low	26.4	Very low	155 Å²	155	155.6 Å²	155.6	83%	0.829	79%	0.791	S	S	*	*			trans	99.7	58.1	163.3	-53.3	-14.3	0	0	0	117.3
442	E	28.1	Very low	26.2	Very low	196 Å²	196	159 Å²	159	92%	0.916	80%	0.797	S	S	*	*			trans	-159.8	87.4	148.5	-116.1	160.6	-140	0	0	110.8
443	F	23.6	Very low	26.1	Very low	216 Å²	216	162.9 Å²	162.9	95%	0.947	80%	0.801	S	S	*	*			trans	-132	36.9	175.9	-139.5	-85	0	0	0	112.5
444	V	25.4	Very low	26.2	Very low	132 Å²	132	160.6 Å²	160.6	80%	0.8	80%	0.803	S	S	*	*			trans	-142.9	80.8	171	-173.9	0	0	0	0	109.9
445	Q	28.2	Very low	26.1	Very low	186 Å²	186	156.3 Å²	156.3	87%	0.869	79%	0.793	S	S	*	*			trans	-172.3	167.6	149.3	-114.1	169.6	88.2	0	0	112.9
446	L	26.5	Very low	26.1	Very low	156 Å²	156	156.2 Å²	156.2	82%	0.817	80%	0.797	S	S	*	*			trans	65.4	63.4	170.6	-57.9	179.4	0	0	0	117.7	H448	L446-H448 PolarHBondContact O-N 3.38Å
447	I	23.5	Very low	26	Very low	167 Å²	167	160.1 Å²	160.1	86%	0.856	81%	0.805	S	S	*	*			trans	-70	103.5	139	-62	172.5	0	0	0	107.4
448	H	27.2	Very low	26	Very low	157 Å²	157	161.4 Å²	161.4	73%	0.727	80%	0.798	S	S	*	*			trans	-172.4	149.9	151.5	-119.9	-85.5	0	0	0	112.9	L446	L446-H448 PolarHBondContact O-N 3.38Å
449	N	28.7	Very low	25.8	Very low	127 Å²	127	155.3 Å²	155.3	68%	0.679	79%	0.792	S	S	*	*			trans	64.6	84.4	159.3	-55.5	-21.9	0	0	0	119.6
450	S	24.2	Very low	25.6	Very low	110 Å²	110	155.4 Å²	155.4	77%	0.769	79%	0.792	S	S	*	*				53.3	177.8	112.6	74.3	0	0	0	0	119.6
451	P	28.5	Very low	25.5	Very low	110 Å²	110	154.3 Å²	154.3	71%	0.714	80%	0.796	S	S	*	*				-127.2	-176.5	-97.2	36.7	-17.7	0	0	0	115.3
452	Q	25.3	Very low	25.3	Very low	179 Å²	179	154.3 Å²	154.3	84%	0.836	79%	0.794	S	S	*	*			trans	68.1	117.1	170.2	-56.8	-176.2	-9.7	0	0	117.9
453	R	26.2	Very low	25.1	Very low	249 Å²	249	152.6 Å²	152.6	94%	0.94	79%	0.791	S	S	*	*				-169.3	124.9	124.8	-105.6	161.3	-165.2	-153.4	2.1	115.1
454	N	23.7	Very low	25.1	Very low	157 Å²	157	147.6 Å²	147.6	84%	0.84	78%	0.783	S	S	*	*			trans	-60.3	158.7	157.8	-75.9	-11.2	0	0	0	111.7
455	S	25.2	Very low	25.1	Very low	87 Å²	87	146.6 Å²	146.6	61%	0.608	78%	0.777	S	S	*	*			cis	-172.1	175.9	-10.6	53.4	0	0	0	0	111
456	T	25.3	Very low	24.8	Very low	125 Å²	125	149.8 Å²	149.8	77%	0.767	78%	0.781	S	S	*	*			trans	56.4	110.3	149.7	47.5	0	0	0	0	119.6
457	W	24.8	Very low	24.8	Very low	235 Å²	235	150.5 Å²	150.5	89%	0.89	78%	0.778	S	S	*	*			trans	-126.5	131.4	152.2	-112.7	41.8	0	0	0	110.6
458	F	24.5	Very low	24.9	Very low	131 Å²	131	148.9 Å²	148.9	58%	0.575	77%	0.771	S	S	*	*			trans	51.8	90.3	163.5	-67.8	-80.1	0	0	0	121.4	N460	F458-N460 HydrophobicContact CD1-CB 4.43Å
459	S	21.6	Very low	24.8	Very low	106 Å²	106	148.5 Å²	148.5	74%	0.741	77%	0.774	S	S	*	*				-80.4	111.1	129.5	43.8	0	0	0	0	110
460	N	24.3	Very low	24.7	Very low	139 Å²	139	150.2 Å²	150.2	74%	0.743	78%	0.782	S	S	*	*			trans	-177.5	89.1	161	-101.7	-24.7	0	0	0	111.6	F458	F458-N460 HydrophobicContact CD1-CB 4.43Å
461	S	24.3	Very low	24.8	Very low	121 Å²	121	153.9 Å²	153.9	85%	0.846	78%	0.781	S	S	*	*			trans	-171.3	77.3	155.1	-84.4	0	0	0	0	111.1
462	I	23	Very low	24.8	Very low	155 Å²	155	157.1 Å²	157.1	80%	0.795	79%	0.786	S	S	*	*			trans	-120.5	143	156.4	-64.5	177.4	0	0	0	105.5
463	N	23.1	Very low	25	Very low	159 Å²	159	154.9 Å²	154.9	85%	0.85	78%	0.78	S	S	*	*	S	Bend	trans	83.1	38.8	-175.2	-51.8	-40	0	0	0	117.7
464	S	24.4	Very low	25.2	Very low	111 Å²	111	149.9 Å²	149.9	78%	0.776	77%	0.767	S	S	*	*			trans	-157.9	133.8	148.1	-148.5	0	0	0	0	108.2
465	T	24.6	Very low	25.4	Very low	111 Å²	111	151.1 Å²	151.1	68%	0.681	76%	0.761	S	S	*	*			cis	-130.1	131.3	10	41.4	0	0	0	0	112.6	K467	T465-K467 PolarHBondContact O-N 2.86Å
466	R	22.9	Very low	25.7	Very low	254 Å²	254	151 Å²	151	96%	0.958	76%	0.757	S	S	*	*			trans	-85.2	86.4	157.8	-124.5	-174.2	-179	173.3	-0.8	108.2
467	K	25.2	Very low	25.9	Very low	170 Å²	170	150.4 Å²	150.4	74%	0.739	75%	0.749	S	S	*	*			trans	165.9	121.6	166.9	-97.7	159	-175.8	-176.6	0	108.8	T465	T465-K467 PolarHBondContact O-N 2.86Å
468	N	26.1	Very low	26.1	Very low	134 Å²	134	146.3 Å²	146.3	72%	0.717	74%	0.738	S	S	*	*			trans	165.1	60.7	143.7	-86.4	4.8	0	0	0	109.4
469	D	24.2	Very low	26.4	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	73%	0.729	S	S	*	*			trans	-60.8	159	146.7	-42.2	-82	0	0	0	108.3
470	L	27	Very low	26.8	Very low	162 Å²	162	141.6 Å²	141.6	85%	0.848	71%	0.712	S	S	*	*			trans	74.5	65.1	-175.7	-50.3	165.2	0	0	0	115.8
471	Y	27.6	Very low	27.1	Very low	188 Å²	188	140.7 Å²	140.7	74%	0.737	70%	0.703	S	S	*	*			trans	-148.9	23.8	164.7	-110	-68.5	0	0	0	116.4
472	E	27.9	Very low	27.5	Very low	177 Å²	177	139.2 Å²	139.2	83%	0.827	69%	0.689	S	S	*	*	S	Bend	trans	-87.7	-34.9	179.2	-67.8	-166.3	113.6	0	0	114.5	H474	E472-H474 PolarHBondContact O-N 2.97Å
473	D	28.7	Very low	27.9	Very low	133 Å²	133	136 Å²	136	71%	0.711	67%	0.673	S	S	*	*	H	α-helix	trans	-64.6	-16.9	-169	-61.8	-55.3	0	0	0	115.5	T476	D473-T476 PolarHBondContact O-OG1 3.26Å; D473-T476 VanDerWaalsContact O-OG1 3.07Å
474	H	31.2	Very low	28.3	Very low	143 Å²	143	134.9 Å²	134.9	66%	0.662	66%	0.66	S	S	*	*	H	α-helix	trans	-92.1	-6.9	-167.6	-124.8	-37.1	0	0	0	115.7	E472	E472-H474 PolarHBondContact O-N 2.97Å
475	Y	28.1	Very low	28.7	Very low	183 Å²	183	133.4 Å²	133.4	72%	0.718	64%	0.644	S	S	*	*	H	α-helix	trans	-94.4	-28.7	179	-108.5	-92.3	0	0	0	113.7	I479	Y475-I479 WeakPolarHBondContact O-CG1 3.27Å; Y475-I479 PolarHBondContact O-N 2.74Å
476	T	30.4	Very low	29.1	Very low	86 Å²	86	129.7 Å²	129.7	53%	0.528	63%	0.627	S	S	.	*	H	α-helix	trans	-64.5	-41	179.8	45.7	0	0	0	0	112.5	D473 I479 T480	D473-T476 PolarHBondContact O-OG1 3.26Å; D473-T476 VanDerWaalsContact O-OG1 3.07Å; T476-I479 PolarHBondContact O-N 2.86Å; T476-T480 WeakPolarHBondContact O-CB 3.24Å; T476-T480 PolarHBondContact O-N 3Å; T476-T480 PolarHBondContact O-OG1 2.8Å
477	D	29.3	Very low	29.5	Very low	112 Å²	112	121.3 Å²	121.3	60%	0.599	60%	0.601	S	S	*	*	H	α-helix	trans	-63.9	-45.4	177.6	-92.7	-18	0	0	0	112.7	I479 T480 E481	D477-I479 VanDerWaalsContact C-N 3.29Å; D477-I479 PolarHBondContact O-N 2.83Å; D477-T480 CarbonylContact O-C 3.5Å; D477-T480 WeakPolarHBondContact O-CA 3.24Å; D477-T480 WeakPolarHBondContact O-CB 3.44Å; D477-T480 PolarHBondContact O-N 3.36Å; D477-T480 VanDerWaalsContact O-N 3.07Å; D477-E481 PolarHBondContact O-N 2.66Å
478	K	29.8	Very low	29.8	Very low	149 Å²	149	119.4 Å²	119.4	65%	0.648	60%	0.595	S	S	*	*	H	α-helix	trans	-64.5	-33.5	177.1	-96.7	-178.4	175.9	174	0	112.8	T482	K478-T482 PolarHBondContact O-N 3.24Å; K478-T482 PolarHBondContact O-OG1 3.05Å
479	I	30.6	Very low	30	Very low	74 Å²	74	117 Å²	117	38%	0.379	59%	0.585	S	S	.	*	H	α-helix	trans	-67.2	-42.4	171.6	-70.2	168.5	0	0	0	110	Y475 T476 D477 E481 T482 I483	Y475-I479 WeakPolarHBondContact O-CG1 3.27Å; Y475-I479 PolarHBondContact O-N 2.74Å; T476-I479 PolarHBondContact O-N 2.86Å; D477-I479 VanDerWaalsContact C-N 3.29Å; D477-I479 PolarHBondContact O-N 2.83Å; I479-E481 PolarHBondContact O-N 2.9Å; I479-T482 WeakPolarHBondContact CA-OG1 3.26Å; I479-T482 PolarHBondContact O-N 3.14Å; I479-T482 PolarHBondContact O-OG1 3.13Å; I479-I483 HydrophobicContact CG2-CD1 3.71Å; I479-I483 HydrophobicContact CG2-CG1 4.45Å; I479-I483 WeakPolarHBondContact O-CB 3.44Å; I479-I483 WeakPolarHBondContact O-CD1 3.19Å; I479-I483 WeakPolarHBondContact O-CG1 3.36Å; I479-I483 PolarHBondContact O-N 3.45Å
480	T	30.9	Very low	30.4	Very low	64 Å²	64	115.1 Å²	115.1	39%	0.393	57%	0.574	S	S	.	*	H	α-helix	trans	-64.9	-37.3	177.4	-57.2	0	0	0	0	112.3	T476 D477 I483 K484	T476-T480 WeakPolarHBondContact O-CB 3.24Å; T476-T480 PolarHBondContact O-N 3Å; T476-T480 PolarHBondContact O-OG1 2.8Å; D477-T480 CarbonylContact O-C 3.5Å; D477-T480 WeakPolarHBondContact O-CA 3.24Å; D477-T480 WeakPolarHBondContact O-CB 3.44Å; D477-T480 PolarHBondContact O-N 3.36Å; D477-T480 VanDerWaalsContact O-N 3.07Å; T480-I483 PolarHBondContact O-N 2.96Å; T480-K484 WeakPolarHBondContact O-CG 3.23Å; T480-K484 PolarHBondContact O-N 3.13Å
481	E	30.9	Very low	30.7	Very low	119 Å²	119	114.5 Å²	114.5	56%	0.556	57%	0.565	S	S	*	*	H	α-helix	trans	-71	-43.3	175.3	-169.6	172.6	-130.8	0	0	112.3	D477 I479 I483 K484 N485	D477-E481 PolarHBondContact O-N 2.66Å; I479-E481 PolarHBondContact O-N 2.9Å; E481-I483 VanDerWaalsContact C-N 3.28Å; E481-I483 PolarHBondContact O-N 3.41Å; E481-K484 WeakPolarHBondContact O-CB 3.45Å; E481-K484 PolarHBondContact O-N 3.37Å; E481-N485 PolarHBondContact O-N 3.12Å; E481-N485 PolarHBondContact O-ND2 3.12Å
482	T	31.3	Very low	30.9	Very low	90 Å²	90	112.9 Å²	112.9	55%	0.552	56%	0.563	S	S	*	*	H	α-helix	trans	-66	-29.3	172.4	41.7	0	0	0	0	112.8	K478 I479 N485 G486	K478-T482 PolarHBondContact O-N 3.24Å; K478-T482 PolarHBondContact O-OG1 3.05Å; I479-T482 WeakPolarHBondContact CA-OG1 3.26Å; I479-T482 PolarHBondContact O-N 3.14Å; I479-T482 PolarHBondContact O-OG1 3.13Å; T482-N485 PolarHBondContact O-N 3.08Å; T482-G486 PolarHBondContact O-N 2.99Å
483	I	31.7	Very low	31	Very low	87 Å²	87	109.8 Å²	109.8	45%	0.446	55%	0.553	S	S	.	*	H	α-helix	trans	-69	-41	170.2	-72.8	167.1	0	0	0	111.2	I479 T480 E481 N485 G486 N487	I479-I483 HydrophobicContact CG2-CD1 3.71Å; I479-I483 HydrophobicContact CG2-CG1 4.45Å; I479-I483 WeakPolarHBondContact O-CB 3.44Å; I479-I483 WeakPolarHBondContact O-CD1 3.19Å; I479-I483 WeakPolarHBondContact O-CG1 3.36Å; I479-I483 PolarHBondContact O-N 3.45Å; T480-I483 PolarHBondContact O-N 2.96Å; E481-I483 VanDerWaalsContact C-N 3.28Å; E481-I483 PolarHBondContact O-N 3.41Å; I483-N485 VanDerWaalsContact C-N 3.34Å; I483-N485 PolarHBondContact O-N 3.45Å; I483-G486 PolarHBondContact O-N 3.49Å; I483-N487 WeakPolarHBondContact CG2-ND2 3.36Å; I483-N487 PolarHBondContact O-N 3.49Å; I483-N487 PolarHBondContact O-ND2 3.47Å
484	K	32.3	Very low	31.2	Very low	137 Å²	137	107.4 Å²	107.4	60%	0.596	54%	0.543	S	S	*	.	H	α-helix	trans	-59.2	-46	172.5	-77.2	171.4	179.8	170.1	0	111.1	T480 E481 N487 Q488	T480-K484 WeakPolarHBondContact O-CG 3.23Å; T480-K484 PolarHBondContact O-N 3.13Å; E481-K484 WeakPolarHBondContact O-CB 3.45Å; E481-K484 PolarHBondContact O-N 3.37Å; K484-N487 PolarHBondContact O-N 3.22Å; K484-Q488 PolarHBondContact O-N 3.44Å; K484-Q488 VanDerWaalsContact O-N 3.15Å
485	N	33	Very low	31.1	Very low	80 Å²	80	106.6 Å²	106.6	43%	0.428	54%	0.543	S	S	.	.	H	α-helix	trans	-68.5	-39.3	179.1	-65.7	-18.2	0	0	0	112.4	E481 T482 I483 N487 Q488 V489	E481-N485 PolarHBondContact O-N 3.12Å; E481-N485 PolarHBondContact O-ND2 3.12Å; T482-N485 PolarHBondContact O-N 3.08Å; I483-N485 VanDerWaalsContact C-N 3.34Å; I483-N485 PolarHBondContact O-N 3.45Å; N485-N487 PolarHBondContact O-N 2.9Å; N485-Q488 WeakPolarHBondContact O-CB 3.5Å; N485-Q488 PolarHBondContact O-N 2.82Å; N485-Q488 VanDerWaalsContact O-N 3.11Å; N485-V489 PolarHBondContact O-N 2.87Å
486	G	31.6	Very low	31.2	Very low	32 Å²	32	101.1 Å²	101.1	33%	0.33	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-41.1	174.3	0	0	0	0	0	113	T482 I483 Q488 V489 I490	T482-G486 PolarHBondContact O-N 2.99Å; I483-G486 PolarHBondContact O-N 3.49Å; G486-Q488 VanDerWaalsContact C-N 3.3Å; G486-Q488 PolarHBondContact O-N 3.38Å; G486-V489 PolarHBondContact O-N 3.49Å; G486-I490 WeakPolarHBondContact O-CG1 3.46Å; G486-I490 PolarHBondContact O-N 3.29Å
487	N	32	Very low	31.2	Very low	78 Å²	78	103.6 Å²	103.6	42%	0.417	55%	0.551	S	S	.	*	H	α-helix	trans	-67.1	-28.4	173.8	-74	-67.8	0	0	0	112.8	I483 K484 N485 K491	I483-N487 WeakPolarHBondContact CG2-ND2 3.36Å; I483-N487 PolarHBondContact O-N 3.49Å; I483-N487 PolarHBondContact O-ND2 3.47Å; K484-N487 PolarHBondContact O-N 3.22Å; N485-N487 PolarHBondContact O-N 2.9Å; N487-K491 PolarHBondContact O-N 2.8Å
488	Q	31.5	Very low	30.9	Very low	130 Å²	130	104.6 Å²	104.6	61%	0.607	56%	0.556	S	S	*	*	H	α-helix	trans	-70.4	-43.6	170.7	-70.2	-176.2	13.5	0	0	112	K484 N485 G486 I490 K491 H492	K484-Q488 PolarHBondContact O-N 3.44Å; K484-Q488 VanDerWaalsContact O-N 3.15Å; N485-Q488 WeakPolarHBondContact O-CB 3.5Å; N485-Q488 PolarHBondContact O-N 2.82Å; N485-Q488 VanDerWaalsContact O-N 3.11Å; G486-Q488 VanDerWaalsContact C-N 3.3Å; G486-Q488 PolarHBondContact O-N 3.38Å; Q488-I490 VanDerWaalsContact C-N 3.29Å; Q488-I490 PolarHBondContact O-N 2.74Å; Q488-K491 PolarHBondContact O-N 2.95Å; Q488-H492 WeakPolarHBondContact O-CB 3.46Å; Q488-H492 PolarHBondContact O-N 2.97Å
489	V	31.3	Very low	30.9	Very low	85 Å²	85	103.4 Å²	103.4	52%	0.515	56%	0.563	S	S	.	*	H	α-helix	trans	-60.5	-39.2	175.6	173.8	0	0	0	0	111.5	N485 G486 H492 N493	N485-V489 PolarHBondContact O-N 2.87Å; G486-V489 PolarHBondContact O-N 3.49Å; V489-H492 PolarHBondContact O-N 3.44Å; V489-N493 WeakPolarHBondContact O-CB 3.45Å; V489-N493 PolarHBondContact O-N 3.16Å
490	I	32.1	Very low	30.6	Very low	108 Å²	108	108.9 Å²	108.9	55%	0.554	58%	0.584	S	S	*	*	H	α-helix	trans	-63.6	-42.7	175.2	-68.4	166.3	0	0	0	111.3	G486 Q488 V494	G486-I490 WeakPolarHBondContact O-CG1 3.46Å; G486-I490 PolarHBondContact O-N 3.29Å; Q488-I490 VanDerWaalsContact C-N 3.29Å; Q488-I490 PolarHBondContact O-N 2.74Å; I490-V494 VanDerWaalsContact O-CG2 3.23Å; I490-V494 WeakPolarHBondContact O-CG2 3.41Å; I490-V494 PolarHBondContact O-N 2.92Å
491	K	32.3	Very low	30.5	Very low	150 Å²	150	114.4 Å²	114.4	65%	0.652	61%	0.605	S	S	*	*	H	α-helix	trans	-61.6	-50	172.3	-80.4	-173.4	170.4	-174.8	0	112	N487 Q488 N493 V494 D495	N487-K491 PolarHBondContact O-N 2.8Å; Q488-K491 PolarHBondContact O-N 2.95Å; K491-N493 PolarHBondContact O-N 3.37Å; K491-V494 PolarHBondContact O-N 2.87Å; K491-D495 PolarHBondContact O-N 3.15Å
492	H	32.2	Very low	30.2	Very low	153 Å²	153	116.4 Å²	116.4	71%	0.708	61%	0.614	S	S	*	*	H	α-helix	trans	-65	-26.4	-172.8	-137.5	-54.1	0	0	0	113.7	Q488 V489	Q488-H492 WeakPolarHBondContact O-CB 3.46Å; Q488-H492 PolarHBondContact O-N 2.97Å; V489-H492 PolarHBondContact O-N 3.44Å
493	N	30.5	Very low	29.9	Very low	113 Å²	113	116.3 Å²	116.3	60%	0.604	62%	0.617	S	S	*	*	H	α-helix	trans	-85.7	-17.8	173.2	-72.1	-10.3	0	0	0	113.8	V489 K491	V489-N493 WeakPolarHBondContact O-CB 3.45Å; V489-N493 PolarHBondContact O-N 3.16Å; K491-N493 PolarHBondContact O-N 3.37Å
494	V	31.6	Very low	29.6	Very low	83 Å²	83	119 Å²	119	50%	0.503	63%	0.632	S	S	.	*	H	α-helix	trans	-88	-41.1	176.7	167.3	0	0	0	0	111.4	I490 K491 G496 I497	I490-V494 VanDerWaalsContact O-CG2 3.23Å; I490-V494 WeakPolarHBondContact O-CG2 3.41Å; I490-V494 PolarHBondContact O-N 2.92Å; K491-V494 PolarHBondContact O-N 2.87Å; V494-G496 PolarHBondContact O-N 3.41Å; V494-G496 VanDerWaalsContact O-N 3.14Å; V494-I497 PolarHBondContact O-N 3.33Å
495	D	30.5	Very low	29.2	Very low	125 Å²	125	120.7 Å²	120.7	67%	0.668	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-16.1	-179.9	-70.2	-38.3	0	0	0	113.3	K491 I497	K491-D495 PolarHBondContact O-N 3.15Å; D495-I497 PolarHBondContact O-N 2.98Å
496	G	29.8	Very low	28.9	Very low	68 Å²	68	123.6 Å²	123.6	70%	0.701	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-4.9	179.2	0	0	0	0	0	116.4	V494	V494-G496 PolarHBondContact O-N 3.41Å; V494-G496 VanDerWaalsContact O-N 3.14Å
497	I	29.6	Very low	28.6	Very low	138 Å²	138	128.2 Å²	128.2	71%	0.708	68%	0.675	S	S	*	*	S	Bend	trans	-119.5	-0.4	-167.2	-56.2	-178.9	0	0	0	113.3	V494 D495 P499	V494-I497 PolarHBondContact O-N 3.33Å; D495-I497 PolarHBondContact O-N 2.98Å; I497-P499 WeakPolarHBondContact O-CD 3.39Å
498	L	24.5	Very low	28.3	Very low	134 Å²	134	131.7 Å²	131.7	70%	0.702	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-96.2	119.1	-179	-93.6	78.4	0	0	0	114.9
499	P	28.6	Very low	28.1	Very low	124 Å²	124	131.3 Å²	131.3	81%	0.805	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-70.9	134.9	151.9	-12.7	29.4	0	0	0	110.4	I497	I497-P499 WeakPolarHBondContact O-CD 3.39Å
500	K	24.6	Very low	27.8	Very low	188 Å²	188	134 Å²	134	82%	0.817	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-80.4	141.5	-179.5	-57.2	167.3	-177.7	173.9	0	110.9
501	H	27.9	Very low	27.3	Very low	180 Å²	180	133.2 Å²	133.2	83%	0.833	71%	0.714	S	S	*	*			trans	-171.6	105.4	140.5	-104.3	-70.9	0	0	0	114.7
502	H	25.7	Very low	27	Very low	162 Å²	162	134.8 Å²	134.8	75%	0.75	72%	0.721	S	S	*	*			trans	37.3	101.2	140.1	-71.2	-77.7	0	0	0	124.2
503	S	23.6	Very low	26.8	Very low	87 Å²	87	134.1 Å²	134.1	61%	0.608	72%	0.722	S	S	*	*				43.4	112.1	115.2	62.2	0	0	0	0	122.8
504	N	26.2	Very low	26.5	Very low	144 Å²	144	135.5 Å²	135.5	77%	0.77	73%	0.728	S	S	*	*				162.5	117.7	121.8	-82.3	-7.6	0	0	0	110.5
505	Q	24.9	Very low	26.2	Very low	173 Å²	173	137.8 Å²	137.8	81%	0.808	74%	0.738	S	S	*	*				64	88.9	84.3	-79.8	-163.4	-13.7	0	0	116.6
506	N	26.5	Very low	26	Very low	140 Å²	140	139 Å²	139	75%	0.749	74%	0.742	S	S	*	*			trans	167.2	118.9	132	-89.2	-43.6	0	0	0	108.3
507	N	25.1	Very low	25.9	Very low	130 Å²	130	145.1 Å²	145.1	70%	0.695	75%	0.752	S	S	*	*				84.4	112.6	67.5	-81.2	-33.8	0	0	0	114.7
508	N	25.5	Very low	25.6	Very low	150 Å²	150	144.5 Å²	144.5	80%	0.802	75%	0.754	S	S	*	*			trans	80.7	149.1	142.1	-70.8	-18.9	0	0	0	123.2
509	V	26.3	Very low	25.9	Very low	123 Å²	123	143.9 Å²	143.9	75%	0.745	76%	0.757	S	S	*	*			trans	98.7	98.9	144.3	157.9	0	0	0	0	121.4
510	I	24.8	Very low	25.8	Very low	141 Å²	141	146.4 Å²	146.4	72%	0.723	76%	0.757	S	S	*	*				66	93.3	127.6	-55.1	175.4	0	0	0	120.5
511	S	23.3	Very low	26.2	Very low	92 Å²	92	142.9 Å²	142.9	64%	0.643	76%	0.757	S	S	*	*				53.1	149.9	117.4	93.7	0	0	0	0	125.1
512	K	25.6	Very low	26.5	Very low	182 Å²	182	140 Å²	140	79%	0.791	76%	0.756	S	S	*	*			trans	97.1	146.5	140.5	-84	178.1	178.2	179.5	0	121.1
513	N	26.7	Very low	27	Very low	139 Å²	139	138 Å²	138	74%	0.743	76%	0.758	S	S	*	*			trans	72.8	124.9	169.7	-52.1	-16.3	0	0	0	115.8
514	I	25.2	Very low	27.6	Very low	142 Å²	142	139.3 Å²	139.3	73%	0.728	77%	0.765	S	S	*	*			cis	92.9	129.2	22.4	-58.3	172.4	0	0	0	114.2
515	N	26.1	Very low	27.9	Very low	132 Å²	132	137.9 Å²	137.9	71%	0.706	77%	0.766	S	S	*	*			trans	66.3	156.9	173.8	-68.5	-5	0	0	0	116.3
516	M	25.5	Very low	28.4	Very low	151 Å²	151	135.6 Å²	135.6	74%	0.744	77%	0.766	S	S	*	*			cis	171.7	140	-26.7	-101.7	-161.1	-64.8	0	0	102.6
517	E	27.6	Very low	28.8	Very low	196 Å²	196	134.8 Å²	134.8	92%	0.916	77%	0.768	S	S	*	*			trans	173.1	168.2	132.2	-97.7	170.1	-172	0	0	112.2
518	T	23.9	Very low	29	Very low	124 Å²	124	134.1 Å²	134.1	76%	0.761	77%	0.771	S	S	*	*			trans	-139.3	148.1	-164	51.2	0	0	0	0	111.8
519	T	30.2	Very low	29.1	Very low	122 Å²	122	135.1 Å²	135.1	75%	0.748	78%	0.776	S	S	*	*			trans	170.4	120.6	144.8	29.9	0	0	0	0	109.6
520	E	26.9	Very low	29.4	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.822	78%	0.779	S	S	*	*				82.7	112.3	90.7	-70.5	-167.2	131.5	0	0	116.9
521	S	33.2	Very low	29.6	Very low	115 Å²	115	133.7 Å²	133.7	80%	0.804	78%	0.78	S	S	*	*				159	129.7	115.7	53.6	0	0	0	0	116.3
522	S	32.9	Very low	29.7	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	78%	0.782	S	S	*	*			trans	61.5	125.2	145.2	-55.8	0	0	0	0	124.5
523	P	36	Very low	29.6	Very low	122 Å²	122	130.8 Å²	130.8	79%	0.792	78%	0.783	S	S	*	*			trans	-98.9	-161.4	168	44.4	-38	0	0	0	111.4
524	P	38.3	Very low	29.6	Very low	114 Å²	114	130 Å²	130	74%	0.74	79%	0.788	S	S	*	*			cis	-141	171.4	1.4	43.9	-26.2	0	0	0	118.3
525	S	32.2	Very low	29.6	Very low	114 Å²	114	128 Å²	128	80%	0.797	79%	0.787	S	S	*	*			trans	163.9	142.3	133.2	-74.6	0	0	0	0	113.1
526	P	34.5	Very low	29.8	Very low	124 Å²	124	126.2 Å²	126.2	81%	0.805	79%	0.785	S	S	*	*			trans	-106.1	149.4	-175.2	38.9	-33.6	0	0	0	115.7
527	P	34.1	Very low	29.9	Very low	123 Å²	123	126.1 Å²	126.1	80%	0.799	79%	0.787	S	S	*	*			trans	-143	-170.6	135.4	42.6	-28.1	0	0	0	112.3
528	P	31.2	Very low	29.9	Very low	116 Å²	116	123.1 Å²	123.1	75%	0.753	78%	0.776	S	S	*	*				-107.1	-179	-89.8	37.3	-22.2	0	0	0	113.8
529	L	26.5	Very low	30.3	Very low	172 Å²	172	121.8 Å²	121.8	90%	0.901	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-66.5	133.6	-179.4	-65.6	86.9	0	0	0	113.1
530	P	33.8	Very low	30.1	Very low	126 Å²	126	119.3 Å²	119.3	82%	0.818	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-92.4	128.5	159.4	33.6	-28.7	0	0	0	111.1
531	S	27.4	Very low	30.3	Very low	107 Å²	107	113.6 Å²	113.6	75%	0.748	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-81.3	153.3	171.1	54.3	0	0	0	0	112.3
532	S	25.5	Very low	30.3	Very low	97 Å²	97	114.4 Å²	114.4	68%	0.678	72%	0.72	S	S	*	*	S	Bend	trans	58.6	114.2	157.1	52.4	0	0	0	0	119.9
533	S	24.6	Very low	30.2	Very low	117 Å²	117	112.1 Å²	112.1	82%	0.818	70%	0.699	S	S	*	*			trans	56	83.8	138.7	61.4	0	0	0	0	120.2
534	S	26.2	Very low	30.2	Very low	122 Å²	122	109 Å²	109	85%	0.853	68%	0.68	S	S	*	*			trans	-162.1	37.8	161.1	52.2	0	0	0	0	116.2
535	S	26.2	Very low	30.3	Very low	101 Å²	101	107.9 Å²	107.9	71%	0.706	67%	0.667	S	S	*	*	S	Bend	trans	-126.8	-12.8	-176.2	58.2	0	0	0	0	117.5
536	S	28.9	Very low	31.1	Very low	93 Å²	93	106.6 Å²	106.6	65%	0.65	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-76.6	-24.7	-173.1	50.1	0	0	0	0	115.4	L538	S536-L538 PolarHBondContact O-N 3.29Å
537	L	28.6	Very low	31.4	Very low	150 Å²	150	103 Å²	103	79%	0.785	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-78.5	-12.6	-170.3	-70.9	163.6	0	0	0	115	S540	L537-S540 PolarHBondContact O-OG 2.99Å
538	L	26.4	Very low	32.2	Very low	132 Å²	132	102 Å²	102	69%	0.691	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-93	-7.6	179.6	-85.5	160.8	0	0	0	114.4	S536	S536-L538 PolarHBondContact O-N 3.29Å
539	N	32.1	Very low	33.4	Very low	96 Å²	96	102.5 Å²	102.5	51%	0.513	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.2	-32.3	176.5	-77.2	-7.6	0	0	0	113	S541 K542 L543	N539-S541 VanDerWaalsContact C-N 3.33Å; N539-S541 PolarHBondContact O-N 3.17Å; N539-K542 PolarHBondContact O-N 3.46Å; N539-K542 VanDerWaalsContact O-N 3.12Å; N539-L543 HydrophobicContact CB-CD1 4.35Å; N539-L543 VanDerWaalsContact O-CD1 3.23Å; N539-L543 WeakPolarHBondContact O-CD1 3.38Å; N539-L543 PolarHBondContact O-N 3.47Å
540	S	27.4	Very low	34.6	Very low	71 Å²	71	95.4 Å²	95.4	50%	0.497	56%	0.564	S	S	.	*	H	α-helix	trans	-59.7	-39.8	-177.9	53.4	0	0	0	0	113.3	L537 L543 S544	L537-S540 PolarHBondContact O-OG 2.99Å; S540-L543 PolarHBondContact O-N 2.92Å; S540-S544 PolarHBondContact O-N 3.47Å; S540-S544 PolarHBondContact O-OG 3.36Å
541	S	30.3	Very low	35.5	Very low	55 Å²	55	92.7 Å²	92.7	39%	0.385	54%	0.542	S	S	.	.	H	α-helix	trans	-67.8	-36.9	175.2	55.8	0	0	0	0	113	N539 S544 I545	N539-S541 VanDerWaalsContact C-N 3.33Å; N539-S541 PolarHBondContact O-N 3.17Å; S541-S544 PolarHBondContact O-OG 3.41Å; S541-S544 VanDerWaalsContact O-OG 3.12Å; S541-I545 WeakPolarHBondContact O-CB 3.35Å; S541-I545 WeakPolarHBondContact O-CD1 3.29Å; S541-I545 WeakPolarHBondContact O-CG1 3.28Å; S541-I545 PolarHBondContact O-N 3.1Å; S541-I545 VanDerWaalsContact O-N 3.08Å
542	K	32.5	Very low	36.9	Very low	132 Å²	132	92.5 Å²	92.5	57%	0.574	53%	0.529	S	S	*	.	H	α-helix	trans	-69.5	-40.6	175	-70.3	178.3	177.9	174.9	0	111.7	N539 N546	N539-K542 PolarHBondContact O-N 3.46Å; N539-K542 VanDerWaalsContact O-N 3.12Å; K542-N546 PolarHBondContact O-N 3.26Å
543	L	31.3	Very low	38.2	Very low	71 Å²	71	94.9 Å²	94.9	37%	0.372	52%	0.523	S	S	.	.	H	α-helix	trans	-62.7	-45.8	174	-92.3	80.5	0	0	0	111.4	N539 S540 I545 N546 F547 I596	N539-L543 HydrophobicContact CB-CD1 4.35Å; N539-L543 VanDerWaalsContact O-CD1 3.23Å; N539-L543 WeakPolarHBondContact O-CD1 3.38Å; N539-L543 PolarHBondContact O-N 3.47Å; S540-L543 PolarHBondContact O-N 2.92Å; L543-I545 PolarHBondContact O-N 3.37Å; L543-N546 PolarHBondContact O-N 2.89Å; L543-F547 VanDerWaalsContact O-CB 3.31Å; L543-F547 WeakPolarHBondContact O-CB 3.43Å; L543-F547 PolarHBondContact O-N 3.4Å; L543-I596 HydrophobicContact CD2-CG2 3.91Å; L543-I596 HydrophobicContact CG-CG2 4.05Å
544	S	35.6	Very low	39.5	Very low	57 Å²	57	89.7 Å²	89.7	40%	0.399	49%	0.486	S	S	.	.	H	α-helix	trans	-66.3	-35.8	179.6	68.9	0	0	0	0	113	S540 S541 F547 N548	S540-S544 PolarHBondContact O-N 3.47Å; S540-S544 PolarHBondContact O-OG 3.36Å; S541-S544 PolarHBondContact O-OG 3.41Å; S541-S544 VanDerWaalsContact O-OG 3.12Å; S544-F547 PolarHBondContact O-N 2.96Å; S544-N548 WeakPolarHBondContact O-CB 3.42Å; S544-N548 VanDerWaalsContact O-CG 3.28Å; S544-N548 PolarHBondContact O-N 3.09Å
545	I	41.7	Very low	40.8	Very low	89 Å²	89	87.4 Å²	87.4	46%	0.456	47%	0.47	S	S	.	.	H	α-helix	trans	-64.3	-41.4	173.4	-70.9	166.1	0	0	0	111.4	S541 L543 K549	S541-I545 WeakPolarHBondContact O-CB 3.35Å; S541-I545 WeakPolarHBondContact O-CD1 3.29Å; S541-I545 WeakPolarHBondContact O-CG1 3.28Å; S541-I545 PolarHBondContact O-N 3.1Å; S541-I545 VanDerWaalsContact O-N 3.08Å; L543-I545 PolarHBondContact O-N 3.37Å; I545-K549 HydrophobicContact CG2-CD 4.28Å; I545-K549 WeakPolarHBondContact O-CB 3.1Å; I545-K549 VanDerWaalsContact O-CG 3.29Å; I545-K549 WeakPolarHBondContact O-CG 3.44Å; I545-K549 PolarHBondContact O-N 3.3Å; I545-K549 VanDerWaalsContact O-N 3.16Å
546	N	48.9	Very low	42.2	Very low	87 Å²	87	88 Å²	88	47%	0.465	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-43.9	175.6	-78.2	-5.3	0	0	0	111.8	K542 L543 N548 K549 L550	K542-N546 PolarHBondContact O-N 3.26Å; L543-N546 PolarHBondContact O-N 2.89Å; N546-N548 PolarHBondContact O-N 3.09Å; N546-K549 PolarHBondContact O-N 2.93Å; N546-L550 WeakPolarHBondContact O-CB 3.33Å; N546-L550 PolarHBondContact O-N 3.04Å
547	F	41.4	Very low	43.2	Very low	49 Å²	49	84.8 Å²	84.8	22%	0.215	44%	0.436	C	S	.	.	H	α-helix	trans	-58.1	-48.5	177.3	-176.8	-97.3	0	0	0	111.9	L543 S544 K549 L550 I551 L593 I605	L543-F547 VanDerWaalsContact O-CB 3.31Å; L543-F547 WeakPolarHBondContact O-CB 3.43Å; L543-F547 PolarHBondContact O-N 3.4Å; S544-F547 PolarHBondContact O-N 2.96Å; F547-K549 PolarHBondContact O-N 2.83Å; F547-L550 PolarHBondContact O-N 3.28Å; F547-I551 HydrophobicContact CD1-CD1 3.88Å; F547-I551 HydrophobicContact CE1-CD1 3.34Å; F547-I551 HydrophobicContact CE1-CG1 4.45Å; F547-I551 HydrophobicContact CE2-CD1 4.37Å; F547-I551 HydrophobicContact CZ-CD1 3.63Å; F547-I551 PolarHBondContact O-N 2.83Å; F547-L593 HydrophobicContact CD2-CD2 3.61Å; F547-L593 HydrophobicContact CE2-CD2 3.63Å; F547-I605 HydrophobicContact CZ-CD1 4.3Å
548	N	50.8	Low	44.2	Very low	101 Å²	101	80 Å²	80	54%	0.54	41%	0.411	S	S	.	.	H	α-helix	trans	-64.5	-41.2	178.5	-72.4	-9.8	0	0	0	112.1	S544 N546 L550 I551 E552	S544-N548 WeakPolarHBondContact O-CB 3.42Å; S544-N548 VanDerWaalsContact O-CG 3.28Å; S544-N548 PolarHBondContact O-N 3.09Å; N546-N548 PolarHBondContact O-N 3.09Å; N548-L550 VanDerWaalsContact C-N 3.32Å; N548-L550 PolarHBondContact O-N 3.33Å; N548-I551 PolarHBondContact O-N 2.91Å; N548-E552 WeakPolarHBondContact O-CB 3.27Å; N548-E552 PolarHBondContact O-N 3.11Å
549	K	55.3	Low	45.5	Very low	128 Å²	128	78 Å²	78	56%	0.557	41%	0.408	S	S	*	.	H	α-helix	trans	-63	-36.9	174.3	-76.8	175	178.2	-179.6	0	112.7	I545 N546 F547 E552 R553	I545-K549 HydrophobicContact CG2-CD 4.28Å; I545-K549 WeakPolarHBondContact O-CB 3.1Å; I545-K549 VanDerWaalsContact O-CG 3.29Å; I545-K549 WeakPolarHBondContact O-CG 3.44Å; I545-K549 PolarHBondContact O-N 3.3Å; I545-K549 VanDerWaalsContact O-N 3.16Å; N546-K549 PolarHBondContact O-N 2.93Å; F547-K549 PolarHBondContact O-N 2.83Å; K549-E552 PolarHBondContact O-N 2.62Å; K549-R553 WeakPolarHBondContact O-CB 3.49Å; K549-R553 PolarHBondContact O-N 2.94Å
550	L	51.7	Low	46.1	Very low	23 Å²	23	79.9 Å²	79.9	12%	0.12	42%	0.417	C	S	.	.	H	α-helix	trans	-73.6	-39.1	179.8	-162.4	161.7	0	0	0	110.8	N546 F547 N548 R553 L554 D589 N592 L593	N546-L550 WeakPolarHBondContact O-CB 3.33Å; N546-L550 PolarHBondContact O-N 3.04Å; F547-L550 PolarHBondContact O-N 3.28Å; N548-L550 VanDerWaalsContact C-N 3.32Å; N548-L550 PolarHBondContact O-N 3.33Å; L550-R553 WeakPolarHBondContact O-CB 3.32Å; L550-R553 PolarHBondContact O-N 3.22Å; L550-L554 HydrophobicContact CD2-CD1 3.6Å; L550-L554 HydrophobicContact CD2-CG 4.05Å; L550-L554 WeakPolarHBondContact O-CB 3.48Å; L550-L554 WeakPolarHBondContact O-CG 3.39Å; L550-L554 PolarHBondContact O-N 2.98Å; L550-D589 HydrophobicContact CD2-CB 3.95Å; L550-D589 HydrophobicContact CG-CB 4.48Å; L550-N592 HydrophobicContact CD1-CB 4.22Å; L550-L593 HydrophobicContact CD1-CG 4.21Å; L550-L593 HydrophobicContact CD2-CD1 3.66Å; L550-L593 HydrophobicContact CD2-CG 3.86Å
551	I	53	Low	46.7	Very low	68 Å²	68	80.3 Å²	80.3	35%	0.349	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-42.2	169	-72.2	-179.2	0	0	0	111.7	F547 N548 R553 L554 S555	F547-I551 HydrophobicContact CD1-CD1 3.88Å; F547-I551 HydrophobicContact CE1-CD1 3.34Å; F547-I551 HydrophobicContact CE1-CG1 4.45Å; F547-I551 HydrophobicContact CE2-CD1 4.37Å; F547-I551 HydrophobicContact CZ-CD1 3.63Å; F547-I551 PolarHBondContact O-N 2.83Å; N548-I551 PolarHBondContact O-N 2.91Å; I551-R553 VanDerWaalsContact C-N 3.29Å; I551-R553 PolarHBondContact O-N 2.84Å; I551-L554 PolarHBondContact O-N 2.85Å; I551-S555 VanDerWaalsContact O-CB 3.24Å; I551-S555 WeakPolarHBondContact O-CB 3.46Å; I551-S555 PolarHBondContact O-N 3.3Å
552	E	56.5	Low	47.2	Very low	104 Å²	104	81.3 Å²	81.3	49%	0.486	42%	0.419	S	S	.	.	H	α-helix	trans	-62.9	-37.9	175.8	-164.5	-165.8	162.1	0	0	111.4	N548 K549 K556	N548-E552 WeakPolarHBondContact O-CB 3.27Å; N548-E552 PolarHBondContact O-N 3.11Å; K549-E552 PolarHBondContact O-N 2.62Å; E552-K556 WeakPolarHBondContact O-CG 3.48Å; E552-K556 PolarHBondContact O-N 3.08Å; E552-K556 VanDerWaalsContact OE1-CE 3.3Å; E552-K556 WeakPolarHBondContact OE1-CE 3.48Å; E552-K556 IonicContact OE1-NZ 2.73Å; E552-K556 PolarHBondContact OE1-NZ 3.07Å
553	R	53.9	Low	47.4	Very low	147 Å²	147	80.8 Å²	80.8	56%	0.555	43%	0.432	S	S	*	.	H	α-helix	trans	-64.1	-55.3	174.3	-169.5	178.2	-168.3	155.8	0.3	111.3	K549 L550 I551 S555 K556 T557	K549-R553 WeakPolarHBondContact O-CB 3.49Å; K549-R553 PolarHBondContact O-N 2.94Å; L550-R553 WeakPolarHBondContact O-CB 3.32Å; L550-R553 PolarHBondContact O-N 3.22Å; I551-R553 VanDerWaalsContact C-N 3.29Å; I551-R553 PolarHBondContact O-N 2.84Å; R553-S555 VanDerWaalsContact C-N 3.28Å; R553-S555 PolarHBondContact O-N 2.56Å; R553-K556 WeakPolarHBondContact O-CA 3.33Å; R553-K556 WeakPolarHBondContact O-CB 3.41Å; R553-K556 PolarHBondContact O-N 3.23Å; R553-T557 PolarHBondContact O-N 3.48Å; R553-T557 PolarHBondContact O-OG1 3.44Å
554	L	50.9	Low	47.6	Very low	8 Å²	8	84.3 Å²	84.3	4%	0.042	45%	0.448	C	S	.	.	H	α-helix	trans	-54.9	-42	175.7	-77.8	172.1	0	0	0	112.2	L550 I551 K556 T557 I558 F586 D589 L593 L609	L550-L554 HydrophobicContact CD2-CD1 3.6Å; L550-L554 HydrophobicContact CD2-CG 4.05Å; L550-L554 WeakPolarHBondContact O-CB 3.48Å; L550-L554 WeakPolarHBondContact O-CG 3.39Å; L550-L554 PolarHBondContact O-N 2.98Å; I551-L554 PolarHBondContact O-N 2.85Å; L554-K556 VanDerWaalsContact C-N 3.34Å; L554-K556 PolarHBondContact O-N 3.37Å; L554-T557 PolarHBondContact O-N 2.87Å; L554-I558 WeakPolarHBondContact O-CB 3.43Å; L554-I558 VanDerWaalsContact O-CG1 3.26Å; L554-I558 WeakPolarHBondContact O-CG1 3.47Å; L554-I558 PolarHBondContact O-N 3.26Å; L554-F586 HydrophobicContact CD2-CD2 3.76Å; L554-F586 HydrophobicContact CD2-CE2 4.27Å; L554-D589 HydrophobicContact CD1-CB 4.46Å; L554-D589 HydrophobicContact CD2-CB 3.74Å; L554-D589 HydrophobicContact CG-CB 4.1Å; L554-L593 HydrophobicContact CD1-CD1 4.33Å; L554-L609 HydrophobicContact CD1-CD2 4.45Å
555	S	53.7	Low	47.6	Very low	74 Å²	74	88.7 Å²	88.7	52%	0.517	47%	0.467	S	S	.	.	H	α-helix	trans	-63.3	-39.5	176.4	-168.9	0	0	0	0	112	I551 R553 I558 S559	I551-S555 VanDerWaalsContact O-CB 3.24Å; I551-S555 WeakPolarHBondContact O-CB 3.46Å; I551-S555 PolarHBondContact O-N 3.3Å; R553-S555 VanDerWaalsContact C-N 3.28Å; R553-S555 PolarHBondContact O-N 2.56Å; S555-I558 PolarHBondContact O-N 3.02Å; S555-S559 WeakPolarHBondContact O-CB 3.19Å; S555-S559 PolarHBondContact O-N 3.09Å; S555-S559 PolarHBondContact O-OG 3.34Å
556	K	56.1	Low	47.3	Very low	113 Å²	113	90 Å²	90	49%	0.491	47%	0.474	S	S	.	.	H	α-helix	trans	-66.3	-42.8	173.5	-75	170.4	-172.9	171.1	0	111.9	E552 R553 L554 I558 S559 L560	E552-K556 WeakPolarHBondContact O-CG 3.48Å; E552-K556 PolarHBondContact O-N 3.08Å; E552-K556 VanDerWaalsContact OE1-CE 3.3Å; E552-K556 WeakPolarHBondContact OE1-CE 3.48Å; E552-K556 IonicContact OE1-NZ 2.73Å; E552-K556 PolarHBondContact OE1-NZ 3.07Å; R553-K556 WeakPolarHBondContact O-CA 3.33Å; R553-K556 WeakPolarHBondContact O-CB 3.41Å; R553-K556 PolarHBondContact O-N 3.23Å; L554-K556 VanDerWaalsContact C-N 3.34Å; L554-K556 PolarHBondContact O-N 3.37Å; K556-I558 VanDerWaalsContact C-N 3.34Å; K556-I558 PolarHBondContact O-N 2.8Å; K556-S559 WeakPolarHBondContact CA-OG 3.47Å; K556-S559 CarbonylContact O-C 3.38Å; K556-S559 PolarHBondContact O-N 3.44Å; K556-S559 VanDerWaalsContact O-N 3.09Å; K556-S559 PolarHBondContact O-OG 2.59Å; K556-L560 WeakPolarHBondContact O-CG 3.35Å; K556-L560 PolarHBondContact O-N 3.34Å
557	T	50.2	Low	46.8	Very low	25 Å²	25	94.8 Å²	94.8	15%	0.153	49%	0.494	C	S	.	.	H	α-helix	trans	-60.5	-43.2	175.3	-36.7	0	0	0	0	111.6	R553 L554 S559 L560 Y582 L585	R553-T557 PolarHBondContact O-N 3.48Å; R553-T557 PolarHBondContact O-OG1 3.44Å; L554-T557 PolarHBondContact O-N 2.87Å; T557-S559 VanDerWaalsContact C-N 3.28Å; T557-S559 PolarHBondContact O-N 3.21Å; T557-L560 PolarHBondContact O-N 3.2Å; T557-Y582 HydrophobicContact CG2-CD2 3.77Å; T557-Y582 HydrophobicContact CG2-CE2 4.28Å; T557-L585 HydrophobicContact CG2-CD2 3.56Å
558	I	49.8	Very low	46.7	Very low	50 Å²	50	94.8 Å²	94.8	26%	0.256	50%	0.5	S	S	.	.	H	α-helix	trans	-63.2	-34.1	174.8	-69	164.3	0	0	0	111.5	L554 S555 K556 L560 Y582	L554-I558 WeakPolarHBondContact O-CB 3.43Å; L554-I558 VanDerWaalsContact O-CG1 3.26Å; L554-I558 WeakPolarHBondContact O-CG1 3.47Å; L554-I558 PolarHBondContact O-N 3.26Å; S555-I558 PolarHBondContact O-N 3.02Å; K556-I558 VanDerWaalsContact C-N 3.34Å; K556-I558 PolarHBondContact O-N 2.8Å; I558-L560 VanDerWaalsContact C-N 3.3Å; I558-L560 PolarHBondContact O-N 3.28Å; I558-Y582 HydrophobicContact CG1-CE2 4.11Å
559	S	52.5	Low	46.3	Very low	90 Å²	90	99.4 Å²	99.4	63%	0.629	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-5.2	177.5	71.7	0	0	0	0	115.4	S555 K556 T557	S555-S559 WeakPolarHBondContact O-CB 3.19Å; S555-S559 PolarHBondContact O-N 3.09Å; S555-S559 PolarHBondContact O-OG 3.34Å; K556-S559 WeakPolarHBondContact CA-OG 3.47Å; K556-S559 CarbonylContact O-C 3.38Å; K556-S559 PolarHBondContact O-N 3.44Å; K556-S559 VanDerWaalsContact O-N 3.09Å; K556-S559 PolarHBondContact O-OG 2.59Å; T557-S559 VanDerWaalsContact C-N 3.28Å; T557-S559 PolarHBondContact O-N 3.21Å
560	L	44.6	Very low	45.7	Very low	135 Å²	135	99.5 Å²	99.5	71%	0.707	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	3.6	178.6	-77.5	164.7	0	0	0	113.3	K556 T557 I558	K556-L560 WeakPolarHBondContact O-CG 3.35Å; K556-L560 PolarHBondContact O-N 3.34Å; T557-L560 PolarHBondContact O-N 3.2Å; I558-L560 VanDerWaalsContact C-N 3.3Å; I558-L560 PolarHBondContact O-N 3.28Å
561	L	39.7	Very low	45.4	Very low	80 Å²	80	101.5 Å²	101.5	42%	0.419	53%	0.532	S	S	.	.			trans	-67.8	125.8	179.2	-151.7	75.9	0	0	0	110.5	S563	L561-S563 PolarHBondContact O-N 2.91Å
562	P	42.4	Very low	45	Very low	76 Å²	76	104.2 Å²	104.2	49%	0.494	54%	0.542	S	S	.	.			trans	-69.7	124.9	-174.7	-19.3	32	0	0	0	113	M564	P562-M564 VanDerWaalsContact C-N 3.35Å; P562-M564 HydrophobicContact CB-CB 4.24Å; P562-M564 HydrophobicContact CB-CG 3.59Å; P562-M564 PolarHBondContact O-N 2.83Å
563	S	36.8	Very low	44.6	Very low	121 Å²	121	103.8 Å²	103.8	85%	0.846	54%	0.543	S	S	*	.			trans	-80.8	82.7	161.7	57.9	0	0	0	0	109	L561	L561-S563 PolarHBondContact O-N 2.91Å
564	M	34.4	Very low	44.4	Very low	145 Å²	145	102.7 Å²	102.7	71%	0.714	54%	0.544	S	S	*	.			trans	-135	123.3	-173.6	-65.8	-64.6	-61	0	0	110.7	P562	P562-M564 VanDerWaalsContact C-N 3.35Å; P562-M564 HydrophobicContact CB-CB 4.24Å; P562-M564 HydrophobicContact CB-CG 3.59Å; P562-M564 PolarHBondContact O-N 2.83Å
565	D	36.2	Very low	44.4	Very low	150 Å²	150	105 Å²	105	80%	0.802	56%	0.556	S	S	*	*			trans	-69.1	141.4	175.3	-57.3	-74.8	0	0	0	111.5	E567	D565-E567 PolarHBondContact O-N 3.22Å
566	I	36	Very low	44.3	Very low	117 Å²	117	104.9 Å²	104.9	60%	0.6	55%	0.547	S	S	*	.			trans	-91.5	85.6	-173.5	-51.7	177.6	0	0	0	110.2	I575	I566-I575 HydrophobicContact CD1-CD1 4.05Å; I566-I575 HydrophobicContact CG1-CD1 4.02Å
567	E	37.2	Very low	44.3	Very low	187 Å²	187	102 Å²	102	87%	0.874	54%	0.537	S	S	*	.			trans	-91.4	-14.4	177.7	-68.1	-159.6	141.1	0	0	114.7	D565	D565-E567 PolarHBondContact O-N 3.22Å
568	S	40.2	Very low	44.4	Very low	49 Å²	49	103.9 Å²	103.9	34%	0.343	55%	0.546	S	S	.	.			trans	-139	154.4	179.4	97.2	0	0	0	0	116	N570 D571	S568-N570 PolarHBondContact O-N 3.32Å; S568-N570 PolarHBondContact OG-N 3.15Å; S568-D571 WeakPolarHBondContact CA-OD2 3.06Å; S568-D571 WeakPolarHBondContact CB-OD2 3.46Å; S568-D571 PolarHBondContact N-OD2 3.28Å; S568-D571 PolarHBondContact O-N 3.16Å; S568-D571 PolarHBondContact OG-OD2 3.35Å
569	K	40.9	Very low	44.7	Very low	197 Å²	197	103.4 Å²	103.4	86%	0.857	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.4	174.6	-110.9	-179.6	178.7	178.6	0	114.3
570	N	42.8	Very low	45	Very low	131 Å²	131	100.5 Å²	100.5	70%	0.701	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-29.3	176.2	-71.1	-23.5	0	0	0	111.6	S568 F572 N573	S568-N570 PolarHBondContact O-N 3.32Å; S568-N570 PolarHBondContact OG-N 3.15Å; N570-F572 VanDerWaalsContact C-N 3.27Å; N570-F572 PolarHBondContact O-N 3.4Å; N570-N573 PolarHBondContact O-N 3.21Å
571	D	44.9	Very low	45.6	Very low	65 Å²	65	98.8 Å²	98.8	35%	0.348	51%	0.511	S	S	.	.	H	α-helix	trans	-66.9	-32	-178.8	-53.9	-56.9	0	0	0	111.2	S568 N573 H574 I575	S568-D571 WeakPolarHBondContact CA-OD2 3.06Å; S568-D571 WeakPolarHBondContact CB-OD2 3.46Å; S568-D571 PolarHBondContact N-OD2 3.28Å; S568-D571 PolarHBondContact O-N 3.16Å; S568-D571 PolarHBondContact OG-OD2 3.35Å; D571-N573 PolarHBondContact O-N 3.42Å; D571-H574 CarbonylContact O-C 3.55Å; D571-H574 WeakPolarHBondContact O-CA 3.36Å; D571-H574 WeakPolarHBondContact O-CB 3.49Å; D571-H574 PolarHBondContact O-N 3.17Å; D571-I575 HydrophobicContact CB-CD1 4.35Å; D571-I575 VanDerWaalsContact O-CG1 3.31Å; D571-I575 WeakPolarHBondContact O-CG1 3.35Å; D571-I575 PolarHBondContact O-N 2.74Å
572	F	46.5	Very low	46.6	Very low	124 Å²	124	95.9 Å²	95.9	54%	0.544	50%	0.495	S	S	.	.	H	α-helix	trans	-55.6	-44	178.7	-165.2	-89.3	0	0	0	113.3	N570 H574 I575 Q576	N570-F572 VanDerWaalsContact C-N 3.27Å; N570-F572 PolarHBondContact O-N 3.4Å; F572-H574 VanDerWaalsContact C-N 3.29Å; F572-H574 PolarHBondContact O-N 3.09Å; F572-I575 PolarHBondContact O-N 2.97Å; F572-Q576 WeakPolarHBondContact O-CB 3.27Å; F572-Q576 PolarHBondContact O-N 3.33Å
573	N	46.9	Very low	47.4	Very low	96 Å²	96	94 Å²	94	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-66.9	-32.4	175.8	-71.6	-22.1	0	0	0	111.9	N570 D571 N577	N570-N573 PolarHBondContact O-N 3.21Å; D571-N573 PolarHBondContact O-N 3.42Å; N573-N577 PolarHBondContact O-N 3.14Å; N573-N577 PolarHBondContact O-ND2 3.43Å
574	H	49.9	Very low	48.6	Very low	124 Å²	124	92.3 Å²	92.3	57%	0.574	46%	0.461	S	S	*	.	H	α-helix	trans	-73.8	-38.7	178.2	-144.6	-39.9	0	0	0	111.4	D571 F572 N578	D571-H574 CarbonylContact O-C 3.55Å; D571-H574 WeakPolarHBondContact O-CA 3.36Å; D571-H574 WeakPolarHBondContact O-CB 3.49Å; D571-H574 PolarHBondContact O-N 3.17Å; F572-H574 VanDerWaalsContact C-N 3.29Å; F572-H574 PolarHBondContact O-N 3.09Å; H574-N578 WeakPolarHBondContact O-CB 3.21Å; H574-N578 PolarHBondContact O-N 3.31Å; H574-N578 PolarHBondContact O-ND2 3.36Å; H574-N578 PolarHBondContact O-OD1 3.02Å
575	I	50.9	Low	49.9	Very low	57 Å²	57	88.4 Å²	88.4	29%	0.292	44%	0.442	S	S	.	.	H	α-helix	trans	-63.2	-47.9	172.3	-68.8	162.9	0	0	0	110.2	I566 D571 F572 N577 N578 I579	I566-I575 HydrophobicContact CD1-CD1 4.05Å; I566-I575 HydrophobicContact CG1-CD1 4.02Å; D571-I575 HydrophobicContact CB-CD1 4.35Å; D571-I575 VanDerWaalsContact O-CG1 3.31Å; D571-I575 WeakPolarHBondContact O-CG1 3.35Å; D571-I575 PolarHBondContact O-N 2.74Å; F572-I575 PolarHBondContact O-N 2.97Å; I575-N577 VanDerWaalsContact C-N 3.35Å; I575-N577 PolarHBondContact O-N 3.19Å; I575-N578 PolarHBondContact O-N 3.46Å; I575-I579 HydrophobicContact CG2-CD1 3.61Å; I575-I579 HydrophobicContact CG2-CG1 4.33Å; I575-I579 VanDerWaalsContact O-CG1 3.3Å; I575-I579 WeakPolarHBondContact O-CG1 3.44Å; I575-I579 PolarHBondContact O-N 2.77Å
576	Q	52.4	Low	51.2	Low	70 Å²	70	81.7 Å²	81.7	33%	0.327	41%	0.406	S	S	.	.	H	α-helix	trans	-59.4	-43.2	179	-173.7	173.9	11.5	0	0	112.3	T93 F572 I579 K580	T93-Q576 PolarHBondContact OG1-NE2 3.02Å; F572-Q576 WeakPolarHBondContact O-CB 3.27Å; F572-Q576 PolarHBondContact O-N 3.33Å; Q576-I579 PolarHBondContact O-N 3.06Å; Q576-K580 WeakPolarHBondContact O-CB 3.46Å; Q576-K580 PolarHBondContact O-N 3.19Å
577	N	54.3	Low	52.4	Low	52 Å²	52	79.7 Å²	79.7	28%	0.278	40%	0.399	S	S	.	.	H	α-helix	trans	-65.1	-45.4	174.8	-71.3	-36.3	0	0	0	112	S94 N573 I575 I579 K580 D581	S94-N577 WeakPolarHBondContact CA-OD1 3.46Å; S94-N577 WeakPolarHBondContact CB-OD1 3.02Å; S94-N577 PolarHBondContact OG-OD1 3.49Å; N573-N577 PolarHBondContact O-N 3.14Å; N573-N577 PolarHBondContact O-ND2 3.43Å; I575-N577 VanDerWaalsContact C-N 3.35Å; I575-N577 PolarHBondContact O-N 3.19Å; N577-I579 VanDerWaalsContact C-N 3.32Å; N577-I579 PolarHBondContact O-N 3.19Å; N577-K580 PolarHBondContact O-N 3.46Å; N577-K580 VanDerWaalsContact O-N 3.14Å; N577-D581 PolarHBondContact O-N 2.99Å
578	N	53.2	Low	53.6	Low	65 Å²	65	74.7 Å²	74.7	35%	0.348	38%	0.378	S	S	.	.	H	α-helix	trans	-61.2	-38.8	177.4	-67.5	-8.1	0	0	0	112.3	H574 I575 Y582	H574-N578 WeakPolarHBondContact O-CB 3.21Å; H574-N578 PolarHBondContact O-N 3.31Å; H574-N578 PolarHBondContact O-ND2 3.36Å; H574-N578 PolarHBondContact O-OD1 3.02Å; I575-N578 PolarHBondContact O-N 3.46Å; N578-Y582 WeakPolarHBondContact O-CB 3.37Å; N578-Y582 PolarHBondContact O-N 2.75Å; N578-Y582 VanDerWaalsContact O-N 3.07Å
579	I	57.1	Low	54.5	Low	40 Å²	40	72.9 Å²	72.9	21%	0.205	37%	0.365	C	S	.	.	H	α-helix	trans	-64.9	-42.6	174.8	-70.1	166.3	0	0	0	110.4	I575 Q576 N577 Y582 T583 C620	I575-I579 HydrophobicContact CG2-CD1 3.61Å; I575-I579 HydrophobicContact CG2-CG1 4.33Å; I575-I579 VanDerWaalsContact O-CG1 3.3Å; I575-I579 WeakPolarHBondContact O-CG1 3.44Å; I575-I579 PolarHBondContact O-N 2.77Å; Q576-I579 PolarHBondContact O-N 3.06Å; N577-I579 VanDerWaalsContact C-N 3.32Å; N577-I579 PolarHBondContact O-N 3.19Å; I579-Y582 WeakPolarHBondContact O-CB 3.24Å; I579-Y582 PolarHBondContact O-N 3.46Å; I579-T583 WeakPolarHBondContact O-CG2 3.26Å; I579-T583 PolarHBondContact O-N 3.01Å; I579-T583 PolarHBondContact O-OG1 2.95Å; I579-C620 HydrophobicContact CD1-CB 3.84Å; I579-C620 HydrophobicContact CG1-CB 4.42Å
580	K	57.1	Low	55.5	Low	29 Å²	29	64.9 Å²	64.9	13%	0.126	33%	0.331	C	S	.	.	H	α-helix	trans	-68	-42.8	179.7	-166.1	-136.7	155.5	-157.9	0	112.3	T91 S94 Q576 N577 Y582 T583 E584	T91-K580 VanDerWaalsContact O-CE 3.26Å; T91-K580 WeakPolarHBondContact O-CE 3.49Å; T91-K580 PolarHBondContact O-NZ 3.38Å; T91-K580 VanDerWaalsContact O-NZ 3.11Å; S94-K580 VanDerWaalsContact OG-CD 3.22Å; S94-K580 WeakPolarHBondContact OG-CD 3.1Å; Q576-K580 WeakPolarHBondContact O-CB 3.46Å; Q576-K580 PolarHBondContact O-N 3.19Å; N577-K580 PolarHBondContact O-N 3.46Å; N577-K580 VanDerWaalsContact O-N 3.14Å; K580-Y582 PolarHBondContact O-N 3.26Å; K580-T583 PolarHBondContact O-N 3.24Å; K580-T583 PolarHBondContact O-OG1 3.27Å; K580-T583 VanDerWaalsContact O-OG1 3.06Å; K580-E584 WeakPolarHBondContact CE-OE2 3.49Å; K580-E584 IonicContact NZ-OE2 3.79Å; K580-E584 PolarHBondContact NZ-OE2 2.77Å; K580-E584 WeakPolarHBondContact O-CB 3.42Å; K580-E584 PolarHBondContact O-N 2.95Å
581	D	58.7	Low	56.5	Low	99 Å²	99	63.2 Å²	63.2	53%	0.529	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-35.3	173.8	-72.1	-7.4	0	0	0	111	N577 L585	N577-D581 PolarHBondContact O-N 2.99Å; D581-L585 WeakPolarHBondContact O-CB 3.44Å; D581-L585 PolarHBondContact O-N 3.11Å
582	Y	59.5	Low	57.1	Low	20 Å²	20	63.6 Å²	63.6	8%	0.078	32%	0.324	C	S	.	.	H	α-helix	trans	-67.5	-43.1	172.9	169.8	-100	0	0	0	113.3	T557 I558 N578 I579 K580 F586 H613 T616	T557-Y582 HydrophobicContact CG2-CD2 3.77Å; T557-Y582 HydrophobicContact CG2-CE2 4.28Å; I558-Y582 HydrophobicContact CG1-CE2 4.11Å; N578-Y582 WeakPolarHBondContact O-CB 3.37Å; N578-Y582 PolarHBondContact O-N 2.75Å; N578-Y582 VanDerWaalsContact O-N 3.07Å; I579-Y582 WeakPolarHBondContact O-CB 3.24Å; I579-Y582 PolarHBondContact O-N 3.46Å; K580-Y582 PolarHBondContact O-N 3.26Å; Y582-F586 VanDerWaalsContact O-CB 3.29Å; Y582-F586 WeakPolarHBondContact O-CB 3.27Å; Y582-F586 PolarHBondContact O-N 2.81Å; Y582-H613 AromaticContact CD1-CE1 3.89Å; Y582-H613 AromaticContact CE1-CE1 3.36Å; Y582-H613 WeakPolarHBondContact CE1-CE1 3.46Å; Y582-H613 AromaticContact CE1-ND1 3.39Å; Y582-H613 WeakPolarHBondContact CE1-ND1 3.2Å; Y582-H613 AromaticContact CZ-CE1 3.97Å; Y582-H613 AromaticContact CZ-ND1 3.64Å; Y582-H613 PolarHBondContact OH-ND1 3.21Å; Y582-T616 HydrophobicContact CE1-CG2 4.16Å
583	T	59.9	Low	57.6	Low	36 Å²	36	58 Å²	58	22%	0.221	30%	0.3	C	S	.	.	H	α-helix	trans	-71.1	-37.7	177.2	58.4	0	0	0	0	112.2	I579 K580 F586 T587 I617	I579-T583 WeakPolarHBondContact O-CG2 3.26Å; I579-T583 PolarHBondContact O-N 3.01Å; I579-T583 PolarHBondContact O-OG1 2.95Å; K580-T583 PolarHBondContact O-N 3.24Å; K580-T583 PolarHBondContact O-OG1 3.27Å; K580-T583 VanDerWaalsContact O-OG1 3.06Å; T583-F586 PolarHBondContact O-N 3.33Å; T583-T587 WeakPolarHBondContact O-CG2 3.34Å; T583-T587 PolarHBondContact O-N 2.85Å; T583-T587 PolarHBondContact O-OG1 2.91Å; T583-I617 HydrophobicContact CG2-CD1 3.9Å; T583-I617 HydrophobicContact CG2-CG1 4.13Å
584	E	62.2	Low	58.1	Low	86 Å²	86	57.3 Å²	57.3	40%	0.402	30%	0.296	S	S	.	.	H	α-helix	trans	-67.9	-36.1	176.4	-164.2	169.3	159.8	0	0	111.5	K580 T587 N588	K580-E584 WeakPolarHBondContact CE-OE2 3.49Å; K580-E584 IonicContact NZ-OE2 3.79Å; K580-E584 PolarHBondContact NZ-OE2 2.77Å; K580-E584 WeakPolarHBondContact O-CB 3.42Å; K580-E584 PolarHBondContact O-N 2.95Å; E584-T587 PolarHBondContact O-OG1 3.21Å; E584-N588 PolarHBondContact O-N 3.03Å; E584-N588 PolarHBondContact O-ND2 2.83Å
585	L	61.1	Low	58.4	Low	63 Å²	63	57.4 Å²	57.4	33%	0.33	30%	0.3	S	S	.	.	H	α-helix	trans	-70.2	-42.1	170.9	-160.4	81.6	0	0	0	112.1	T557 D581 N588 D589	T557-L585 HydrophobicContact CG2-CD2 3.56Å; D581-L585 WeakPolarHBondContact O-CB 3.44Å; D581-L585 PolarHBondContact O-N 3.11Å; L585-N588 PolarHBondContact O-N 3.14Å; L585-D589 PolarHBondContact O-N 3.33Å
586	F	63.3	Low	58.7	Low	9 Å²	9	58 Å²	58	4%	0.039	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-43	179.9	-179.4	-90.1	0	0	0	112.4	L554 Y582 T583 N588 D589 L590 L609 H613	L554-F586 HydrophobicContact CD2-CD2 3.76Å; L554-F586 HydrophobicContact CD2-CE2 4.27Å; Y582-F586 VanDerWaalsContact O-CB 3.29Å; Y582-F586 WeakPolarHBondContact O-CB 3.27Å; Y582-F586 PolarHBondContact O-N 2.81Å; T583-F586 PolarHBondContact O-N 3.33Å; F586-N588 VanDerWaalsContact C-N 3.34Å; F586-N588 PolarHBondContact O-N 3.46Å; F586-D589 PolarHBondContact O-N 3.09Å; F586-L590 HydrophobicContact CE1-CB 4.36Å; F586-L590 HydrophobicContact CE1-CD1 4.43Å; F586-L590 HydrophobicContact CE1-CD2 4.12Å; F586-L590 HydrophobicContact CZ-CD1 4.36Å; F586-L590 WeakPolarHBondContact O-CB 3.41Å; F586-L590 PolarHBondContact O-N 3.09Å; F586-L609 HydrophobicContact CZ-CB 4.46Å; F586-H613 WeakPolarHBondContact CB-CE1 3.33Å; F586-H613 HydrophobicContact CD1-CB 4.17Å; F586-H613 AromaticContact CD1-CD2 3.44Å; F586-H613 VanDerWaalsContact CD1-CD2 3.44Å; F586-H613 WeakPolarHBondContact CD1-CD2 3.48Å; F586-H613 AromaticContact CD1-CE1 3.44Å; F586-H613 VanDerWaalsContact CD1-CE1 3.44Å; F586-H613 WeakPolarHBondContact CD1-CE1 3.46Å; F586-H613 AromaticContact CD1-CG 3.47Å; F586-H613 VanDerWaalsContact CD1-CG 3.47Å; F586-H613 AromaticContact CD1-ND1 3.47Å; F586-H613 WeakPolarHBondContact CD1-ND1 3.21Å; F586-H613 AromaticContact CD1-NE2 3.42Å; F586-H613 WeakPolarHBondContact CD1-NE2 3.19Å; F586-H613 HydrophobicContact CD2-CB 4.36Å; F586-H613 AromaticContact CD2-CE1 3.99Å; F586-H613 AromaticContact CD2-CG 4Å; F586-H613 AromaticContact CD2-ND1 3.48Å; F586-H613 WeakPolarHBondContact CD2-ND1 3.36Å; F586-H613 HydrophobicContact CE1-CB 3.63Å; F586-H613 AromaticContact CE1-CD2 3.58Å; F586-H613 AromaticContact CE1-CG 3.44Å; F586-H613 VanDerWaalsContact CE1-CG 3.44Å; F586-H613 AromaticContact CE1-ND1 3.87Å; F586-H613 HydrophobicContact CE2-CB 3.85Å; F586-H613 AromaticContact CE2-CG 3.98Å; F586-H613 AromaticContact CE2-ND1 3.89Å; F586-H613 AromaticContact CG-CE1 3.31Å; F586-H613 WeakPolarHBondContact CG-CE1 3.49Å; F586-H613 AromaticContact CG-CG 3.76Å; F586-H613 AromaticContact CG-ND1 3.26Å; F586-H613 VanDerWaalsContact CG-ND1 3.26Å; F586-H613 WeakPolarHBondContact CG-ND1 3.44Å; F586-H613 AromaticContact CG-NE2 3.8Å; F586-H613 HydrophobicContact CZ-CB 3.46Å; F586-H613 VanDerWaalsContact CZ-CB 3.46Å; F586-H613 AromaticContact CZ-CG 3.71Å
587	T	62.3	Low	58.8	Low	75 Å²	75	56.5 Å²	56.5	46%	0.46	30%	0.297	S	S	.	.	H	α-helix	trans	-65	-38.1	177.5	52.4	0	0	0	0	111.6	T583 E584 L590 L591	T583-T587 WeakPolarHBondContact O-CG2 3.34Å; T583-T587 PolarHBondContact O-N 2.85Å; T583-T587 PolarHBondContact O-OG1 2.91Å; E584-T587 PolarHBondContact O-OG1 3.21Å; T587-L590 PolarHBondContact O-N 3.48Å; T587-L591 VanDerWaalsContact O-CB 3.24Å; T587-L591 WeakPolarHBondContact O-CB 3.47Å; T587-L591 PolarHBondContact O-N 2.83Å
588	N	62.1	Low	58.8	Low	81 Å²	81	62.8 Å²	62.8	43%	0.433	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-48.5	172.8	-85	-74.1	0	0	0	112.5	E584 L585 F586 L590 L591 N592	E584-N588 PolarHBondContact O-N 3.03Å; E584-N588 PolarHBondContact O-ND2 2.83Å; L585-N588 PolarHBondContact O-N 3.14Å; F586-N588 VanDerWaalsContact C-N 3.34Å; F586-N588 PolarHBondContact O-N 3.46Å; N588-L590 VanDerWaalsContact C-N 3.31Å; N588-L590 PolarHBondContact O-N 3.16Å; N588-L591 PolarHBondContact O-N 3.49Å; N588-N592 PolarHBondContact O-N 3.24Å; N588-N592 PolarHBondContact O-ND2 3.5Å
589	D	58.6	Low	58.6	Low	12 Å²	12	67.7 Å²	67.7	6%	0.064	34%	0.343	C	S	.	.	H	α-helix	trans	-64.2	-35.2	177.5	-87.1	-16.6	0	0	0	111.4	L550 L554 L585 F586 L593	L550-D589 HydrophobicContact CD2-CB 3.95Å; L550-D589 HydrophobicContact CG-CB 4.48Å; L554-D589 HydrophobicContact CD1-CB 4.46Å; L554-D589 HydrophobicContact CD2-CB 3.74Å; L554-D589 HydrophobicContact CG-CB 4.1Å; L585-D589 PolarHBondContact O-N 3.33Å; F586-D589 PolarHBondContact O-N 3.09Å; D589-L593 PolarHBondContact O-N 2.85Å
590	L	62.7	Low	58.3	Low	28 Å²	28	72.4 Å²	72.4	15%	0.147	37%	0.369	C	S	.	.	H	α-helix	trans	-68.1	-43.6	174.1	-170.7	77.3	0	0	0	112.4	F586 T587 N588 N592 L593 L594 L610	F586-L590 HydrophobicContact CE1-CB 4.36Å; F586-L590 HydrophobicContact CE1-CD1 4.43Å; F586-L590 HydrophobicContact CE1-CD2 4.12Å; F586-L590 HydrophobicContact CZ-CD1 4.36Å; F586-L590 WeakPolarHBondContact O-CB 3.41Å; F586-L590 PolarHBondContact O-N 3.09Å; T587-L590 PolarHBondContact O-N 3.48Å; N588-L590 VanDerWaalsContact C-N 3.31Å; N588-L590 PolarHBondContact O-N 3.16Å; L590-N592 VanDerWaalsContact C-N 3.34Å; L590-N592 PolarHBondContact O-N 3.45Å; L590-L593 WeakPolarHBondContact O-CA 3.34Å; L590-L593 VanDerWaalsContact O-CB 3.29Å; L590-L593 WeakPolarHBondContact O-CB 3.12Å; L590-L593 PolarHBondContact O-N 3.5Å; L590-L593 VanDerWaalsContact O-N 3.12Å; L590-L594 WeakPolarHBondContact O-CG 3.33Å; L590-L594 PolarHBondContact O-N 3.42Å; L590-L610 HydrophobicContact CD2-CD1 4.29Å
591	L	62.2	Low	57.9	Low	96 Å²	96	75.5 Å²	75.5	50%	0.503	40%	0.4	S	S	.	.	H	α-helix	trans	-63.8	-40.6	177.9	-174.9	67.2	0	0	0	111.2	T587 N588 L593 L594 L595	T587-L591 VanDerWaalsContact O-CB 3.24Å; T587-L591 WeakPolarHBondContact O-CB 3.47Å; T587-L591 PolarHBondContact O-N 2.83Å; N588-L591 PolarHBondContact O-N 3.49Å; L591-L593 VanDerWaalsContact C-N 3.33Å; L591-L593 PolarHBondContact O-N 3.29Å; L591-L594 PolarHBondContact O-N 2.91Å; L591-L595 HydrophobicContact CG-CD1 4.18Å; L591-L595 WeakPolarHBondContact O-CB 3.26Å; L591-L595 WeakPolarHBondContact O-CG 3.4Å; L591-L595 PolarHBondContact O-N 3.34Å
592	N	57.6	Low	57.7	Low	74 Å²	74	72.8 Å²	72.8	40%	0.396	39%	0.385	S	S	.	.	H	α-helix	trans	-62.7	-38.7	171.5	-78	-73.9	0	0	0	111.9	L550 N588 L590 I596	L550-N592 HydrophobicContact CD1-CB 4.22Å; N588-N592 PolarHBondContact O-N 3.24Å; N588-N592 PolarHBondContact O-ND2 3.5Å; L590-N592 VanDerWaalsContact C-N 3.34Å; L590-N592 PolarHBondContact O-N 3.45Å; N592-I596 WeakPolarHBondContact O-CB 3.16Å; N592-I596 WeakPolarHBondContact O-CD1 3.46Å; N592-I596 WeakPolarHBondContact O-CG1 3.4Å; N592-I596 PolarHBondContact O-N 3.18Å; N592-I596 VanDerWaalsContact O-N 3.17Å
593	L	57.5	Low	57.4	Low	5 Å²	5	76.7 Å²	76.7	3%	0.026	41%	0.407	C	S	.	.	H	α-helix	trans	-62.5	-39.4	173.9	-103.7	168.3	0	0	0	113.1	F547 L550 L554 D589 L590 L591 Y606 L609	F547-L593 HydrophobicContact CD2-CD2 3.61Å; F547-L593 HydrophobicContact CE2-CD2 3.63Å; L550-L593 HydrophobicContact CD1-CG 4.21Å; L550-L593 HydrophobicContact CD2-CD1 3.66Å; L550-L593 HydrophobicContact CD2-CG 3.86Å; L554-L593 HydrophobicContact CD1-CD1 4.33Å; D589-L593 PolarHBondContact O-N 2.85Å; L590-L593 WeakPolarHBondContact O-CA 3.34Å; L590-L593 VanDerWaalsContact O-CB 3.29Å; L590-L593 WeakPolarHBondContact O-CB 3.12Å; L590-L593 PolarHBondContact O-N 3.5Å; L590-L593 VanDerWaalsContact O-N 3.12Å; L591-L593 VanDerWaalsContact C-N 3.33Å; L591-L593 PolarHBondContact O-N 3.29Å; L593-Y606 HydrophobicContact CD2-CE1 4.38Å; L593-L609 HydrophobicContact CD1-CD1 4.1Å
594	L	57.7	Low	57.2	Low	83 Å²	83	82.8 Å²	82.8	44%	0.435	43%	0.433	S	S	.	.	H	α-helix	trans	-68.5	-49	177	-70	167.7	0	0	0	111.3	L590 L591 I596 N597 Y606	L590-L594 WeakPolarHBondContact O-CG 3.33Å; L590-L594 PolarHBondContact O-N 3.42Å; L591-L594 PolarHBondContact O-N 2.91Å; L594-I596 PolarHBondContact O-N 3.39Å; L594-N597 PolarHBondContact O-N 2.89Å; L594-N597 VanDerWaalsContact O-N 3.15Å; L594-Y606 HydrophobicContact CD2-CD2 4.14Å; L594-Y606 HydrophobicContact CD2-CE2 4.12Å
595	L	57.1	Low	57	Low	126 Å²	126	81.6 Å²	81.6	66%	0.66	43%	0.429	S	S	*	.	H	α-helix	trans	-60.9	-26.9	179	-74.6	167	0	0	0	113.8	L591	L591-L595 HydrophobicContact CG-CD1 4.18Å; L591-L595 WeakPolarHBondContact O-CB 3.26Å; L591-L595 WeakPolarHBondContact O-CG 3.4Å; L591-L595 PolarHBondContact O-N 3.34Å
596	I	56.9	Low	57	Low	69 Å²	69	79.9 Å²	79.9	35%	0.354	42%	0.418	S	S	.	.	H	α-helix	trans	-82.8	-19	179.8	-72	169.4	0	0	0	112.7	L543 N592 L594	L543-I596 HydrophobicContact CD2-CG2 3.91Å; L543-I596 HydrophobicContact CG-CG2 4.05Å; N592-I596 WeakPolarHBondContact O-CB 3.16Å; N592-I596 WeakPolarHBondContact O-CD1 3.46Å; N592-I596 WeakPolarHBondContact O-CG1 3.4Å; N592-I596 PolarHBondContact O-N 3.18Å; N592-I596 VanDerWaalsContact O-N 3.17Å; L594-I596 PolarHBondContact O-N 3.39Å
597	N	54.6	Low	56.7	Low	39 Å²	39	86.5 Å²	86.5	21%	0.209	44%	0.444	C	S	.	.			trans	-128.1	71.3	-169.8	-81.1	-34.4	0	0	0	112.4	L594 K599 N602 Y606	L594-N597 PolarHBondContact O-N 2.89Å; L594-N597 VanDerWaalsContact O-N 3.15Å; N597-K599 PolarHBondContact O-N 2.98Å; N597-N602 PolarHBondContact ND2-ND2 3.43Å; N597-Y606 WeakPolarHBondContact CB-OH 3.48Å; N597-Y606 PolarHBondContact ND2-OH 3.09Å
598	E	52.8	Low	56.7	Low	183 Å²	183	88.3 Å²	88.3	86%	0.855	45%	0.45	S	S	*	.			trans	-61.3	10.1	172.4	-57.6	-179.5	125.2	0	0	115.2
599	K	48.8	Very low	56.8	Low	168 Å²	168	86 Å²	86	73%	0.73	44%	0.437	S	S	*	.	S	Bend	trans	-132.3	125.3	-172.2	-62.9	-169.4	178.4	-175.4	0	112	N597 A601	N597-K599 PolarHBondContact O-N 2.98Å; K599-A601 PolarHBondContact O-N 2.63Å
600	N	51	Low	57.3	Low	140 Å²	140	89.2 Å²	89.2	75%	0.749	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-57.7	0.3	-165.2	-71	-22.4	0	0	0	118.3	N602 L603	N600-N602 VanDerWaalsContact C-N 3.27Å; N600-N602 PolarHBondContact O-N 3.42Å; N600-L603 HydrophobicContact CB-CD1 4.07Å; N600-L603 WeakPolarHBondContact O-CD1 3.41Å
601	A	50	Low	57.6	Low	94 Å²	94	94.1 Å²	94.1	78%	0.777	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-64	-27	-174.2	0	0	0	0	0	114.3	K599	K599-A601 PolarHBondContact O-N 2.63Å
602	N	53.3	Low	57.8	Low	42 Å²	42	94.1 Å²	94.1	23%	0.225	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-99.7	8.5	-171.6	-71.5	-23.6	0	0	0	115.1	N597 N600 Q604 I605 Y606	N597-N602 PolarHBondContact ND2-ND2 3.43Å; N600-N602 VanDerWaalsContact C-N 3.27Å; N600-N602 PolarHBondContact O-N 3.42Å; N602-Q604 PolarHBondContact O-N 3.31Å; N602-Q604 VanDerWaalsContact O-N 3.15Å; N602-I605 HydrophobicContact CB-CD1 4.49Å; N602-I605 WeakPolarHBondContact O-CA 3.39Å; N602-I605 WeakPolarHBondContact O-CB 3.43Å; N602-I605 PolarHBondContact O-N 2.84Å; N602-Y606 HydrophobicContact CB-CE1 4.21Å; N602-Y606 HydrophobicContact CB-CE2 4.15Å; N602-Y606 PolarHBondContact O-N 3.05Å
603	L	53.9	Low	58.1	Low	101 Å²	101	91.1 Å²	91.1	53%	0.529	45%	0.45	S	S	.	.	H	α-helix	trans	-56.6	-34.4	-176.2	-100.4	91.3	0	0	0	114.1	N600 I605 Y606 Y607	N600-L603 HydrophobicContact CB-CD1 4.07Å; N600-L603 WeakPolarHBondContact O-CD1 3.41Å; L603-I605 VanDerWaalsContact C-N 3.3Å; L603-I605 PolarHBondContact O-N 3Å; L603-Y606 HydrophobicContact CG-CD2 4.38Å; L603-Y606 PolarHBondContact O-N 2.96Å; L603-Y607 WeakPolarHBondContact O-CB 3.5Å; L603-Y607 PolarHBondContact O-N 3.32Å
604	Q	54.8	Low	58.5	Low	164 Å²	164	95.5 Å²	95.5	77%	0.766	47%	0.473	S	S	*	.	H	α-helix	trans	-63.6	-35.5	174.9	-71.8	-177.8	-20.6	0	0	112.5	N602 Y607 L608	N602-Q604 PolarHBondContact O-N 3.31Å; N602-Q604 VanDerWaalsContact O-N 3.15Å; Q604-Y607 PolarHBondContact O-N 3.2Å; Q604-L608 WeakPolarHBondContact O-CB 3.46Å; Q604-L608 VanDerWaalsContact O-CG 3.26Å; Q604-L608 WeakPolarHBondContact O-CG 3.39Å; Q604-L608 PolarHBondContact O-N 2.9Å
605	I	58.1	Low	58.8	Low	62 Å²	62	95.3 Å²	95.3	32%	0.318	47%	0.473	S	S	.	.	H	α-helix	trans	-69.6	-40.9	177.3	-57.2	178	0	0	0	109.8	F547 N602 L603 L608 L609	F547-I605 HydrophobicContact CZ-CD1 4.3Å; N602-I605 HydrophobicContact CB-CD1 4.49Å; N602-I605 WeakPolarHBondContact O-CA 3.39Å; N602-I605 WeakPolarHBondContact O-CB 3.43Å; N602-I605 PolarHBondContact O-N 2.84Å; L603-I605 VanDerWaalsContact C-N 3.3Å; L603-I605 PolarHBondContact O-N 3Å; I605-L608 PolarHBondContact O-N 3.22Å; I605-L609 HydrophobicContact CG2-CD1 4.06Å; I605-L609 WeakPolarHBondContact O-CB 3.36Å; I605-L609 WeakPolarHBondContact O-CG 3.33Å; I605-L609 PolarHBondContact O-N 3.12Å
606	Y	60.5	Low	59	Low	27 Å²	27	90.9 Å²	90.9	11%	0.106	45%	0.451	C	S	.	.	H	α-helix	trans	-63.2	-44.9	174.3	-52.1	-34.7	0	0	0	111.8	L593 L594 N597 N602 L603 L608 L609 L610	L593-Y606 HydrophobicContact CD2-CE1 4.38Å; L594-Y606 HydrophobicContact CD2-CD2 4.14Å; L594-Y606 HydrophobicContact CD2-CE2 4.12Å; N597-Y606 WeakPolarHBondContact CB-OH 3.48Å; N597-Y606 PolarHBondContact ND2-OH 3.09Å; N602-Y606 HydrophobicContact CB-CE1 4.21Å; N602-Y606 HydrophobicContact CB-CE2 4.15Å; N602-Y606 PolarHBondContact O-N 3.05Å; L603-Y606 HydrophobicContact CG-CD2 4.38Å; L603-Y606 PolarHBondContact O-N 2.96Å; Y606-L608 VanDerWaalsContact C-N 3.35Å; Y606-L608 PolarHBondContact O-N 2.9Å; Y606-L609 PolarHBondContact O-N 2.66Å; Y606-L610 VanDerWaalsContact O-CB 3.27Å; Y606-L610 WeakPolarHBondContact O-CB 3.36Å; Y606-L610 PolarHBondContact O-N 2.82Å
607	Y	58.1	Low	59.3	Low	147 Å²	147	90 Å²	90	58%	0.576	45%	0.447	S	S	*	.	H	α-helix	trans	-61.5	-42	177.3	-176.3	-95.1	0	0	0	112	L603 Q604 R611	L603-Y607 WeakPolarHBondContact O-CB 3.5Å; L603-Y607 PolarHBondContact O-N 3.32Å; Q604-Y607 PolarHBondContact O-N 3.2Å; Y607-R611 WeakPolarHBondContact O-CB 3.45Å; Y607-R611 PolarHBondContact O-N 3.29Å
608	L	62.1	Low	59.6	Low	113 Å²	113	93.6 Å²	93.6	59%	0.592	46%	0.462	S	S	*	.	H	α-helix	trans	-66.7	-40.9	176.2	-72.7	169	0	0	0	112.7	Q604 I605 Y606 K612	Q604-L608 WeakPolarHBondContact O-CB 3.46Å; Q604-L608 VanDerWaalsContact O-CG 3.26Å; Q604-L608 WeakPolarHBondContact O-CG 3.39Å; Q604-L608 PolarHBondContact O-N 2.9Å; I605-L608 PolarHBondContact O-N 3.22Å; Y606-L608 VanDerWaalsContact C-N 3.35Å; Y606-L608 PolarHBondContact O-N 2.9Å; L608-K612 VanDerWaalsContact O-CB 3.3Å; L608-K612 WeakPolarHBondContact O-CB 3.27Å; L608-K612 PolarHBondContact O-N 3.07Å
609	L	64.7	Low	59.9	Low	33 Å²	33	90.2 Å²	90.2	17%	0.173	45%	0.449	C	S	.	.	H	α-helix	trans	-64.5	-48	174.6	-81.2	166.1	0	0	0	111.7	L554 F586 L593 I605 Y606 K612 H613	L554-L609 HydrophobicContact CD1-CD2 4.45Å; F586-L609 HydrophobicContact CZ-CB 4.46Å; L593-L609 HydrophobicContact CD1-CD1 4.1Å; I605-L609 HydrophobicContact CG2-CD1 4.06Å; I605-L609 WeakPolarHBondContact O-CB 3.36Å; I605-L609 WeakPolarHBondContact O-CG 3.33Å; I605-L609 PolarHBondContact O-N 3.12Å; Y606-L609 PolarHBondContact O-N 2.66Å; L609-K612 PolarHBondContact O-N 3.49Å; L609-H613 WeakPolarHBondContact O-CB 3.39Å; L609-H613 PolarHBondContact O-N 3.3Å
610	L	68.3	Low	60.2	Low	79 Å²	79	84.4 Å²	84.4	41%	0.414	43%	0.43	S	S	.	.	H	α-helix	trans	-63.2	-45.7	179.3	-168.7	76	0	0	0	111.1	L590 Y606 K612 H613 L614	L590-L610 HydrophobicContact CD2-CD1 4.29Å; Y606-L610 VanDerWaalsContact O-CB 3.27Å; Y606-L610 WeakPolarHBondContact O-CB 3.36Å; Y606-L610 PolarHBondContact O-N 2.82Å; L610-K612 PolarHBondContact O-N 3.48Å; L610-H613 PolarHBondContact O-N 2.8Å; L610-L614 HydrophobicContact CD2-CD1 4.46Å; L610-L614 HydrophobicContact CG-CD1 4.1Å; L610-L614 WeakPolarHBondContact O-CB 3.37Å; L610-L614 WeakPolarHBondContact O-CG 3.49Å; L610-L614 PolarHBondContact O-N 2.99Å
611	R	69.3	Low	60.5	Low	131 Å²	131	82.7 Å²	82.7	49%	0.494	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-40	176.1	-173.6	175.9	-178.6	-178	2	111.9	Y607 N615	Y607-R611 WeakPolarHBondContact O-CB 3.45Å; Y607-R611 PolarHBondContact O-N 3.29Å; R611-N615 WeakPolarHBondContact O-CB 3.43Å; R611-N615 PolarHBondContact O-N 3.32Å; R611-N615 PolarHBondContact O-OD1 3.14Å
612	K	67.1	Low	60.6	Low	96 Å²	96	84.9 Å²	84.9	42%	0.417	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-44.9	173.7	-174.1	177.1	179.5	-179.1	0	111	L608 L609 L610 N615 T616	L608-K612 VanDerWaalsContact O-CB 3.3Å; L608-K612 WeakPolarHBondContact O-CB 3.27Å; L608-K612 PolarHBondContact O-N 3.07Å; L609-K612 PolarHBondContact O-N 3.49Å; L610-K612 PolarHBondContact O-N 3.48Å; K612-N615 PolarHBondContact O-N 3.11Å; K612-T616 PolarHBondContact O-N 2.61Å; K612-T616 PolarHBondContact O-OG1 3.47Å
613	H	63.1	Low	61	Low	12 Å²	12	87.1 Å²	87.1	6%	0.056	44%	0.439	C	S	.	.	H	α-helix	trans	-65.2	-43.8	179	-171.9	75.8	0	0	0	112.5	Y582 F586 L609 L610 T616 I617	Y582-H613 AromaticContact CD1-CE1 3.89Å; Y582-H613 AromaticContact CE1-CE1 3.36Å; Y582-H613 WeakPolarHBondContact CE1-CE1 3.46Å; Y582-H613 AromaticContact CE1-ND1 3.39Å; Y582-H613 WeakPolarHBondContact CE1-ND1 3.2Å; Y582-H613 AromaticContact CZ-CE1 3.97Å; Y582-H613 AromaticContact CZ-ND1 3.64Å; Y582-H613 PolarHBondContact OH-ND1 3.21Å; F586-H613 WeakPolarHBondContact CB-CE1 3.33Å; F586-H613 HydrophobicContact CD1-CB 4.17Å; F586-H613 AromaticContact CD1-CD2 3.44Å; F586-H613 VanDerWaalsContact CD1-CD2 3.44Å; F586-H613 WeakPolarHBondContact CD1-CD2 3.48Å; F586-H613 AromaticContact CD1-CE1 3.44Å; F586-H613 VanDerWaalsContact CD1-CE1 3.44Å; F586-H613 WeakPolarHBondContact CD1-CE1 3.46Å; F586-H613 AromaticContact CD1-CG 3.47Å; F586-H613 VanDerWaalsContact CD1-CG 3.47Å; F586-H613 AromaticContact CD1-ND1 3.47Å; F586-H613 WeakPolarHBondContact CD1-ND1 3.21Å; F586-H613 AromaticContact CD1-NE2 3.42Å; F586-H613 WeakPolarHBondContact CD1-NE2 3.19Å; F586-H613 HydrophobicContact CD2-CB 4.36Å; F586-H613 AromaticContact CD2-CE1 3.99Å; F586-H613 AromaticContact CD2-CG 4Å; F586-H613 AromaticContact CD2-ND1 3.48Å; F586-H613 WeakPolarHBondContact CD2-ND1 3.36Å; F586-H613 HydrophobicContact CE1-CB 3.63Å; F586-H613 AromaticContact CE1-CD2 3.58Å; F586-H613 AromaticContact CE1-CG 3.44Å; F586-H613 VanDerWaalsContact CE1-CG 3.44Å; F586-H613 AromaticContact CE1-ND1 3.87Å; F586-H613 HydrophobicContact CE2-CB 3.85Å; F586-H613 AromaticContact CE2-CG 3.98Å; F586-H613 AromaticContact CE2-ND1 3.89Å; F586-H613 AromaticContact CG-CE1 3.31Å; F586-H613 WeakPolarHBondContact CG-CE1 3.49Å; F586-H613 AromaticContact CG-CG 3.76Å; F586-H613 AromaticContact CG-ND1 3.26Å; F586-H613 VanDerWaalsContact CG-ND1 3.26Å; F586-H613 WeakPolarHBondContact CG-ND1 3.44Å; F586-H613 AromaticContact CG-NE2 3.8Å; F586-H613 HydrophobicContact CZ-CB 3.46Å; F586-H613 VanDerWaalsContact CZ-CB 3.46Å; F586-H613 AromaticContact CZ-CG 3.71Å; L609-H613 WeakPolarHBondContact O-CB 3.39Å; L609-H613 PolarHBondContact O-N 3.3Å; L610-H613 PolarHBondContact O-N 2.8Å; H613-T616 CarbonylContact O-C 3.59Å; H613-T616 PolarHBondContact O-N 2.66Å; H613-T616 VanDerWaalsContact O-N 3.14Å; H613-I617 WeakPolarHBondContact O-CG1 3.37Å; H613-I617 PolarHBondContact O-N 3.33Å
614	L	66.3	Low	61.4	Low	97 Å²	97	86.3 Å²	86.3	51%	0.508	43%	0.434	S	S	.	.	H	α-helix	trans	-61.7	-43.6	174.7	-72.9	168.7	0	0	0	111.9	L610 T616 I617 H618	L610-L614 HydrophobicContact CD2-CD1 4.46Å; L610-L614 HydrophobicContact CG-CD1 4.1Å; L610-L614 WeakPolarHBondContact O-CB 3.37Å; L610-L614 WeakPolarHBondContact O-CG 3.49Å; L610-L614 PolarHBondContact O-N 2.99Å; L614-T616 VanDerWaalsContact C-N 3.33Å; L614-T616 PolarHBondContact O-N 2.83Å; L614-I617 PolarHBondContact O-N 2.74Å; L614-H618 WeakPolarHBondContact O-CB 3.49Å; L614-H618 PolarHBondContact O-N 3.09Å
615	N	63.9	Low	61.7	Low	79 Å²	79	82 Å²	82	42%	0.422	42%	0.415	S	S	.	.	H	α-helix	trans	-62.3	-38.1	172	-81	43.8	0	0	0	112.1	R611 K612 H618 N619	R611-N615 WeakPolarHBondContact O-CB 3.43Å; R611-N615 PolarHBondContact O-N 3.32Å; R611-N615 PolarHBondContact O-OD1 3.14Å; K612-N615 PolarHBondContact O-N 3.11Å; N615-H618 PolarHBondContact O-N 3.45Å; N615-N619 WeakPolarHBondContact O-CB 3.41Å; N615-N619 VanDerWaalsContact O-CG 3.26Å; N615-N619 PolarHBondContact O-N 2.82Å; N615-N619 PolarHBondContact O-OD1 3.18Å
616	T	61.4	Low	61.9	Low	32 Å²	32	83.2 Å²	83.2	20%	0.196	42%	0.421	C	S	.	.	H	α-helix	trans	-67.7	-39.9	175.5	-59.8	0	0	0	0	112.2	Y582 K612 H613 L614 C620	Y582-T616 HydrophobicContact CE1-CG2 4.16Å; K612-T616 PolarHBondContact O-N 2.61Å; K612-T616 PolarHBondContact O-OG1 3.47Å; H613-T616 CarbonylContact O-C 3.59Å; H613-T616 PolarHBondContact O-N 2.66Å; H613-T616 VanDerWaalsContact O-N 3.14Å; L614-T616 VanDerWaalsContact C-N 3.33Å; L614-T616 PolarHBondContact O-N 2.83Å; T616-C620 WeakPolarHBondContact O-CB 3.21Å; T616-C620 PolarHBondContact O-N 3.19Å; T616-C620 PolarHBondContact O-SG 3.28Å
617	I	63.3	Low	62	Low	52 Å²	52	86.7 Å²	86.7	27%	0.267	44%	0.441	S	S	.	.	H	α-helix	trans	-62.4	-49.7	172.6	-69	168.5	0	0	0	109.6	T583 H613 L614 N619 C620 T621	T583-I617 HydrophobicContact CG2-CD1 3.9Å; T583-I617 HydrophobicContact CG2-CG1 4.13Å; H613-I617 WeakPolarHBondContact O-CG1 3.37Å; H613-I617 PolarHBondContact O-N 3.33Å; L614-I617 PolarHBondContact O-N 2.74Å; I617-N619 PolarHBondContact O-N 3.37Å; I617-C620 CarbonylContact O-C 3.5Å; I617-C620 WeakPolarHBondContact O-CA 3.45Å; I617-C620 PolarHBondContact O-N 2.86Å; I617-T621 HydrophobicContact CG2-CG2 4.17Å; I617-T621 WeakPolarHBondContact O-CG2 3.43Å; I617-T621 PolarHBondContact O-N 3.07Å; I617-T621 PolarHBondContact O-OG1 3.32Å
618	H	59.8	Low	62.3	Low	113 Å²	113	82.7 Å²	82.7	52%	0.523	43%	0.432	S	S	.	.	H	α-helix	trans	-53.9	-53.5	-179.7	-174.9	57	0	0	0	111.1	L614 N615 C620 T621 T622	L614-H618 WeakPolarHBondContact O-CB 3.49Å; L614-H618 PolarHBondContact O-N 3.09Å; N615-H618 PolarHBondContact O-N 3.45Å; H618-C620 PolarHBondContact O-N 3.27Å; H618-C620 VanDerWaalsContact O-N 3.09Å; H618-T621 WeakPolarHBondContact CA-OG1 3.37Å; H618-T621 PolarHBondContact O-N 2.95Å; H618-T621 PolarHBondContact O-OG1 3.34Å; H618-T622 PolarHBondContact O-N 2.77Å; H618-T622 PolarHBondContact O-OG1 3.26Å
619	N	60.8	Low	62.3	Low	112 Å²	112	80.5 Å²	80.5	60%	0.599	42%	0.42	S	S	*	.	H	α-helix	trans	-64.4	-9	176.9	-70.9	32.7	0	0	0	115.2	N615 I617 T622	N615-N619 WeakPolarHBondContact O-CB 3.41Å; N615-N619 VanDerWaalsContact O-CG 3.26Å; N615-N619 PolarHBondContact O-N 2.82Å; N615-N619 PolarHBondContact O-OD1 3.18Å; I617-N619 PolarHBondContact O-N 3.37Å; N619-T622 WeakPolarHBondContact CA-OG1 3.29Å
620	C	53.7	Low	62.1	Low	47 Å²	47	84.2 Å²	84.2	32%	0.318	44%	0.439	S	S	.	.	H	α-helix	trans	-105.8	-7.7	172.3	-70	0	0	0	0	112.8	I579 T616 I617 H618	I579-C620 HydrophobicContact CD1-CB 3.84Å; I579-C620 HydrophobicContact CG1-CB 4.42Å; T616-C620 WeakPolarHBondContact O-CB 3.21Å; T616-C620 PolarHBondContact O-N 3.19Å; T616-C620 PolarHBondContact O-SG 3.28Å; I617-C620 CarbonylContact O-C 3.5Å; I617-C620 WeakPolarHBondContact O-CA 3.45Å; I617-C620 PolarHBondContact O-N 2.86Å; H618-C620 PolarHBondContact O-N 3.27Å; H618-C620 VanDerWaalsContact O-N 3.09Å
621	T	58.3	Low	61.6	Low	103 Å²	103	84.6 Å²	84.6	63%	0.632	44%	0.441	S	S	*	.	H	α-helix	trans	-102.9	-19.8	174.6	53.4	0	0	0	0	113.1	I617 H618	I617-T621 HydrophobicContact CG2-CG2 4.17Å; I617-T621 WeakPolarHBondContact O-CG2 3.43Å; I617-T621 PolarHBondContact O-N 3.07Å; I617-T621 PolarHBondContact O-OG1 3.32Å; H618-T621 WeakPolarHBondContact CA-OG1 3.37Å; H618-T621 PolarHBondContact O-N 2.95Å; H618-T621 PolarHBondContact O-OG1 3.34Å
622	T	52.1	Low	60.9	Low	141 Å²	141	80.4 Å²	80.4	87%	0.865	44%	0.437	S	S	*	.			trans	-84.6	0	166.6	56.5	0	0	0	0	110.7	H618 N619	H618-T622 PolarHBondContact O-N 2.77Å; H618-T622 PolarHBondContact O-OG1 3.26Å; N619-T622 WeakPolarHBondContact CA-OG1 3.29Å

Retrieved 622 of 622 residues in 248.2 ms (Link to these results)

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