A0A087Y0U7_POEFO Loading...

Transportin-1

AlphaFold DB (A0A3B3UQ67), UniProt , Accession A0A087Y0U7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 893 aa.

						>A0A087Y0U7_POEFO|A0A087Y0U7
MECEWKPDEQGLQQILQLLKESQSPDTSTQRSVQQRLEQLNQYPDFNNYLIFVLTKLKSEDEPTRSLSGLILKNNVKAHYQNFPNGVSDFIKSECLQNIGDSSPLIRATVGILITTIASKGELQNWPELLPKLCLLLDSEDYNTCEGAFGALQKICEDSAEILDSDMLDRPLNVMIPKFLQFFKHNSPKIRSHAIACVNQFIISRTQALMLHIDPFIENLFALATDEEPEVRKNVCRALVMLLEVRLDRLLPHMHNIVEYMLLRTQDPDENVALEACEFWLTLAEQPVCKEVLCGHLSQLIPVLVNGMKYSEIDIILLKGDIEEDEAIPDNEQDIRPRFHRSRTVAQQHEGDGIEEDDDDDDEMDDDDDDDTISDWNLRKCSAAALDVLANVFRDDLLLHILPLLKELLFHPDWVVKESGILVLGAIAEGCMQGMIPYLPELIPHLIQCLSDKKALVRSITCWTLSRYAHWVVSQPPDIYLKPLMTELLKRILDSNKRVQEAACSAFATLEEEACTELVPYLAFILDTLVFAFSKYQHKNLLILYDAIGTLADSVGHHLNKPEYIQMLMPPLIQKWNQLKDEDKDLFPLLECLSSVATALQSGFLPYCEPVYQRCVNLVQKTLAQAMLHQSQPDQYEVPDKDFMIVALDLLSGLAEGLGGTIEQLVARSNILTLMYQCMQDKMPEVRQSSFALLGDLTKACFQHVKPCIGDFMPILGTNLNPELISVCNNATWAIGEISIQMGPEMQPYIAMVLHQLVEIINRPNTPKTLLENTAITIGRLGYVCPQEVAPMLQQFIRPWCTSLRNIRDNEEKDSAFRGICTMISVNPGGVVQDFIFFCDAVASWVNPKDDLREMFYKILHGFKNQVGEDNWRRFSDQFPLPLKERLATFYGV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	71.7	Confident	250 Å²	250	128.5 Å²	128.5	100%	1.232	64%	0.643	S	S	*	*				0	82.8	0	-84.8	179.3	172.6	0	0	105.6
2	E	41.4	Very low	73.1	Confident	192 Å²	192	119.6 Å²	119.6	90%	0.897	60%	0.599	S	S	*	*			trans	-81.4	135.2	173.8	-79	171.5	165.5	0	0	108.2	E4	E2-E4 PolarHBondContact O-N 3.35Å
3	C	43	Very low	74.3	Confident	136 Å²	136	121.3 Å²	121.3	92%	0.919	60%	0.604	S	S	*	*			trans	-68.6	100.9	176.9	-122	0	0	0	0	107.8	W5	C3-W5 PolarHBondContact O-N 3.14Å
4	E	67.1	Low	75.3	Confident	164 Å²	164	121.4 Å²	121.4	77%	0.766	60%	0.602	S	S	*	*			trans	-59	119	169.5	-77.5	177.1	161.1	0	0	108.9	E2	E2-E4 PolarHBondContact O-N 3.35Å
5	W	85.7	Confident	76.3	Confident	57 Å²	57	114.1 Å²	114.1	22%	0.216	57%	0.566	C	S	.	*			trans	-57.1	138.3	171.5	178.7	93.4	0	0	0	109.8	C3 P7 D45 N48 Y49 F52 F90	C3-W5 PolarHBondContact O-N 3.14Å; W5-P7 HydrophobicContact CH2-CB 3.72Å; W5-P7 HydrophobicContact CH2-CG 4.48Å; W5-P7 HydrophobicContact CZ2-CB 4.47Å; W5-P7 HydrophobicContact CZ3-CB 4.05Å; W5-P7 HydrophobicContact CZ3-CG 4.32Å; W5-D45 PolarHBondContact NE1-OD1 3.17Å; W5-N48 VanDerWaalsContact CD1-ND2 3.28Å; W5-N48 HydrophobicContact CD2-CB 3.71Å; W5-N48 HydrophobicContact CE3-CB 4.14Å; W5-N48 HydrophobicContact CG-CB 4.28Å; W5-N48 HydrophobicContact CH2-CB 3.86Å; W5-N48 HydrophobicContact CZ2-CB 3.4Å; W5-N48 HydrophobicContact CZ3-CB 4.21Å; W5-N48 PolarHBondContact NE1-ND2 3.04Å; W5-Y49 HydrophobicContact CH2-CD1 4.04Å; W5-Y49 HydrophobicContact CH2-CD2 4.19Å; W5-Y49 HydrophobicContact CH2-CE1 4.22Å; W5-Y49 HydrophobicContact CH2-CE2 4.35Å; W5-Y49 HydrophobicContact CH2-CG 4.02Å; W5-Y49 HydrophobicContact CZ2-CD1 4.38Å; W5-Y49 AromaticContact CZ2-CD2 3.81Å; W5-Y49 HydrophobicContact CZ2-CD2 3.81Å; W5-Y49 HydrophobicContact CZ2-CE1 4.32Å; W5-Y49 AromaticContact CZ2-CE2 3.74Å; W5-Y49 HydrophobicContact CZ2-CE2 3.74Å; W5-Y49 HydrophobicContact CZ2-CG 4.12Å; W5-Y49 AromaticContact CZ2-CZ 4Å; W5-F52 HydrophobicContact CH2-CB 4.23Å; W5-F52 HydrophobicContact CZ3-CB 3.78Å; W5-F52 AromaticContact CZ3-CD2 3.85Å; W5-F52 HydrophobicContact CZ3-CD2 3.85Å; W5-F52 AromaticContact CZ3-CG 3.94Å; W5-F52 HydrophobicContact CZ3-CG 3.94Å; W5-F90 HydrophobicContact CD2-CE1 4.34Å; W5-F90 AromaticContact CE3-CE1 3.72Å; W5-F90 HydrophobicContact CE3-CE1 3.72Å; W5-F90 AromaticContact CE3-CZ 3.81Å; W5-F90 HydrophobicContact CE3-CZ 3.81Å; W5-F90 HydrophobicContact CZ3-CE1 4.18Å; W5-F90 HydrophobicContact CZ3-CZ 4.36Å
6	K	85.3	Confident	77.2	Confident	162 Å²	162	108.4 Å²	108.4	70%	0.704	54%	0.538	S	S	*	.			trans	-131.7	137.1	177	-70.7	-170.6	177.7	-175.7	0	110
7	P	88.3	Confident	78	Confident	36 Å²	36	108.5 Å²	108.5	23%	0.234	54%	0.536	C	S	.	.			trans	-69.1	144.7	176.3	30	-34.8	0	0	0	110.4	W5 L12 Y49 F52	W5-P7 HydrophobicContact CH2-CB 3.72Å; W5-P7 HydrophobicContact CH2-CG 4.48Å; W5-P7 HydrophobicContact CZ2-CB 4.47Å; W5-P7 HydrophobicContact CZ3-CB 4.05Å; W5-P7 HydrophobicContact CZ3-CG 4.32Å; P7-L12 HydrophobicContact CB-CB 4.5Å; P7-Y49 HydrophobicContact CB-CD1 4.14Å; P7-Y49 HydrophobicContact CB-CE1 3.61Å; P7-F52 HydrophobicContact CG-CD1 4.16Å; P7-F52 HydrophobicContact CG-CD2 4.31Å; P7-F52 HydrophobicContact CG-CE1 3.77Å; P7-F52 HydrophobicContact CG-CE2 3.92Å; P7-F52 HydrophobicContact CG-CG 4.43Å; P7-F52 HydrophobicContact CG-CZ 3.64Å
8	D	89.9	Confident	78.8	Confident	92 Å²	92	103.1 Å²	103.1	49%	0.492	51%	0.51	S	S	.	.			trans	-79.5	135.8	160.6	175.1	75.9	0	0	0	109.2	Q10 G11 L12 Y49	D8-Q10 VanDerWaalsContact C-N 3.3Å; D8-Q10 PolarHBondContact O-N 3.05Å; D8-Q10 WeakPolarHBondContact OD2-CA 3.42Å; D8-Q10 VanDerWaalsContact OD2-CB 3.26Å; D8-Q10 WeakPolarHBondContact OD2-CB 3.04Å; D8-Q10 PolarHBondContact OD2-N 3.17Å; D8-G11 PolarHBondContact O-N 3.46Å; D8-G11 PolarHBondContact OD2-N 3.15Å; D8-L12 WeakPolarHBondContact O-CB 3.35Å; D8-L12 PolarHBondContact O-N 3.32Å; D8-Y49 PolarHBondContact N-OH 3.34Å
9	E	85.6	Confident	79.4	Confident	170 Å²	170	97.7 Å²	97.7	79%	0.794	48%	0.483	S	S	*	.	H	α-helix	trans	-64.2	-35.3	-175.7	-75.8	-153.2	170.5	0	0	112.7	L12 Q13	E9-L12 PolarHBondContact O-N 3.32Å; E9-Q13 WeakPolarHBondContact O-CB 3.37Å; E9-Q13 PolarHBondContact O-N 2.79Å
10	Q	85.4	Confident	79.9	Confident	137 Å²	137	97.9 Å²	97.9	64%	0.64	48%	0.481	S	S	*	.	H	α-helix	trans	-70.6	-41.4	179.3	-167.9	174.7	14.2	0	0	110.6	D8 Q13 Q14	D8-Q10 VanDerWaalsContact C-N 3.3Å; D8-Q10 PolarHBondContact O-N 3.05Å; D8-Q10 WeakPolarHBondContact OD2-CA 3.42Å; D8-Q10 VanDerWaalsContact OD2-CB 3.26Å; D8-Q10 WeakPolarHBondContact OD2-CB 3.04Å; D8-Q10 PolarHBondContact OD2-N 3.17Å; Q10-Q13 PolarHBondContact O-N 3.08Å; Q10-Q14 WeakPolarHBondContact O-CG 3.43Å; Q10-Q14 PolarHBondContact O-N 2.82Å
11	G	85.4	Confident	80.4	Confident	17 Å²	17	95.3 Å²	95.3	18%	0.175	47%	0.468	C	S	.	.	H	α-helix	trans	-59.8	-47.6	172.2	0	0	0	0	0	112.4	D8 Q13 Q14 I15	D8-G11 PolarHBondContact O-N 3.46Å; D8-G11 PolarHBondContact OD2-N 3.15Å; G11-Q13 VanDerWaalsContact C-N 3.33Å; G11-Q13 PolarHBondContact O-N 3.39Å; G11-Q14 PolarHBondContact O-N 2.64Å; G11-Q14 VanDerWaalsContact O-N 3.17Å; G11-I15 WeakPolarHBondContact O-CG1 3.06Å; G11-I15 PolarHBondContact O-N 3.36Å; G11-I15 VanDerWaalsContact O-N 3.08Å
12	L	89.2	Confident	83.1	Confident	22 Å²	22	84.8 Å²	84.8	12%	0.115	42%	0.419	C	S	.	.	H	α-helix	trans	-60.5	-42.1	179.3	-177.7	62.2	0	0	0	111.8	P7 D8 E9 Q14 I15 L16 Y49 F52 V53 L57	P7-L12 HydrophobicContact CB-CB 4.5Å; D8-L12 WeakPolarHBondContact O-CB 3.35Å; D8-L12 PolarHBondContact O-N 3.32Å; E9-L12 PolarHBondContact O-N 3.32Å; L12-Q14 VanDerWaalsContact C-N 3.31Å; L12-Q14 PolarHBondContact O-N 2.83Å; L12-I15 PolarHBondContact O-N 3.42Å; L12-L16 HydrophobicContact CD1-CG 4.46Å; L12-L16 HydrophobicContact CG-CD1 4.21Å; L12-L16 WeakPolarHBondContact O-CG 3.48Å; L12-L16 PolarHBondContact O-N 2.95Å; L12-Y49 HydrophobicContact CB-CD1 4.29Å; L12-Y49 HydrophobicContact CB-CE1 4.08Å; L12-Y49 HydrophobicContact CD1-CD1 4.19Å; L12-F52 HydrophobicContact CD1-CD1 4.25Å; L12-F52 HydrophobicContact CD2-CE1 4.19Å; L12-V53 HydrophobicContact CD1-CG2 3.76Å; L12-L57 HydrophobicContact CD2-CD1 3.97Å
13	Q	88.9	Confident	85.3	Confident	142 Å²	142	79.7 Å²	79.7	66%	0.664	40%	0.395	S	S	*	.	H	α-helix	trans	-63.6	-36.5	178.2	-165.9	171.3	17.5	0	0	112.5	E9 Q10 G11 Q17	E9-Q13 WeakPolarHBondContact O-CB 3.37Å; E9-Q13 PolarHBondContact O-N 2.79Å; Q10-Q13 PolarHBondContact O-N 3.08Å; G11-Q13 VanDerWaalsContact C-N 3.33Å; G11-Q13 PolarHBondContact O-N 3.39Å; Q13-Q17 WeakPolarHBondContact O-CB 3.37Å; Q13-Q17 PolarHBondContact O-N 3.28Å
14	Q	87.8	Confident	87.5	Confident	123 Å²	123	74.7 Å²	74.7	58%	0.575	36%	0.362	S	S	*	.	H	α-helix	trans	-67.1	-42	175.1	-71.1	179.2	4.5	0	0	112.2	Q10 G11 L12 Q17 L18	Q10-Q14 WeakPolarHBondContact O-CG 3.43Å; Q10-Q14 PolarHBondContact O-N 2.82Å; G11-Q14 PolarHBondContact O-N 2.64Å; G11-Q14 VanDerWaalsContact O-N 3.17Å; L12-Q14 VanDerWaalsContact C-N 3.31Å; L12-Q14 PolarHBondContact O-N 2.83Å; Q14-Q17 PolarHBondContact O-N 3.15Å; Q14-L18 PolarHBondContact O-N 3.14Å
15	I	90.4	Very high	88.4	Confident	12 Å²	12	72.8 Å²	72.8	6%	0.062	36%	0.363	C	S	.	.	H	α-helix	trans	-65	-42.9	177	-60.7	-40.2	0	0	0	111	G11 L12 Q17 L18 L19 L40 F46 Y49 L50	G11-I15 WeakPolarHBondContact O-CG1 3.06Å; G11-I15 PolarHBondContact O-N 3.36Å; G11-I15 VanDerWaalsContact O-N 3.08Å; L12-I15 PolarHBondContact O-N 3.42Å; I15-Q17 VanDerWaalsContact C-N 3.32Å; I15-Q17 PolarHBondContact O-N 3.01Å; I15-L18 WeakPolarHBondContact O-CB 3.32Å; I15-L18 PolarHBondContact O-N 3.3Å; I15-L19 HydrophobicContact CG2-CD1 4.04Å; I15-L19 HydrophobicContact CG2-CG 4.33Å; I15-L19 WeakPolarHBondContact O-CG 3.41Å; I15-L19 PolarHBondContact O-N 3.01Å; I15-L40 HydrophobicContact CD1-CD1 4.12Å; I15-F46 HydrophobicContact CD1-CD2 3.68Å; I15-F46 HydrophobicContact CD1-CE2 3.53Å; I15-F46 HydrophobicContact CG1-CD2 4.32Å; I15-F46 HydrophobicContact CG1-CE2 4.21Å; I15-F46 HydrophobicContact CG2-CE2 4.23Å; I15-Y49 HydrophobicContact CG1-CD1 4.37Å; I15-Y49 HydrophobicContact CG1-CG 4.17Å; I15-L50 HydrophobicContact CG2-CD2 4.47Å
16	L	91	Very high	88.7	Confident	22 Å²	22	73.4 Å²	73.4	12%	0.115	37%	0.371	C	S	.	.	H	α-helix	trans	-63	-39	176.7	-70.7	175.1	0	0	0	112.4	L12 L19 K20 V53 L57 E60	L12-L16 HydrophobicContact CD1-CG 4.46Å; L12-L16 HydrophobicContact CG-CD1 4.21Å; L12-L16 WeakPolarHBondContact O-CG 3.48Å; L12-L16 PolarHBondContact O-N 2.95Å; L16-L19 PolarHBondContact O-N 2.91Å; L16-K20 WeakPolarHBondContact O-CG 3.43Å; L16-K20 PolarHBondContact O-N 3.09Å; L16-V53 HydrophobicContact CD2-CG1 4.18Å; L16-V53 HydrophobicContact CD2-CG2 4.16Å; L16-L57 HydrophobicContact CD1-CD2 3.91Å; L16-L57 HydrophobicContact CD2-CD2 3.75Å; L16-L57 HydrophobicContact CG-CD2 4.36Å; L16-E60 HydrophobicContact CD1-CG 4.48Å; L16-E60 HydrophobicContact CD2-CG 3.81Å
17	Q	90.5	Very high	88.8	Confident	111 Å²	111	69.5 Å²	69.5	52%	0.519	36%	0.361	S	S	.	.	H	α-helix	trans	-62.3	-45	173.9	-178	175	-10.1	0	0	111.1	Q13 Q14 I15 L19 K20 E21	Q13-Q17 WeakPolarHBondContact O-CB 3.37Å; Q13-Q17 PolarHBondContact O-N 3.28Å; Q14-Q17 PolarHBondContact O-N 3.15Å; I15-Q17 VanDerWaalsContact C-N 3.32Å; I15-Q17 PolarHBondContact O-N 3.01Å; Q17-L19 PolarHBondContact O-N 3.46Å; Q17-K20 PolarHBondContact O-N 3.1Å; Q17-E21 HydrophobicContact CG-CG 4.47Å; Q17-E21 WeakPolarHBondContact CG-OE1 3.28Å; Q17-E21 PolarHBondContact NE2-OE1 3.12Å; Q17-E21 WeakPolarHBondContact O-CG 3.4Å; Q17-E21 PolarHBondContact O-N 3.24Å
18	L	91.5	Very high	88.8	Confident	10 Å²	10	71.7 Å²	71.7	5%	0.052	38%	0.377	C	S	.	.	H	α-helix	trans	-62.2	-41.8	178	-174.5	68.4	0	0	0	112.3	Q14 I15 K20 E21 S22 V33 R36 L37 L40	Q14-L18 PolarHBondContact O-N 3.14Å; I15-L18 WeakPolarHBondContact O-CB 3.32Å; I15-L18 PolarHBondContact O-N 3.3Å; L18-K20 VanDerWaalsContact C-N 3.3Å; L18-K20 PolarHBondContact O-N 3.47Å; L18-E21 PolarHBondContact O-N 2.76Å; L18-S22 PolarHBondContact O-N 3.47Å; L18-V33 HydrophobicContact CD1-CB 4.3Å; L18-V33 HydrophobicContact CD1-CG1 3.97Å; L18-V33 HydrophobicContact CD1-CG2 4.16Å; L18-V33 HydrophobicContact CG-CG1 4.44Å; L18-R36 HydrophobicContact CD1-CB 3.88Å; L18-L37 HydrophobicContact CD2-CD2 3.54Å; L18-L37 HydrophobicContact CD2-CG 4.05Å; L18-L37 HydrophobicContact CG-CD2 4.28Å; L18-L40 HydrophobicContact CD2-CD1 3.5Å; L18-L40 VanDerWaalsContact CD2-CD1 3.5Å
19	L	90.9	Very high	88.6	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-66.6	-28.7	176.2	-71.3	173	0	0	0	113.1	I15 L16 Q17 S22 Q23 V53 T64 L67 I71	I15-L19 HydrophobicContact CG2-CD1 4.04Å; I15-L19 HydrophobicContact CG2-CG 4.33Å; I15-L19 WeakPolarHBondContact O-CG 3.41Å; I15-L19 PolarHBondContact O-N 3.01Å; L16-L19 PolarHBondContact O-N 2.91Å; Q17-L19 PolarHBondContact O-N 3.46Å; L19-S22 WeakPolarHBondContact CA-OG 3.48Å; L19-S22 PolarHBondContact O-OG 3.33Å; L19-Q23 WeakPolarHBondContact O-CG 3.15Å; L19-V53 HydrophobicContact CD1-CG1 3.92Å; L19-T64 HydrophobicContact CB-CG2 4Å; L19-T64 HydrophobicContact CD1-CG2 4.22Å; L19-L67 HydrophobicContact CD2-CG 4.39Å; L19-I71 HydrophobicContact CD2-CD1 3.62Å
20	K	89.6	Confident	88.6	Confident	100 Å²	100	65.1 Å²	65.1	44%	0.435	35%	0.346	S	S	.	.	H	α-helix	trans	-78	-39.3	173.4	-73.9	174.8	-177.5	172.7	0	111.2	L16 Q17 L18 S22 Q23 E60	L16-K20 WeakPolarHBondContact O-CG 3.43Å; L16-K20 PolarHBondContact O-N 3.09Å; Q17-K20 PolarHBondContact O-N 3.1Å; L18-K20 VanDerWaalsContact C-N 3.3Å; L18-K20 PolarHBondContact O-N 3.47Å; K20-S22 VanDerWaalsContact C-N 3.28Å; K20-S22 PolarHBondContact O-N 3.34Å; K20-Q23 PolarHBondContact O-N 3.46Å; K20-E60 WeakPolarHBondContact CE-OE2 3.49Å; K20-E60 IonicContact NZ-OE1 3.7Å; K20-E60 PolarHBondContact NZ-OE1 2.91Å; K20-E60 IonicContact NZ-OE2 3.71Å; K20-E60 PolarHBondContact NZ-OE2 3.08Å
21	E	90.2	Very high	88.6	Confident	45 Å²	45	67 Å²	67	21%	0.21	35%	0.347	C	S	.	.	H	α-helix	trans	-63	-34.1	173.8	-72.3	173.7	-171.3	0	0	111.7	Q17 L18 Q23 S24 T29 V33 R36	Q17-E21 HydrophobicContact CG-CG 4.47Å; Q17-E21 WeakPolarHBondContact CG-OE1 3.28Å; Q17-E21 PolarHBondContact NE2-OE1 3.12Å; Q17-E21 WeakPolarHBondContact O-CG 3.4Å; Q17-E21 PolarHBondContact O-N 3.24Å; L18-E21 PolarHBondContact O-N 2.76Å; E21-Q23 PolarHBondContact O-N 3.14Å; E21-S24 WeakPolarHBondContact O-CB 3.47Å; E21-S24 PolarHBondContact O-N 3.23Å; E21-S24 VanDerWaalsContact O-N 3.08Å; E21-T29 HydrophobicContact CB-CG2 4.07Å; E21-V33 HydrophobicContact CB-CG2 3.52Å; E21-R36 IonicContact OE2-NH1 2.85Å; E21-R36 PolarHBondContact OE2-NH1 2.8Å
22	S	87.7	Confident	88.7	Confident	28 Å²	28	68.6 Å²	68.6	20%	0.196	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-20.6	178.2	68.8	0	0	0	0	113.9	L18 L19 K20 S24 L67	L18-S22 PolarHBondContact O-N 3.47Å; L19-S22 WeakPolarHBondContact CA-OG 3.48Å; L19-S22 PolarHBondContact O-OG 3.33Å; K20-S22 VanDerWaalsContact C-N 3.28Å; K20-S22 PolarHBondContact O-N 3.34Å; S22-S24 VanDerWaalsContact C-N 3.33Å; S22-L67 WeakPolarHBondContact OG-CD2 3.49Å
23	Q	87.8	Confident	88.7	Confident	86 Å²	86	67.7 Å²	67.7	40%	0.402	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-1.5	174.4	-62.7	172.6	10.8	0	0	112.7	L19 K20 E21 T64 L67	L19-Q23 WeakPolarHBondContact O-CG 3.15Å; K20-Q23 PolarHBondContact O-N 3.46Å; E21-Q23 PolarHBondContact O-N 3.14Å; Q23-T64 PolarHBondContact NE2-OG1 3.45Å; Q23-L67 HydrophobicContact CG-CD2 3.7Å
24	S	89.3	Confident	88.5	Confident	31 Å²	31	66.9 Å²	66.9	22%	0.217	35%	0.347	C	S	.	.			trans	-63.6	137.5	178.9	-177.1	0	0	0	0	111	E21 S22 D26 Q30	E21-S24 WeakPolarHBondContact O-CB 3.47Å; E21-S24 PolarHBondContact O-N 3.23Å; E21-S24 VanDerWaalsContact O-N 3.08Å; S22-S24 VanDerWaalsContact C-N 3.33Å; S24-D26 PolarHBondContact O-N 3.13Å; S24-D26 PolarHBondContact OG-N 3.08Å; S24-Q30 WeakPolarHBondContact O-CG 3.04Å; S24-Q30 PolarHBondContact O-NE2 3.23Å
25	P	86.6	Confident	88.4	Confident	123 Å²	123	66.9 Å²	66.9	80%	0.799	35%	0.347	S	S	*	.	S	Bend	trans	-73.1	-8	171.8	31.5	-35.5	0	0	0	112.9	T27	P25-T27 PolarHBondContact O-N 3.06Å
26	D	91.6	Very high	88.3	Confident	70 Å²	70	71.8 Å²	71.8	37%	0.374	37%	0.365	S	S	.	.			trans	-79.4	118.1	180	174.9	61.4	0	0	0	112.3	S24 S28 T29 Q30	S24-D26 PolarHBondContact O-N 3.13Å; S24-D26 PolarHBondContact OG-N 3.08Å; D26-S28 VanDerWaalsContact C-N 3.26Å; D26-S28 PolarHBondContact O-N 3.05Å; D26-S28 WeakPolarHBondContact OD2-CB 3.46Å; D26-S28 PolarHBondContact OD2-N 2.88Å; D26-S28 PolarHBondContact OD2-OG 3.03Å; D26-T29 WeakPolarHBondContact O-CB 3.48Å; D26-T29 PolarHBondContact O-N 3.2Å; D26-T29 WeakPolarHBondContact OD2-CB 3.43Å; D26-T29 PolarHBondContact OD2-N 3.07Å; D26-T29 PolarHBondContact OD2-OG1 2.98Å; D26-Q30 PolarHBondContact O-N 3.21Å
27	T	87.3	Confident	88.1	Confident	81 Å²	81	72 Å²	72	50%	0.497	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-33.1	-178.5	-47.4	0	0	0	0	113	P25 Q30 R31	P25-T27 PolarHBondContact O-N 3.06Å; T27-Q30 PolarHBondContact O-N 3.22Å; T27-R31 PolarHBondContact O-N 3.05Å; T27-R31 VanDerWaalsContact O-N 3.1Å
28	S	88.1	Confident	87.8	Confident	81 Å²	81	72.4 Å²	72.4	57%	0.566	37%	0.368	S	S	*	.	H	α-helix	trans	-69.8	-39.3	179.8	83.4	0	0	0	0	111.6	D26 R31 S32	D26-S28 VanDerWaalsContact C-N 3.26Å; D26-S28 PolarHBondContact O-N 3.05Å; D26-S28 WeakPolarHBondContact OD2-CB 3.46Å; D26-S28 PolarHBondContact OD2-N 2.88Å; D26-S28 PolarHBondContact OD2-OG 3.03Å; S28-R31 PolarHBondContact O-N 3.09Å; S28-S32 PolarHBondContact O-N 3.32Å; S28-S32 VanDerWaalsContact O-N 3.12Å
29	T	86.9	Confident	87.5	Confident	40 Å²	40	77.6 Å²	77.6	25%	0.245	39%	0.392	C	S	.	.	H	α-helix	trans	-63.8	-47.1	173.3	-56.4	0	0	0	0	110.4	E21 D26 R31 S32 V33	E21-T29 HydrophobicContact CB-CG2 4.07Å; D26-T29 WeakPolarHBondContact O-CB 3.48Å; D26-T29 PolarHBondContact O-N 3.2Å; D26-T29 WeakPolarHBondContact OD2-CB 3.43Å; D26-T29 PolarHBondContact OD2-N 3.07Å; D26-T29 PolarHBondContact OD2-OG1 2.98Å; T29-R31 PolarHBondContact O-N 3.23Å; T29-S32 WeakPolarHBondContact O-CB 3.49Å; T29-S32 PolarHBondContact O-N 3.22Å; T29-S32 VanDerWaalsContact O-N 3.16Å; T29-V33 HydrophobicContact CG2-CG2 4.31Å; T29-V33 WeakPolarHBondContact O-CB 3.33Å; T29-V33 VanDerWaalsContact O-CG2 3.25Å; T29-V33 WeakPolarHBondContact O-CG2 3.49Å; T29-V33 PolarHBondContact O-N 3.4Å
30	Q	84.3	Confident	87.3	Confident	84 Å²	84	80.1 Å²	80.1	39%	0.393	41%	0.405	S	S	.	.	H	α-helix	trans	-58.1	-43.6	177.6	-70.5	177.4	-3.9	0	0	112.7	S24 D26 T27 V33 Q34	S24-Q30 WeakPolarHBondContact O-CG 3.04Å; S24-Q30 PolarHBondContact O-NE2 3.23Å; D26-Q30 PolarHBondContact O-N 3.21Å; T27-Q30 PolarHBondContact O-N 3.22Å; Q30-V33 PolarHBondContact O-N 3.45Å; Q30-Q34 PolarHBondContact O-N 3.27Å
31	R	85.1	Confident	86.8	Confident	178 Å²	178	77.1 Å²	77.1	67%	0.672	39%	0.394	S	S	*	.	H	α-helix	trans	-63	-42.8	175.1	-72.8	-174	-158.4	175.3	5.5	112.7	T27 S28 T29 V33 Q34 Q35	T27-R31 PolarHBondContact O-N 3.05Å; T27-R31 VanDerWaalsContact O-N 3.1Å; S28-R31 PolarHBondContact O-N 3.09Å; T29-R31 PolarHBondContact O-N 3.23Å; R31-V33 VanDerWaalsContact C-N 3.34Å; R31-Q34 PolarHBondContact O-N 3.45Å; R31-Q35 WeakPolarHBondContact O-CG 3.42Å; R31-Q35 PolarHBondContact O-N 3.03Å; R31-Q35 VanDerWaalsContact O-N 3.15Å
32	S	88.3	Confident	86.2	Confident	49 Å²	49	82.1 Å²	82.1	34%	0.343	42%	0.417	S	S	.	.	H	α-helix	trans	-62.6	-42.5	177.6	-179.6	0	0	0	0	111.5	S28 T29 Q35 R36	S28-S32 PolarHBondContact O-N 3.32Å; S28-S32 VanDerWaalsContact O-N 3.12Å; T29-S32 WeakPolarHBondContact O-CB 3.49Å; T29-S32 PolarHBondContact O-N 3.22Å; T29-S32 VanDerWaalsContact O-N 3.16Å; S32-Q35 PolarHBondContact O-N 3.38Å; S32-R36 WeakPolarHBondContact O-CG 3.12Å; S32-R36 PolarHBondContact O-N 2.84Å; S32-R36 VanDerWaalsContact O-N 3.09Å
33	V	88.9	Confident	85.9	Confident	4 Å²	4	87.8 Å²	87.8	2%	0.024	44%	0.435	C	S	.	.	H	α-helix	trans	-61.4	-45.6	174.8	167.4	0	0	0	0	111	L18 E21 T29 Q30 R31 Q35 R36 L37	L18-V33 HydrophobicContact CD1-CB 4.3Å; L18-V33 HydrophobicContact CD1-CG1 3.97Å; L18-V33 HydrophobicContact CD1-CG2 4.16Å; L18-V33 HydrophobicContact CG-CG1 4.44Å; E21-V33 HydrophobicContact CB-CG2 3.52Å; T29-V33 HydrophobicContact CG2-CG2 4.31Å; T29-V33 WeakPolarHBondContact O-CB 3.33Å; T29-V33 VanDerWaalsContact O-CG2 3.25Å; T29-V33 WeakPolarHBondContact O-CG2 3.49Å; T29-V33 PolarHBondContact O-N 3.4Å; Q30-V33 PolarHBondContact O-N 3.45Å; R31-V33 VanDerWaalsContact C-N 3.34Å; V33-Q35 VanDerWaalsContact C-N 3.34Å; V33-Q35 PolarHBondContact O-N 3.48Å; V33-R36 PolarHBondContact O-N 3.21Å; V33-R36 VanDerWaalsContact O-N 3.12Å; V33-L37 HydrophobicContact CG1-CD1 3.84Å; V33-L37 HydrophobicContact CG1-CG 4.23Å; V33-L37 WeakPolarHBondContact O-CG 3.49Å; V33-L37 PolarHBondContact O-N 3.19Å
34	Q	84.8	Confident	85.4	Confident	125 Å²	125	86.2 Å²	86.2	58%	0.584	43%	0.432	S	S	*	.	H	α-helix	trans	-58.2	-46	179.4	-166.8	117.2	6.1	0	0	111.7	Q30 R31 R36 L37 E38	Q30-Q34 PolarHBondContact O-N 3.27Å; R31-Q34 PolarHBondContact O-N 3.45Å; Q34-R36 VanDerWaalsContact C-N 3.32Å; Q34-R36 PolarHBondContact O-N 3.48Å; Q34-L37 PolarHBondContact O-N 2.93Å; Q34-E38 PolarHBondContact O-N 3.4Å
35	Q	86.8	Confident	85.3	Confident	123 Å²	123	88.1 Å²	88.1	58%	0.575	44%	0.44	S	S	*	.	H	α-helix	trans	-62	-38.2	176.1	-70.3	178.7	-6.6	0	0	112.5	R31 S32 V33 Q39	R31-Q35 WeakPolarHBondContact O-CG 3.42Å; R31-Q35 PolarHBondContact O-N 3.03Å; R31-Q35 VanDerWaalsContact O-N 3.15Å; S32-Q35 PolarHBondContact O-N 3.38Å; V33-Q35 VanDerWaalsContact C-N 3.34Å; V33-Q35 PolarHBondContact O-N 3.48Å; Q35-Q39 WeakPolarHBondContact O-CG 3.47Å; Q35-Q39 PolarHBondContact O-N 2.69Å
36	R	88.3	Confident	85.6	Confident	114 Å²	114	82.7 Å²	82.7	43%	0.43	40%	0.404	S	S	.	.	H	α-helix	trans	-68.7	-40.6	175.7	-75.9	179.9	178.8	172.2	-0.4	112.1	L18 E21 S32 V33 Q34 Q39 L40	L18-R36 HydrophobicContact CD1-CB 3.88Å; E21-R36 IonicContact OE2-NH1 2.85Å; E21-R36 PolarHBondContact OE2-NH1 2.8Å; S32-R36 WeakPolarHBondContact O-CG 3.12Å; S32-R36 PolarHBondContact O-N 2.84Å; S32-R36 VanDerWaalsContact O-N 3.09Å; V33-R36 PolarHBondContact O-N 3.21Å; V33-R36 VanDerWaalsContact O-N 3.12Å; Q34-R36 VanDerWaalsContact C-N 3.32Å; Q34-R36 PolarHBondContact O-N 3.48Å; R36-Q39 PolarHBondContact O-N 2.74Å; R36-L40 WeakPolarHBondContact O-CG 3.48Å; R36-L40 PolarHBondContact O-N 3.12Å
37	L	86.1	Confident	85.6	Confident	27 Å²	27	79.4 Å²	79.4	14%	0.141	39%	0.386	C	S	.	.	H	α-helix	trans	-61.7	-44.1	176	-74.4	171.6	0	0	0	111.1	L18 V33 Q34 Q39 L40 N41 F46 I71	L18-L37 HydrophobicContact CD2-CD2 3.54Å; L18-L37 HydrophobicContact CD2-CG 4.05Å; L18-L37 HydrophobicContact CG-CD2 4.28Å; V33-L37 HydrophobicContact CG1-CD1 3.84Å; V33-L37 HydrophobicContact CG1-CG 4.23Å; V33-L37 WeakPolarHBondContact O-CG 3.49Å; V33-L37 PolarHBondContact O-N 3.19Å; Q34-L37 PolarHBondContact O-N 2.93Å; L37-Q39 VanDerWaalsContact C-N 3.3Å; L37-Q39 PolarHBondContact O-N 3.03Å; L37-L40 PolarHBondContact O-N 3.2Å; L37-N41 WeakPolarHBondContact O-CB 3.31Å; L37-N41 PolarHBondContact O-N 3.2Å; L37-N41 PolarHBondContact O-OD1 2.88Å; L37-F46 HydrophobicContact CD2-CE1 4.3Å; L37-F46 HydrophobicContact CD2-CZ 3.81Å; L37-I71 HydrophobicContact CD1-CD1 4.2Å; L37-I71 HydrophobicContact CD2-CD1 4.2Å; L37-I71 HydrophobicContact CD2-CG2 4.23Å
38	E	84.1	Confident	85.9	Confident	119 Å²	119	75.9 Å²	75.9	56%	0.556	37%	0.365	S	S	*	.	H	α-helix	trans	-58.9	-39.3	175.2	-81.4	172.9	177	0	0	113	Q34	Q34-E38 PolarHBondContact O-N 3.4Å
39	Q	85.5	Confident	86.3	Confident	120 Å²	120	73.2 Å²	73.2	56%	0.561	34%	0.342	S	S	*	.	H	α-helix	trans	-67.9	-43.1	175.5	-70.2	172	17.9	0	0	111.9	Q35 R36 L37 N41 Q42	Q35-Q39 WeakPolarHBondContact O-CG 3.47Å; Q35-Q39 PolarHBondContact O-N 2.69Å; R36-Q39 PolarHBondContact O-N 2.74Å; L37-Q39 VanDerWaalsContact C-N 3.3Å; L37-Q39 PolarHBondContact O-N 3.03Å; Q39-N41 VanDerWaalsContact C-N 3.34Å; Q39-Q42 WeakPolarHBondContact O-CB 3.32Å; Q39-Q42 PolarHBondContact O-N 3.41Å
40	L	85.8	Confident	86.7	Confident	55 Å²	55	71.3 Å²	71.3	29%	0.288	33%	0.33	S	S	.	.	H	α-helix	trans	-70.4	-29.8	-179.2	-71.9	171.9	0	0	0	112.8	I15 L18 R36 L37 Q42 Y43 F46	I15-L40 HydrophobicContact CD1-CD1 4.12Å; L18-L40 HydrophobicContact CD2-CD1 3.5Å; L18-L40 VanDerWaalsContact CD2-CD1 3.5Å; R36-L40 WeakPolarHBondContact O-CG 3.48Å; R36-L40 PolarHBondContact O-N 3.12Å; L37-L40 PolarHBondContact O-N 3.2Å; L40-Q42 PolarHBondContact O-N 3.4Å; L40-Q42 VanDerWaalsContact O-N 3.1Å; L40-Y43 PolarHBondContact O-N 3.36Å; L40-F46 HydrophobicContact CB-CD1 3.81Å; L40-F46 HydrophobicContact CB-CD2 4.17Å; L40-F46 HydrophobicContact CB-CE1 3.95Å; L40-F46 HydrophobicContact CB-CE2 4.32Å; L40-F46 HydrophobicContact CB-CG 3.93Å; L40-F46 HydrophobicContact CB-CZ 4.2Å; L40-F46 HydrophobicContact CD1-CD2 4.44Å; L40-F46 HydrophobicContact CD1-CE2 4.15Å; L40-F46 HydrophobicContact CD1-CZ 4.39Å; L40-F46 WeakPolarHBondContact O-CB 3.49Å
41	N	80.3	Confident	87.2	Confident	36 Å²	36	67.3 Å²	67.3	19%	0.193	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.6	176.2	-76.9	-6.7	0	0	0	113.6	L37 Q39 Y43 F46 N75	L37-N41 WeakPolarHBondContact O-CB 3.31Å; L37-N41 PolarHBondContact O-N 3.2Å; L37-N41 PolarHBondContact O-OD1 2.88Å; Q39-N41 VanDerWaalsContact C-N 3.34Å; N41-Y43 PolarHBondContact O-N 3.15Å; N41-F46 VanDerWaalsContact OD1-CE1 3.27Å; N41-F46 WeakPolarHBondContact OD1-CE1 3.25Å; N41-N75 PolarHBondContact ND2-OD1 3.22Å; N41-N75 VanDerWaalsContact OD1-CG 3.29Å; N41-N75 PolarHBondContact OD1-ND2 3.11Å; N41-N75 PolarHBondContact OD1-OD1 2.86Å; N41-N75 VanDerWaalsContact OD1-OD1 3.09Å
42	Q	75.8	Confident	87.7	Confident	150 Å²	150	60.7 Å²	60.7	70%	0.701	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.7	175.1	-58.7	177.1	15.1	0	0	113	Q39 L40	Q39-Q42 WeakPolarHBondContact O-CB 3.32Å; Q39-Q42 PolarHBondContact O-N 3.41Å; L40-Q42 PolarHBondContact O-N 3.4Å; L40-Q42 VanDerWaalsContact O-N 3.1Å
43	Y	82.8	Confident	88.1	Confident	148 Å²	148	58.3 Å²	58.3	58%	0.58	27%	0.272	S	S	*	.			trans	-103.5	114.1	-178.1	-62.9	-86.9	0	0	0	110.3	L40 N41 D45 F46	L40-Y43 PolarHBondContact O-N 3.36Å; N41-Y43 PolarHBondContact O-N 3.15Å; Y43-D45 PolarHBondContact O-N 3.28Å; Y43-D45 VanDerWaalsContact O-N 3.1Å; Y43-F46 VanDerWaalsContact O-CB 3.23Å; Y43-F46 WeakPolarHBondContact O-CB 3.32Å; Y43-F46 PolarHBondContact O-N 2.8Å
44	P	77.7	Confident	88.5	Confident	52 Å²	52	58.1 Å²	58.1	34%	0.338	27%	0.27	S	S	.	.	H	α-helix	trans	-57.1	-32	-178.5	-28.3	35.5	0	0	0	114.4	F46 N47 P84 V87	P44-F46 PolarHBondContact O-N 3.47Å; P44-N47 WeakPolarHBondContact O-CB 3.16Å; P44-N47 PolarHBondContact O-N 2.88Å; P44-N47 PolarHBondContact O-ND2 3.42Å; P44-P84 VanDerWaalsContact CB-CD 3.5Å; P44-P84 HydrophobicContact CB-CG 3.72Å; P44-P84 HydrophobicContact CG-CG 3.95Å; P44-V87 HydrophobicContact CB-CG2 4.25Å
45	D	86.9	Confident	89	Confident	71 Å²	71	52.2 Å²	52.2	38%	0.38	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-25.1	179.9	-161.6	51.4	0	0	0	113	W5 Y43 N47 N48 Y49	W5-D45 PolarHBondContact NE1-OD1 3.17Å; Y43-D45 PolarHBondContact O-N 3.28Å; Y43-D45 VanDerWaalsContact O-N 3.1Å; D45-N47 PolarHBondContact O-N 3.44Å; D45-N48 WeakPolarHBondContact O-CB 3.44Å; D45-N48 PolarHBondContact O-N 3.13Å; D45-N48 PolarHBondContact OD1-ND2 3.3Å; D45-N48 VanDerWaalsContact OD1-ND2 3.15Å; D45-Y49 WeakPolarHBondContact O-CD2 3.26Å; D45-Y49 PolarHBondContact O-N 2.88Å; D45-Y49 WeakPolarHBondContact OD2-CE2 3.41Å
46	F	91.4	Very high	89.3	Confident	10 Å²	10	50.6 Å²	50.6	4%	0.044	23%	0.234	C	C	.	.	H	α-helix	trans	-57.5	-38	174.1	176.3	-129.2	0	0	0	111.6	I15 L37 L40 N41 Y43 P44 N48 Y49 L50	I15-F46 HydrophobicContact CD1-CD2 3.68Å; I15-F46 HydrophobicContact CD1-CE2 3.53Å; I15-F46 HydrophobicContact CG1-CD2 4.32Å; I15-F46 HydrophobicContact CG1-CE2 4.21Å; I15-F46 HydrophobicContact CG2-CE2 4.23Å; L37-F46 HydrophobicContact CD2-CE1 4.3Å; L37-F46 HydrophobicContact CD2-CZ 3.81Å; L40-F46 HydrophobicContact CB-CD1 3.81Å; L40-F46 HydrophobicContact CB-CD2 4.17Å; L40-F46 HydrophobicContact CB-CE1 3.95Å; L40-F46 HydrophobicContact CB-CE2 4.32Å; L40-F46 HydrophobicContact CB-CG 3.93Å; L40-F46 HydrophobicContact CB-CZ 4.2Å; L40-F46 HydrophobicContact CD1-CD2 4.44Å; L40-F46 HydrophobicContact CD1-CE2 4.15Å; L40-F46 HydrophobicContact CD1-CZ 4.39Å; L40-F46 WeakPolarHBondContact O-CB 3.49Å; N41-F46 VanDerWaalsContact OD1-CE1 3.27Å; N41-F46 WeakPolarHBondContact OD1-CE1 3.25Å; Y43-F46 VanDerWaalsContact O-CB 3.23Å; Y43-F46 WeakPolarHBondContact O-CB 3.32Å; Y43-F46 PolarHBondContact O-N 2.8Å; P44-F46 PolarHBondContact O-N 3.47Å; F46-N48 VanDerWaalsContact C-N 3.28Å; F46-N48 PolarHBondContact O-N 3.21Å; F46-Y49 WeakPolarHBondContact O-CB 3.46Å; F46-Y49 PolarHBondContact O-N 3.38Å; F46-Y49 VanDerWaalsContact O-N 3.14Å; F46-L50 HydrophobicContact CD1-CD1 4.13Å; F46-L50 HydrophobicContact CD2-CG 4.41Å; F46-L50 HydrophobicContact CE1-CD1 3.71Å; F46-L50 HydrophobicContact CE1-CD2 4.46Å; F46-L50 HydrophobicContact CE1-CG 4.24Å; F46-L50 HydrophobicContact CE2-CD1 4.37Å; F46-L50 HydrophobicContact CE2-CD2 3.88Å; F46-L50 HydrophobicContact CE2-CG 4Å; F46-L50 HydrophobicContact CZ-CD1 3.85Å; F46-L50 HydrophobicContact CZ-CD2 3.74Å; F46-L50 HydrophobicContact CZ-CG 3.92Å; F46-L50 PolarHBondContact O-N 3.33Å; F46-L50 VanDerWaalsContact O-N 3.08Å
47	N	93	Very high	89.5	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-66.8	-29.2	179.2	-59.5	-62.9	0	0	0	112.4	P44 D45 L50 I51 L72 N75 F83 V87 I91	P44-N47 WeakPolarHBondContact O-CB 3.16Å; P44-N47 PolarHBondContact O-N 2.88Å; P44-N47 PolarHBondContact O-ND2 3.42Å; D45-N47 PolarHBondContact O-N 3.44Å; N47-L50 PolarHBondContact O-N 3.4Å; N47-I51 PolarHBondContact O-N 2.92Å; N47-I51 VanDerWaalsContact O-N 3.14Å; N47-L72 HydrophobicContact CB-CD1 3.64Å; N47-N75 WeakPolarHBondContact OD1-CB 3.35Å; N47-N75 PolarHBondContact OD1-ND2 3.16Å; N47-F83 HydrophobicContact CB-CE2 4.06Å; N47-F83 HydrophobicContact CB-CZ 4.19Å; N47-F83 VanDerWaalsContact CG-CZ 3.47Å; N47-F83 WeakPolarHBondContact ND2-CZ 3.13Å; N47-V87 HydrophobicContact CB-CG1 4.08Å; N47-I91 HydrophobicContact CB-CD1 4.22Å
48	N	93.9	Very high	89.8	Confident	7 Å²	7	49.9 Å²	49.9	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-40	172.5	-68	-28	0	0	0	111.6	W5 D45 F46 L50 I51 F52 V87 F90	W5-N48 VanDerWaalsContact CD1-ND2 3.28Å; W5-N48 HydrophobicContact CD2-CB 3.71Å; W5-N48 HydrophobicContact CE3-CB 4.14Å; W5-N48 HydrophobicContact CG-CB 4.28Å; W5-N48 HydrophobicContact CH2-CB 3.86Å; W5-N48 HydrophobicContact CZ2-CB 3.4Å; W5-N48 HydrophobicContact CZ3-CB 4.21Å; W5-N48 PolarHBondContact NE1-ND2 3.04Å; D45-N48 WeakPolarHBondContact O-CB 3.44Å; D45-N48 PolarHBondContact O-N 3.13Å; D45-N48 PolarHBondContact OD1-ND2 3.3Å; D45-N48 VanDerWaalsContact OD1-ND2 3.15Å; F46-N48 VanDerWaalsContact C-N 3.28Å; F46-N48 PolarHBondContact O-N 3.21Å; N48-L50 VanDerWaalsContact C-N 3.34Å; N48-I51 VanDerWaalsContact O-CG2 3.24Å; N48-I51 WeakPolarHBondContact O-CG2 3.39Å; N48-F52 VanDerWaalsContact O-CB 3.23Å; N48-F52 WeakPolarHBondContact O-CB 3.13Å; N48-F52 PolarHBondContact O-N 3.4Å; N48-V87 WeakPolarHBondContact OD1-CG1 3.35Å; N48-F90 HydrophobicContact CB-CD1 4.18Å; N48-F90 HydrophobicContact CB-CE1 4.21Å; N48-F90 WeakPolarHBondContact OD1-CD1 3.33Å
49	Y	94.7	Very high	90.1	Very high	24 Å²	24	49.1 Å²	49.1	9%	0.094	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-42.4	173.2	-76	-85.8	0	0	0	111.5	W5 P7 D8 L12 I15 D45 F46 I51 F52 V53	W5-Y49 HydrophobicContact CH2-CD1 4.04Å; W5-Y49 HydrophobicContact CH2-CD2 4.19Å; W5-Y49 HydrophobicContact CH2-CE1 4.22Å; W5-Y49 HydrophobicContact CH2-CE2 4.35Å; W5-Y49 HydrophobicContact CH2-CG 4.02Å; W5-Y49 HydrophobicContact CZ2-CD1 4.38Å; W5-Y49 AromaticContact CZ2-CD2 3.81Å; W5-Y49 HydrophobicContact CZ2-CD2 3.81Å; W5-Y49 HydrophobicContact CZ2-CE1 4.32Å; W5-Y49 AromaticContact CZ2-CE2 3.74Å; W5-Y49 HydrophobicContact CZ2-CE2 3.74Å; W5-Y49 HydrophobicContact CZ2-CG 4.12Å; W5-Y49 AromaticContact CZ2-CZ 4Å; P7-Y49 HydrophobicContact CB-CD1 4.14Å; P7-Y49 HydrophobicContact CB-CE1 3.61Å; D8-Y49 PolarHBondContact N-OH 3.34Å; L12-Y49 HydrophobicContact CB-CD1 4.29Å; L12-Y49 HydrophobicContact CB-CE1 4.08Å; L12-Y49 HydrophobicContact CD1-CD1 4.19Å; I15-Y49 HydrophobicContact CG1-CD1 4.37Å; I15-Y49 HydrophobicContact CG1-CG 4.17Å; D45-Y49 WeakPolarHBondContact O-CD2 3.26Å; D45-Y49 PolarHBondContact O-N 2.88Å; D45-Y49 WeakPolarHBondContact OD2-CE2 3.41Å; F46-Y49 WeakPolarHBondContact O-CB 3.46Å; F46-Y49 PolarHBondContact O-N 3.38Å; F46-Y49 VanDerWaalsContact O-N 3.14Å; Y49-I51 PolarHBondContact O-N 2.8Å; Y49-F52 PolarHBondContact O-N 2.87Å; Y49-V53 WeakPolarHBondContact O-CG2 3.26Å; Y49-V53 PolarHBondContact O-N 3.49Å
50	L	95.3	Very high	90.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-44.2	-178.2	-67.5	176	0	0	0	112.5	I15 F46 N47 N48 L54 S68 I71 L72	I15-L50 HydrophobicContact CG2-CD2 4.47Å; F46-L50 HydrophobicContact CD1-CD1 4.13Å; F46-L50 HydrophobicContact CD2-CG 4.41Å; F46-L50 HydrophobicContact CE1-CD1 3.71Å; F46-L50 HydrophobicContact CE1-CD2 4.46Å; F46-L50 HydrophobicContact CE1-CG 4.24Å; F46-L50 HydrophobicContact CE2-CD1 4.37Å; F46-L50 HydrophobicContact CE2-CD2 3.88Å; F46-L50 HydrophobicContact CE2-CG 4Å; F46-L50 HydrophobicContact CZ-CD1 3.85Å; F46-L50 HydrophobicContact CZ-CD2 3.74Å; F46-L50 HydrophobicContact CZ-CG 3.92Å; F46-L50 PolarHBondContact O-N 3.33Å; F46-L50 VanDerWaalsContact O-N 3.08Å; N47-L50 PolarHBondContact O-N 3.4Å; N48-L50 VanDerWaalsContact C-N 3.34Å; L50-L54 PolarHBondContact O-N 2.91Å; L50-S68 WeakPolarHBondContact CA-OG 3.45Å; L50-S68 WeakPolarHBondContact CD2-OG 3.45Å; L50-S68 PolarHBondContact O-OG 2.61Å; L50-I71 HydrophobicContact CD1-CB 4.35Å; L50-I71 HydrophobicContact CD1-CG2 3.78Å; L50-I71 HydrophobicContact CD2-CG2 4.36Å; L50-L72 HydrophobicContact CB-CB 3.97Å; L50-L72 HydrophobicContact CB-CD2 4.47Å; L50-L72 HydrophobicContact CD1-CB 4.01Å; L50-L72 HydrophobicContact CD1-CD1 4.43Å
51	I	96.3	Very high	90.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.7	-35.7	176.7	-172.1	62	0	0	0	111.5	N47 N48 Y49 L54 T55 L72 F90 I91 E94 L113	N47-I51 PolarHBondContact O-N 2.92Å; N47-I51 VanDerWaalsContact O-N 3.14Å; N48-I51 VanDerWaalsContact O-CG2 3.24Å; N48-I51 WeakPolarHBondContact O-CG2 3.39Å; Y49-I51 PolarHBondContact O-N 2.8Å; I51-L54 HydrophobicContact CD1-CD2 4.02Å; I51-L54 PolarHBondContact O-N 3.14Å; I51-T55 HydrophobicContact CD1-CG2 3.69Å; I51-T55 HydrophobicContact CG1-CG2 4.22Å; I51-T55 WeakPolarHBondContact O-CB 3.43Å; I51-T55 PolarHBondContact O-N 3.42Å; I51-T55 PolarHBondContact O-OG1 2.86Å; I51-L72 HydrophobicContact CB-CD2 3.76Å; I51-L72 HydrophobicContact CD1-CD2 4.22Å; I51-L72 HydrophobicContact CG1-CD2 4.49Å; I51-F90 HydrophobicContact CG2-CD1 3.76Å; I51-F90 HydrophobicContact CG2-CE1 3.54Å; I51-I91 HydrophobicContact CB-CG1 4.14Å; I51-I91 HydrophobicContact CD1-CG2 4.41Å; I51-I91 HydrophobicContact CG1-CG1 4.5Å; I51-I91 HydrophobicContact CG1-CG2 4.39Å; I51-I91 HydrophobicContact CG2-CG1 3.86Å; I51-E94 HydrophobicContact CD1-CB 4.28Å; I51-E94 HydrophobicContact CG1-CB 3.68Å; I51-E94 HydrophobicContact CG1-CG 4.36Å; I51-L113 HydrophobicContact CD1-CD1 4.32Å
52	F	95.9	Very high	91.4	Very high	39 Å²	39	49 Å²	49	17%	0.171	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-44	177.2	-177.5	-89.1	0	0	0	112	W5 P7 L12 N48 Y49 T55 K56 L57	W5-F52 HydrophobicContact CH2-CB 4.23Å; W5-F52 HydrophobicContact CZ3-CB 3.78Å; W5-F52 AromaticContact CZ3-CD2 3.85Å; W5-F52 HydrophobicContact CZ3-CD2 3.85Å; W5-F52 AromaticContact CZ3-CG 3.94Å; W5-F52 HydrophobicContact CZ3-CG 3.94Å; P7-F52 HydrophobicContact CG-CD1 4.16Å; P7-F52 HydrophobicContact CG-CD2 4.31Å; P7-F52 HydrophobicContact CG-CE1 3.77Å; P7-F52 HydrophobicContact CG-CE2 3.92Å; P7-F52 HydrophobicContact CG-CG 4.43Å; P7-F52 HydrophobicContact CG-CZ 3.64Å; L12-F52 HydrophobicContact CD1-CD1 4.25Å; L12-F52 HydrophobicContact CD2-CE1 4.19Å; N48-F52 VanDerWaalsContact O-CB 3.23Å; N48-F52 WeakPolarHBondContact O-CB 3.13Å; N48-F52 PolarHBondContact O-N 3.4Å; Y49-F52 PolarHBondContact O-N 2.87Å; F52-T55 PolarHBondContact O-N 2.94Å; F52-K56 HydrophobicContact CD2-CB 3.8Å; F52-K56 HydrophobicContact CD2-CG 3.76Å; F52-K56 HydrophobicContact CE1-CB 4.35Å; F52-K56 HydrophobicContact CE2-CB 3.62Å; F52-K56 HydrophobicContact CE2-CG 3.81Å; F52-K56 HydrophobicContact CG-CB 4.24Å; F52-K56 HydrophobicContact CZ-CB 3.91Å; F52-K56 WeakPolarHBondContact O-CB 3.46Å; F52-K56 PolarHBondContact O-N 3.13Å; F52-L57 HydrophobicContact CE1-CB 4.5Å; F52-L57 HydrophobicContact CE1-CD1 3.94Å; F52-L57 PolarHBondContact O-N 3.43Å
53	V	95.9	Very high	92.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-45.2	175.8	171.2	0	0	0	0	110.5	L12 L16 L19 Y49 T55 L57 R65	L12-V53 HydrophobicContact CD1-CG2 3.76Å; L16-V53 HydrophobicContact CD2-CG1 4.18Å; L16-V53 HydrophobicContact CD2-CG2 4.16Å; L19-V53 HydrophobicContact CD1-CG1 3.92Å; Y49-V53 WeakPolarHBondContact O-CG2 3.26Å; Y49-V53 PolarHBondContact O-N 3.49Å; V53-T55 PolarHBondContact O-N 3.08Å; V53-L57 HydrophobicContact CG2-CD2 4.42Å; V53-R65 WeakPolarHBondContact O-CG 3.33Å
54	L	96.8	Very high	92.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.3	-49	178.2	175.8	65.9	0	0	0	112.3	L50 I51 R65 I106 T109 V110 L113	L50-L54 PolarHBondContact O-N 2.91Å; I51-L54 HydrophobicContact CD1-CD2 4.02Å; I51-L54 PolarHBondContact O-N 3.14Å; L54-R65 WeakPolarHBondContact CD1-O 3.48Å; L54-R65 PolarHBondContact O-NE 3.22Å; L54-R65 VanDerWaalsContact O-NE 3.08Å; L54-R65 PolarHBondContact O-NH2 3.06Å; L54-I106 HydrophobicContact CD1-CD1 4.04Å; L54-I106 HydrophobicContact CD1-CG2 4.13Å; L54-T109 HydrophobicContact CD1-CG2 3.92Å; L54-T109 HydrophobicContact CD2-CG2 4.17Å; L54-V110 HydrophobicContact CD2-CG2 3.94Å; L54-V110 HydrophobicContact CG-CG2 4.36Å; L54-L113 HydrophobicContact CD2-CD1 3.5Å; L54-L113 VanDerWaalsContact CD2-CD1 3.5Å
55	T	95.4	Very high	93.6	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-100.2	-42.6	-163.3	58	0	0	0	0	114.3	I51 F52 V53 K58 E94 N98	I51-T55 HydrophobicContact CD1-CG2 3.69Å; I51-T55 HydrophobicContact CG1-CG2 4.22Å; I51-T55 WeakPolarHBondContact O-CB 3.43Å; I51-T55 PolarHBondContact O-N 3.42Å; I51-T55 PolarHBondContact O-OG1 2.86Å; F52-T55 PolarHBondContact O-N 2.94Å; V53-T55 PolarHBondContact O-N 3.08Å; T55-K58 WeakPolarHBondContact O-CE 3.25Å; T55-K58 PolarHBondContact O-NZ 3.14Å; T55-E94 HydrophobicContact CG2-CB 4.23Å; T55-E94 PolarHBondContact OG1-OE2 2.96Å; T55-N98 WeakPolarHBondContact CB-ND2 3.46Å; T55-N98 HydrophobicContact CG2-CB 4.03Å; T55-N98 PolarHBondContact O-OD1 3.06Å
56	K	93.6	Very high	94	Very high	88 Å²	88	33.6 Å²	33.6	38%	0.383	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-32.2	-173.3	-62.5	-61.1	-158.9	-144.1	0	113.6	F52 K58 E94	F52-K56 HydrophobicContact CD2-CB 3.8Å; F52-K56 HydrophobicContact CD2-CG 3.76Å; F52-K56 HydrophobicContact CE1-CB 4.35Å; F52-K56 HydrophobicContact CE2-CB 3.62Å; F52-K56 HydrophobicContact CE2-CG 3.81Å; F52-K56 HydrophobicContact CG-CB 4.24Å; F52-K56 HydrophobicContact CZ-CB 3.91Å; F52-K56 WeakPolarHBondContact O-CB 3.46Å; F52-K56 PolarHBondContact O-N 3.13Å; K56-K58 VanDerWaalsContact C-N 3.26Å; K56-K58 PolarHBondContact O-N 3.11Å; K56-E94 WeakPolarHBondContact CE-OE1 3.33Å; K56-E94 WeakPolarHBondContact CE-OE2 3.27Å; K56-E94 IonicContact NZ-OE1 3.71Å; K56-E94 PolarHBondContact NZ-OE1 3.27Å; K56-E94 IonicContact NZ-OE2 3.71Å; K56-E94 PolarHBondContact NZ-OE2 2.99Å
57	L	93.1	Very high	94.1	Very high	24 Å²	24	35.4 Å²	35.4	13%	0.126	18%	0.184	C	C	.	.			trans	-82.7	63.6	-171.7	-157	85.2	0	0	0	112.7	L12 L16 F52 V53 S59 E60	L12-L57 HydrophobicContact CD2-CD1 3.97Å; L16-L57 HydrophobicContact CD1-CD2 3.91Å; L16-L57 HydrophobicContact CD2-CD2 3.75Å; L16-L57 HydrophobicContact CG-CD2 4.36Å; F52-L57 HydrophobicContact CE1-CB 4.5Å; F52-L57 HydrophobicContact CE1-CD1 3.94Å; F52-L57 PolarHBondContact O-N 3.43Å; V53-L57 HydrophobicContact CG2-CD2 4.42Å; L57-S59 PolarHBondContact O-N 2.89Å; L57-E60 HydrophobicContact CD2-CB 4.14Å; L57-E60 HydrophobicContact CD2-CG 3.32Å; L57-E60 HydrophobicContact CG-CG 4.21Å; L57-E60 PolarHBondContact O-N 3.13Å
58	K	90.8	Very high	94.2	Very high	103 Å²	103	35.3 Å²	35.3	45%	0.448	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-6.2	-177.6	-51.7	-58.2	-168.4	-168.2	0	114.4	T55 K56 N98 D101	T55-K58 WeakPolarHBondContact O-CE 3.25Å; T55-K58 PolarHBondContact O-NZ 3.14Å; K56-K58 VanDerWaalsContact C-N 3.26Å; K56-K58 PolarHBondContact O-N 3.11Å; K58-N98 PolarHBondContact NZ-OD1 3.24Å; K58-D101 IonicContact NZ-OD2 3.17Å; K58-D101 PolarHBondContact NZ-OD2 3.18Å
59	S	90.9	Very high	94.3	Very high	103 Å²	103	35 Å²	35	72%	0.72	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-22.3	175.3	55.2	0	0	0	0	113.9	L57	L57-S59 PolarHBondContact O-N 2.89Å
60	E	92.9	Very high	94.2	Very high	40 Å²	40	36.8 Å²	36.8	19%	0.187	19%	0.193	C	C	.	.	S	Bend	trans	-87.5	158.3	174.8	-69.1	-68.5	148.9	0	0	111.2	L16 K20 L57 R65	L16-E60 HydrophobicContact CD1-CG 4.48Å; L16-E60 HydrophobicContact CD2-CG 3.81Å; K20-E60 WeakPolarHBondContact CE-OE2 3.49Å; K20-E60 IonicContact NZ-OE1 3.7Å; K20-E60 PolarHBondContact NZ-OE1 2.91Å; K20-E60 IonicContact NZ-OE2 3.71Å; K20-E60 PolarHBondContact NZ-OE2 3.08Å; L57-E60 HydrophobicContact CD2-CB 4.14Å; L57-E60 HydrophobicContact CD2-CG 3.32Å; L57-E60 HydrophobicContact CG-CG 4.21Å; L57-E60 PolarHBondContact O-N 3.13Å; E60-R65 HydrophobicContact CB-CG 4.26Å; E60-R65 VanDerWaalsContact O-CD 3.3Å; E60-R65 WeakPolarHBondContact O-CD 3.44Å
61	D	92.9	Very high	94.1	Very high	79 Å²	79	37.6 Å²	37.6	42%	0.422	20%	0.197	S	C	.	.			trans	-68.7	158.7	-179.6	63.1	43.7	0	0	0	113.4	P63 T64 R65	D61-P63 WeakPolarHBondContact OD1-CD 3.27Å; D61-T64 PolarHBondContact O-N 3.31Å; D61-T64 WeakPolarHBondContact OD1-CB 3.37Å; D61-T64 PolarHBondContact OD1-N 3.2Å; D61-T64 PolarHBondContact OD1-OG1 2.97Å; D61-R65 VanDerWaalsContact O-CG 3.26Å; D61-R65 WeakPolarHBondContact O-CG 3.4Å; D61-R65 PolarHBondContact O-N 3.11Å; D61-R65 VanDerWaalsContact O-N 3.08Å
62	E	93.5	Very high	94	Very high	89 Å²	89	37.6 Å²	37.6	42%	0.416	20%	0.197	S	C	.	.	H	α-helix	trans	-61.7	-41.4	-176.8	-52.6	-176	176.2	0	0	113.6	T64 R65 S66 S103 L105	E62-T64 PolarHBondContact O-N 3.03Å; E62-R65 PolarHBondContact O-N 2.96Å; E62-S66 VanDerWaalsContact O-CB 3.25Å; E62-S66 WeakPolarHBondContact O-CB 3.37Å; E62-S66 PolarHBondContact O-N 3.35Å; E62-S103 WeakPolarHBondContact OE1-CB 3.45Å; E62-S103 PolarHBondContact OE1-OG 3Å; E62-S103 PolarHBondContact OE2-OG 3Å; E62-L105 HydrophobicContact CB-CD2 4.18Å
63	P	93.5	Very high	94	Very high	75 Å²	75	38.3 Å²	38.3	49%	0.487	20%	0.2	S	C	.	.	H	α-helix	trans	-59.6	-43.1	175.9	-25.9	36.3	0	0	0	113.4	D61 S66 L67	D61-P63 WeakPolarHBondContact OD1-CD 3.27Å; P63-S66 PolarHBondContact O-N 3.2Å; P63-L67 VanDerWaalsContact O-CB 3.24Å; P63-L67 WeakPolarHBondContact O-CB 3.35Å; P63-L67 PolarHBondContact O-N 3.11Å
64	T	93.3	Very high	93.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-44.6	178.7	-58.4	0	0	0	0	111.3	L19 Q23 D61 E62 L67 S68	L19-T64 HydrophobicContact CB-CG2 4Å; L19-T64 HydrophobicContact CD1-CG2 4.22Å; Q23-T64 PolarHBondContact NE2-OG1 3.45Å; D61-T64 PolarHBondContact O-N 3.31Å; D61-T64 WeakPolarHBondContact OD1-CB 3.37Å; D61-T64 PolarHBondContact OD1-N 3.2Å; D61-T64 PolarHBondContact OD1-OG1 2.97Å; E62-T64 PolarHBondContact O-N 3.03Å; T64-L67 PolarHBondContact O-N 3.49Å; T64-S68 PolarHBondContact O-N 3.22Å; T64-S68 VanDerWaalsContact O-N 3.08Å
65	R	96.3	Very high	93.5	Very high	14 Å²	14	42.6 Å²	42.6	5%	0.053	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-46.5	175.8	-68.9	173.1	58	-152.4	-6.8	111.3	V53 L54 E60 D61 E62 S68 G69 D101 I106	V53-R65 WeakPolarHBondContact O-CG 3.33Å; L54-R65 WeakPolarHBondContact CD1-O 3.48Å; L54-R65 PolarHBondContact O-NE 3.22Å; L54-R65 VanDerWaalsContact O-NE 3.08Å; L54-R65 PolarHBondContact O-NH2 3.06Å; E60-R65 HydrophobicContact CB-CG 4.26Å; E60-R65 VanDerWaalsContact O-CD 3.3Å; E60-R65 WeakPolarHBondContact O-CD 3.44Å; D61-R65 VanDerWaalsContact O-CG 3.26Å; D61-R65 WeakPolarHBondContact O-CG 3.4Å; D61-R65 PolarHBondContact O-N 3.11Å; D61-R65 VanDerWaalsContact O-N 3.08Å; E62-R65 PolarHBondContact O-N 2.96Å; R65-S68 WeakPolarHBondContact O-CB 3.42Å; R65-S68 PolarHBondContact O-N 3.04Å; R65-G69 PolarHBondContact O-N 3.31Å; R65-D101 IonicContact NH2-OD2 3.18Å; R65-D101 PolarHBondContact NH2-OD2 3.21Å; R65-I106 HydrophobicContact CB-CD1 3.6Å
66	S	94.7	Very high	93.3	Very high	8 Å²	8	42.6 Å²	42.6	6%	0.056	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-45.2	178.9	-175.9	0	0	0	0	112.4	E62 P63 S68 G69 L70 T109	E62-S66 VanDerWaalsContact O-CB 3.25Å; E62-S66 WeakPolarHBondContact O-CB 3.37Å; E62-S66 PolarHBondContact O-N 3.35Å; P63-S66 PolarHBondContact O-N 3.2Å; S66-S68 VanDerWaalsContact C-N 3.27Å; S66-S68 PolarHBondContact O-N 3.32Å; S66-G69 CarbonylContact O-C 3.56Å; S66-G69 WeakPolarHBondContact O-CA 3.29Å; S66-G69 PolarHBondContact O-N 3.26Å; S66-L70 WeakPolarHBondContact O-CG 3.22Å; S66-L70 PolarHBondContact O-N 3.32Å; S66-T109 PolarHBondContact OG-OG1 3.19Å
67	L	93.3	Very high	93.1	Very high	48 Å²	48	44.8 Å²	44.8	25%	0.251	23%	0.233	S	C	.	.	H	α-helix	trans	-58.6	-40.4	177.1	-179.2	57.9	0	0	0	112	L19 S22 Q23 P63 T64 G69 L70 I71	L19-L67 HydrophobicContact CD2-CG 4.39Å; S22-L67 WeakPolarHBondContact OG-CD2 3.49Å; Q23-L67 HydrophobicContact CG-CD2 3.7Å; P63-L67 VanDerWaalsContact O-CB 3.24Å; P63-L67 WeakPolarHBondContact O-CB 3.35Å; P63-L67 PolarHBondContact O-N 3.11Å; T64-L67 PolarHBondContact O-N 3.49Å; L67-G69 VanDerWaalsContact C-N 3.31Å; L67-G69 PolarHBondContact O-N 2.95Å; L67-L70 PolarHBondContact O-N 3.45Å; L67-I71 HydrophobicContact CD1-CD1 4.42Å; L67-I71 HydrophobicContact CD1-CG1 4.45Å; L67-I71 HydrophobicContact CG-CD1 4.22Å; L67-I71 WeakPolarHBondContact O-CG1 3.37Å; L67-I71 PolarHBondContact O-N 2.88Å
68	S	95.7	Very high	92.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-56.5	-45.1	172.7	-170.5	0	0	0	0	112	L50 T64 R65 S66 L72	L50-S68 WeakPolarHBondContact CA-OG 3.45Å; L50-S68 WeakPolarHBondContact CD2-OG 3.45Å; L50-S68 PolarHBondContact O-OG 2.61Å; T64-S68 PolarHBondContact O-N 3.22Å; T64-S68 VanDerWaalsContact O-N 3.08Å; R65-S68 WeakPolarHBondContact O-CB 3.42Å; R65-S68 PolarHBondContact O-N 3.04Å; S66-S68 VanDerWaalsContact C-N 3.27Å; S66-S68 PolarHBondContact O-N 3.32Å; S68-L72 PolarHBondContact O-N 2.97Å; S68-L72 VanDerWaalsContact O-N 3.08Å
69	G	95.9	Very high	92.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-37.7	175.3	0	0	0	0	0	113.9	R65 S66 L67 L72 K73	R65-G69 PolarHBondContact O-N 3.31Å; S66-G69 CarbonylContact O-C 3.56Å; S66-G69 WeakPolarHBondContact O-CA 3.29Å; S66-G69 PolarHBondContact O-N 3.26Å; L67-G69 VanDerWaalsContact C-N 3.31Å; L67-G69 PolarHBondContact O-N 2.95Å; G69-L72 WeakPolarHBondContact O-CB 3.28Å; G69-L72 PolarHBondContact O-N 3.39Å; G69-K73 PolarHBondContact O-N 2.62Å
70	L	93	Very high	92.6	Very high	61 Å²	61	42.4 Å²	42.4	32%	0.319	22%	0.221	S	C	.	.	H	α-helix	trans	-70.3	-35.6	178.1	-67.2	175.4	0	0	0	112.8	S66 L67 K73 N74 T109	S66-L70 WeakPolarHBondContact O-CG 3.22Å; S66-L70 PolarHBondContact O-N 3.32Å; L67-L70 PolarHBondContact O-N 3.45Å; L70-K73 WeakPolarHBondContact O-CB 3.18Å; L70-K73 PolarHBondContact O-N 3Å; L70-N74 PolarHBondContact O-N 2.88Å; L70-N74 VanDerWaalsContact O-N 3.13Å; L70-T109 HydrophobicContact CD2-CG2 4.48Å; L70-T109 HydrophobicContact CG-CG2 4.4Å
71	I	92.8	Very high	92.2	Very high	18 Å²	18	49.3 Å²	49.3	9%	0.092	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-46.6	170.5	-67.1	166.7	0	0	0	109.4	L19 L37 L50 L67 K73 N74 N75	L19-I71 HydrophobicContact CD2-CD1 3.62Å; L37-I71 HydrophobicContact CD1-CD1 4.2Å; L37-I71 HydrophobicContact CD2-CD1 4.2Å; L37-I71 HydrophobicContact CD2-CG2 4.23Å; L50-I71 HydrophobicContact CD1-CB 4.35Å; L50-I71 HydrophobicContact CD1-CG2 3.78Å; L50-I71 HydrophobicContact CD2-CG2 4.36Å; L67-I71 HydrophobicContact CD1-CD1 4.42Å; L67-I71 HydrophobicContact CD1-CG1 4.45Å; L67-I71 HydrophobicContact CG-CD1 4.22Å; L67-I71 WeakPolarHBondContact O-CG1 3.37Å; L67-I71 PolarHBondContact O-N 2.88Å; I71-K73 VanDerWaalsContact C-N 3.28Å; I71-K73 PolarHBondContact O-N 3.47Å; I71-N74 WeakPolarHBondContact O-CB 3.3Å; I71-N74 PolarHBondContact O-N 3.48Å; I71-N74 VanDerWaalsContact O-N 3.11Å; I71-N75 PolarHBondContact O-N 3.22Å; I71-N75 PolarHBondContact O-OD1 3.35Å
72	L	95	Very high	91.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.5	-40.9	175.9	179.2	59.4	0	0	0	111.8	N47 L50 I51 S68 G69 N74 N75 V76 F83 I91 L113	N47-L72 HydrophobicContact CB-CD1 3.64Å; L50-L72 HydrophobicContact CB-CB 3.97Å; L50-L72 HydrophobicContact CB-CD2 4.47Å; L50-L72 HydrophobicContact CD1-CB 4.01Å; L50-L72 HydrophobicContact CD1-CD1 4.43Å; I51-L72 HydrophobicContact CB-CD2 3.76Å; I51-L72 HydrophobicContact CD1-CD2 4.22Å; I51-L72 HydrophobicContact CG1-CD2 4.49Å; S68-L72 PolarHBondContact O-N 2.97Å; S68-L72 VanDerWaalsContact O-N 3.08Å; G69-L72 WeakPolarHBondContact O-CB 3.28Å; G69-L72 PolarHBondContact O-N 3.39Å; L72-N74 VanDerWaalsContact C-N 3.31Å; L72-N74 PolarHBondContact O-N 3.48Å; L72-N75 WeakPolarHBondContact O-CB 3.31Å; L72-N75 PolarHBondContact O-N 3.33Å; L72-N75 VanDerWaalsContact O-N 3.12Å; L72-V76 HydrophobicContact CD1-CG2 4.42Å; L72-V76 WeakPolarHBondContact O-CG2 3.34Å; L72-V76 PolarHBondContact O-N 2.94Å; L72-F83 HydrophobicContact CD1-CE2 4.46Å; L72-I91 HydrophobicContact CD1-CD1 4.06Å; L72-I91 HydrophobicContact CD2-CD1 4.39Å; L72-I91 HydrophobicContact CD2-CG1 4.38Å; L72-I91 HydrophobicContact CD2-CG2 4.12Å; L72-L113 HydrophobicContact CB-CD2 4.14Å; L72-L113 HydrophobicContact CD2-CD1 4.1Å; L72-L113 HydrophobicContact CD2-CD2 4.06Å; L72-L113 HydrophobicContact CG-CD2 3.82Å
73	K	94.4	Very high	91.6	Very high	54 Å²	54	48.1 Å²	48.1	24%	0.235	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-44.4	175.7	-175.6	-138.2	73.9	178.2	0	111.5	G69 L70 I71 N75 V76 K77 I112 L113 T116	G69-K73 PolarHBondContact O-N 2.62Å; L70-K73 WeakPolarHBondContact O-CB 3.18Å; L70-K73 PolarHBondContact O-N 3Å; I71-K73 VanDerWaalsContact C-N 3.28Å; I71-K73 PolarHBondContact O-N 3.47Å; K73-N75 VanDerWaalsContact C-N 3.32Å; K73-N75 PolarHBondContact O-N 2.84Å; K73-V76 PolarHBondContact O-N 3.39Å; K73-K77 PolarHBondContact O-N 3.19Å; K73-I112 HydrophobicContact CD-CG2 3.45Å; K73-I112 VanDerWaalsContact CD-CG2 3.45Å; K73-I112 HydrophobicContact CG-CG2 3.77Å; K73-L113 HydrophobicContact CB-CD2 3.88Å; K73-T116 HydrophobicContact CG-CG2 4.01Å; K73-T116 WeakPolarHBondContact CG-OG1 3.45Å
74	N	91.1	Very high	91.4	Very high	84 Å²	84	47.4 Å²	47.4	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-64.8	-38.4	177.1	-67.4	-21.8	0	0	0	111.6	L70 I71 L72 K77 A78	L70-N74 PolarHBondContact O-N 2.88Å; L70-N74 VanDerWaalsContact O-N 3.13Å; I71-N74 WeakPolarHBondContact O-CB 3.3Å; I71-N74 PolarHBondContact O-N 3.48Å; I71-N74 VanDerWaalsContact O-N 3.11Å; L72-N74 VanDerWaalsContact C-N 3.31Å; L72-N74 PolarHBondContact O-N 3.48Å; N74-K77 PolarHBondContact O-N 3.25Å; N74-A78 PolarHBondContact O-N 3.35Å
75	N	91.8	Very high	91.1	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.032	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-42.1	176.3	-67.3	0.2	0	0	0	112.3	N41 N47 I71 L72 K73 K77 A78 H79 F83	N41-N75 PolarHBondContact ND2-OD1 3.22Å; N41-N75 VanDerWaalsContact OD1-CG 3.29Å; N41-N75 PolarHBondContact OD1-ND2 3.11Å; N41-N75 PolarHBondContact OD1-OD1 2.86Å; N41-N75 VanDerWaalsContact OD1-OD1 3.09Å; N47-N75 WeakPolarHBondContact OD1-CB 3.35Å; N47-N75 PolarHBondContact OD1-ND2 3.16Å; I71-N75 PolarHBondContact O-N 3.22Å; I71-N75 PolarHBondContact O-OD1 3.35Å; L72-N75 WeakPolarHBondContact O-CB 3.31Å; L72-N75 PolarHBondContact O-N 3.33Å; L72-N75 VanDerWaalsContact O-N 3.12Å; K73-N75 VanDerWaalsContact C-N 3.32Å; K73-N75 PolarHBondContact O-N 2.84Å; N75-K77 VanDerWaalsContact C-N 3.32Å; N75-A78 PolarHBondContact O-N 3.47Å; N75-H79 WeakPolarHBondContact O-CA 3.42Å; N75-H79 WeakPolarHBondContact O-CB 3.49Å; N75-H79 PolarHBondContact O-N 3.34Å; N75-F83 HydrophobicContact CB-CZ 4.19Å
76	V	91.9	Very high	90.7	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	30%	0.301	C	S	.	.	H	α-helix	trans	-58.2	-47.9	170.9	171.7	0	0	0	0	109.2	L72 K73 A78 Y80 F83 T116 I117	L72-V76 HydrophobicContact CD1-CG2 4.42Å; L72-V76 WeakPolarHBondContact O-CG2 3.34Å; L72-V76 PolarHBondContact O-N 2.94Å; K73-V76 PolarHBondContact O-N 3.39Å; V76-A78 VanDerWaalsContact C-N 3.28Å; V76-A78 PolarHBondContact O-N 3.39Å; V76-Y80 HydrophobicContact CB-CD2 4.4Å; V76-Y80 HydrophobicContact CG1-CD2 3.72Å; V76-Y80 HydrophobicContact CG1-CE2 4.4Å; V76-Y80 HydrophobicContact CG1-CG 4.19Å; V76-Y80 HydrophobicContact CG2-CD2 4.3Å; V76-Y80 WeakPolarHBondContact O-CB 3.47Å; V76-Y80 PolarHBondContact O-N 3.01Å; V76-F83 HydrophobicContact CG2-CE2 4.18Å; V76-F83 HydrophobicContact CG2-CZ 4.48Å; V76-T116 HydrophobicContact CB-CG2 4.28Å; V76-T116 HydrophobicContact CG1-CG2 3.83Å; V76-I117 HydrophobicContact CG1-CG1 3.81Å; V76-I117 HydrophobicContact CG2-CG1 4.13Å
77	K	89.3	Confident	90.6	Very high	134 Å²	134	55.5 Å²	55.5	58%	0.583	30%	0.302	S	S	*	.	H	α-helix	trans	-58.6	-37.7	-178.9	-166.7	177	178.7	179.4	0	113.5	K73 N74 N75 T116	K73-K77 PolarHBondContact O-N 3.19Å; N74-K77 PolarHBondContact O-N 3.25Å; N75-K77 VanDerWaalsContact C-N 3.32Å; K77-T116 HydrophobicContact CB-CG2 4.49Å
78	A	86.8	Confident	90.5	Very high	68 Å²	68	53.7 Å²	53.7	56%	0.562	29%	0.293	S	S	*	.	H	α-helix	trans	-93.3	-31.4	-174.6	0	0	0	0	0	114.6	N74 N75 V76	N74-A78 PolarHBondContact O-N 3.35Å; N75-A78 PolarHBondContact O-N 3.47Å; V76-A78 VanDerWaalsContact C-N 3.28Å; V76-A78 PolarHBondContact O-N 3.39Å
79	H	87.8	Confident	90.3	Very high	76 Å²	76	57.9 Å²	57.9	35%	0.352	32%	0.315	S	S	.	.	H	α-helix	trans	-136.1	10.3	-162.7	-54.9	-45.2	0	0	0	114.6	N75 Q81 N82 F83	N75-H79 WeakPolarHBondContact O-CA 3.42Å; N75-H79 WeakPolarHBondContact O-CB 3.49Å; N75-H79 PolarHBondContact O-N 3.34Å; H79-Q81 PolarHBondContact O-N 3.43Å; H79-Q81 VanDerWaalsContact O-N 3.13Å; H79-N82 WeakPolarHBondContact O-CB 3.35Å; H79-N82 PolarHBondContact O-N 3.15Å; H79-F83 HydrophobicContact CB-CE1 4.11Å; H79-F83 VanDerWaalsContact O-CD1 3.24Å; H79-F83 WeakPolarHBondContact O-CD1 3.44Å
80	Y	88.2	Confident	90.2	Very high	35 Å²	35	59.6 Å²	59.6	14%	0.137	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-54.7	-36.1	-174.1	-171.6	-105.1	0	0	0	114.2	V76 N82 F83 K92 I117 G121	V76-Y80 HydrophobicContact CB-CD2 4.4Å; V76-Y80 HydrophobicContact CG1-CD2 3.72Å; V76-Y80 HydrophobicContact CG1-CE2 4.4Å; V76-Y80 HydrophobicContact CG1-CG 4.19Å; V76-Y80 HydrophobicContact CG2-CD2 4.3Å; V76-Y80 WeakPolarHBondContact O-CB 3.47Å; V76-Y80 PolarHBondContact O-N 3.01Å; Y80-N82 PolarHBondContact O-N 3.04Å; Y80-N82 VanDerWaalsContact O-N 3.16Å; Y80-F83 HydrophobicContact CD2-CD2 4.27Å; Y80-F83 WeakPolarHBondContact O-CB 3.31Å; Y80-F83 PolarHBondContact O-N 2.83Å; Y80-K92 WeakPolarHBondContact OH-CE 3.37Å; Y80-I117 HydrophobicContact CE2-CG1 4.3Å; Y80-I117 HydrophobicContact CE2-CG2 3.94Å; Y80-I117 WeakPolarHBondContact OH-CG2 3.48Å; Y80-G121 VanDerWaalsContact CD1-CA 3.5Å
81	Q	85.1	Confident	90.3	Very high	186 Å²	186	56.8 Å²	56.8	87%	0.869	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-61.4	-23.7	177.3	-65.1	179.2	0.8	0	0	113.5	H79	H79-Q81 PolarHBondContact O-N 3.43Å; H79-Q81 VanDerWaalsContact O-N 3.13Å
82	N	86.4	Confident	90.4	Very high	122 Å²	122	56.6 Å²	56.6	65%	0.652	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-90.6	-2.6	178.9	-61.3	-25.4	0	0	0	112.6	H79 Y80	H79-N82 WeakPolarHBondContact O-CB 3.35Å; H79-N82 PolarHBondContact O-N 3.15Å; Y80-N82 PolarHBondContact O-N 3.04Å; Y80-N82 VanDerWaalsContact O-N 3.16Å
83	F	88.1	Confident	90.4	Very high	20 Å²	20	59.1 Å²	59.1	9%	0.088	32%	0.324	C	S	.	.	S	Bend	trans	-74.3	129.7	-177.4	-79.5	29.7	0	0	0	110	N47 L72 N75 V76 H79 Y80 V87 I91	N47-F83 HydrophobicContact CB-CE2 4.06Å; N47-F83 HydrophobicContact CB-CZ 4.19Å; N47-F83 VanDerWaalsContact CG-CZ 3.47Å; N47-F83 WeakPolarHBondContact ND2-CZ 3.13Å; L72-F83 HydrophobicContact CD1-CE2 4.46Å; N75-F83 HydrophobicContact CB-CZ 4.19Å; V76-F83 HydrophobicContact CG2-CE2 4.18Å; V76-F83 HydrophobicContact CG2-CZ 4.48Å; H79-F83 HydrophobicContact CB-CE1 4.11Å; H79-F83 VanDerWaalsContact O-CD1 3.24Å; H79-F83 WeakPolarHBondContact O-CD1 3.44Å; Y80-F83 HydrophobicContact CD2-CD2 4.27Å; Y80-F83 WeakPolarHBondContact O-CB 3.31Å; Y80-F83 PolarHBondContact O-N 2.83Å; F83-V87 HydrophobicContact CD2-CG1 4.14Å; F83-I91 HydrophobicContact CD2-CD1 4.21Å; F83-I91 HydrophobicContact CE2-CD1 3.94Å
84	P	89.6	Confident	90.4	Very high	60 Å²	60	57 Å²	57	39%	0.39	32%	0.315	S	S	.	.			trans	-63.2	142.5	169.3	-18.5	31	0	0	0	110.7	P44 G86 V87 S88	P44-P84 VanDerWaalsContact CB-CD 3.5Å; P44-P84 HydrophobicContact CB-CG 3.72Å; P44-P84 HydrophobicContact CG-CG 3.95Å; P84-G86 PolarHBondContact O-N 3.34Å; P84-G86 VanDerWaalsContact O-N 3.11Å; P84-V87 HydrophobicContact CB-CG2 4.39Å; P84-V87 HydrophobicContact CG-CG2 4.29Å; P84-V87 WeakPolarHBondContact O-CB 3.05Å; P84-V87 PolarHBondContact O-N 2.75Å; P84-S88 PolarHBondContact O-N 3.08Å; P84-S88 VanDerWaalsContact O-N 3.16Å
85	N	86.3	Confident	90.7	Very high	125 Å²	125	53 Å²	53	67%	0.668	29%	0.294	S	S	*	.	H	α-helix	trans	-52.3	-39	-179	-64.5	-1.7	0	0	0	113.2	V87 S88 D89	N85-V87 VanDerWaalsContact C-N 3.28Å; N85-V87 PolarHBondContact O-N 2.89Å; N85-S88 WeakPolarHBondContact CA-OG 3.42Å; N85-S88 PolarHBondContact O-N 3.21Å; N85-S88 PolarHBondContact O-OG 3.02Å; N85-D89 VanDerWaalsContact O-CB 3.31Å; N85-D89 WeakPolarHBondContact O-CB 3.48Å; N85-D89 PolarHBondContact O-N 2.87Å
86	G	88.8	Confident	90.8	Very high	56 Å²	56	53.7 Å²	53.7	58%	0.577	30%	0.297	S	S	*	.	H	α-helix	trans	-63.1	-30.6	177.9	0	0	0	0	0	114.4	P84 F90	P84-G86 PolarHBondContact O-N 3.34Å; P84-G86 VanDerWaalsContact O-N 3.11Å; G86-F90 WeakPolarHBondContact O-CB 3.28Å; G86-F90 PolarHBondContact O-N 2.95Å
87	V	90.7	Very high	90.9	Very high	12 Å²	12	59.3 Å²	59.3	7%	0.073	32%	0.323	C	S	.	.	H	α-helix	trans	-76.8	-46.2	176	174	0	0	0	0	110	P44 N47 N48 F83 P84 N85 F90 I91	P44-V87 HydrophobicContact CB-CG2 4.25Å; N47-V87 HydrophobicContact CB-CG1 4.08Å; N48-V87 WeakPolarHBondContact OD1-CG1 3.35Å; F83-V87 HydrophobicContact CD2-CG1 4.14Å; P84-V87 HydrophobicContact CB-CG2 4.39Å; P84-V87 HydrophobicContact CG-CG2 4.29Å; P84-V87 WeakPolarHBondContact O-CB 3.05Å; P84-V87 PolarHBondContact O-N 2.75Å; N85-V87 VanDerWaalsContact C-N 3.28Å; N85-V87 PolarHBondContact O-N 2.89Å; V87-F90 PolarHBondContact O-N 3.27Å; V87-I91 HydrophobicContact CG1-CD1 3.77Å; V87-I91 WeakPolarHBondContact O-CD1 3.5Å; V87-I91 VanDerWaalsContact O-CG1 3.26Å; V87-I91 WeakPolarHBondContact O-CG1 3.29Å; V87-I91 PolarHBondContact O-N 3.27Å
88	S	91.3	Very high	91.2	Very high	9 Å²	9	54 Å²	54	6%	0.063	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-43.3	179.1	56	0	0	0	0	111.6	P84 N85 F90 I91 K92	P84-S88 PolarHBondContact O-N 3.08Å; P84-S88 VanDerWaalsContact O-N 3.16Å; N85-S88 WeakPolarHBondContact CA-OG 3.42Å; N85-S88 PolarHBondContact O-N 3.21Å; N85-S88 PolarHBondContact O-OG 3.02Å; S88-F90 VanDerWaalsContact C-N 3.35Å; S88-F90 PolarHBondContact O-N 3.02Å; S88-I91 PolarHBondContact O-N 2.77Å; S88-K92 WeakPolarHBondContact O-CB 3.45Å; S88-K92 WeakPolarHBondContact O-CG 3.48Å; S88-K92 PolarHBondContact O-N 2.82Å
89	D	92	Very high	91.6	Very high	88 Å²	88	50.9 Å²	50.9	47%	0.471	28%	0.275	S	S	.	.	H	α-helix	trans	-63.8	-38.5	177.6	-65.7	-21.6	0	0	0	112.2	N85 S93	N85-D89 VanDerWaalsContact O-CB 3.31Å; N85-D89 WeakPolarHBondContact O-CB 3.48Å; N85-D89 PolarHBondContact O-N 2.87Å; D89-S93 VanDerWaalsContact O-CB 3.3Å; D89-S93 WeakPolarHBondContact O-CB 3.5Å; D89-S93 PolarHBondContact O-N 3.15Å
90	F	93.9	Very high	91.9	Very high	36 Å²	36	48 Å²	48	16%	0.158	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-47.2	174.2	179.9	-119.3	0	0	0	111.6	W5 N48 I51 G86 V87 S88 S93 E94	W5-F90 HydrophobicContact CD2-CE1 4.34Å; W5-F90 AromaticContact CE3-CE1 3.72Å; W5-F90 HydrophobicContact CE3-CE1 3.72Å; W5-F90 AromaticContact CE3-CZ 3.81Å; W5-F90 HydrophobicContact CE3-CZ 3.81Å; W5-F90 HydrophobicContact CZ3-CE1 4.18Å; W5-F90 HydrophobicContact CZ3-CZ 4.36Å; N48-F90 HydrophobicContact CB-CD1 4.18Å; N48-F90 HydrophobicContact CB-CE1 4.21Å; N48-F90 WeakPolarHBondContact OD1-CD1 3.33Å; I51-F90 HydrophobicContact CG2-CD1 3.76Å; I51-F90 HydrophobicContact CG2-CE1 3.54Å; G86-F90 WeakPolarHBondContact O-CB 3.28Å; G86-F90 PolarHBondContact O-N 2.95Å; V87-F90 PolarHBondContact O-N 3.27Å; S88-F90 VanDerWaalsContact C-N 3.35Å; S88-F90 PolarHBondContact O-N 3.02Å; F90-S93 PolarHBondContact O-N 3.26Å; F90-E94 HydrophobicContact CD2-CG 4.15Å; F90-E94 HydrophobicContact CE1-CG 4.45Å; F90-E94 HydrophobicContact CE2-CG 3.7Å; F90-E94 HydrophobicContact CZ-CG 3.87Å; F90-E94 WeakPolarHBondContact O-CG 3.46Å; F90-E94 PolarHBondContact O-N 2.94Å
91	I	94.7	Very high	92.3	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-48.1	177.7	-64.9	161.8	0	0	0	110.7	N47 I51 L72 F83 V87 S88 S93 E94 C95 I117	N47-I91 HydrophobicContact CB-CD1 4.22Å; I51-I91 HydrophobicContact CB-CG1 4.14Å; I51-I91 HydrophobicContact CD1-CG2 4.41Å; I51-I91 HydrophobicContact CG1-CG1 4.5Å; I51-I91 HydrophobicContact CG1-CG2 4.39Å; I51-I91 HydrophobicContact CG2-CG1 3.86Å; L72-I91 HydrophobicContact CD1-CD1 4.06Å; L72-I91 HydrophobicContact CD2-CD1 4.39Å; L72-I91 HydrophobicContact CD2-CG1 4.38Å; L72-I91 HydrophobicContact CD2-CG2 4.12Å; F83-I91 HydrophobicContact CD2-CD1 4.21Å; F83-I91 HydrophobicContact CE2-CD1 3.94Å; V87-I91 HydrophobicContact CG1-CD1 3.77Å; V87-I91 WeakPolarHBondContact O-CD1 3.5Å; V87-I91 VanDerWaalsContact O-CG1 3.26Å; V87-I91 WeakPolarHBondContact O-CG1 3.29Å; V87-I91 PolarHBondContact O-N 3.27Å; S88-I91 PolarHBondContact O-N 2.77Å; I91-S93 VanDerWaalsContact C-N 3.33Å; I91-S93 PolarHBondContact O-N 3.3Å; I91-E94 PolarHBondContact O-N 3.19Å; I91-C95 WeakPolarHBondContact O-CB 3.48Å; I91-C95 PolarHBondContact O-N 2.97Å; I91-C95 PolarHBondContact O-SG 2.98Å; I91-C95 VanDerWaalsContact O-SG 3.34Å; I91-I117 HydrophobicContact CG2-CD1 3.68Å
92	K	95.1	Very high	92.6	Very high	15 Å²	15	43 Å²	43	7%	0.065	26%	0.256	C	S	.	.	H	α-helix	trans	-54.7	-48.4	177.4	-76	175.4	173.4	-176.3	0	111.5	Y80 S88 L96 I117 N125 W126	Y80-K92 WeakPolarHBondContact OH-CE 3.37Å; S88-K92 WeakPolarHBondContact O-CB 3.45Å; S88-K92 WeakPolarHBondContact O-CG 3.48Å; S88-K92 PolarHBondContact O-N 2.82Å; K92-L96 WeakPolarHBondContact O-CG 3.36Å; K92-L96 PolarHBondContact O-N 3.11Å; K92-L96 VanDerWaalsContact O-N 3.17Å; K92-I117 HydrophobicContact CG-CG2 4.45Å; K92-N125 PolarHBondContact NZ-O 3.08Å; K92-W126 HydrophobicContact CB-CH2 3.8Å; K92-W126 HydrophobicContact CB-CZ2 3.33Å; K92-W126 HydrophobicContact CD-CD2 3.78Å; K92-W126 HydrophobicContact CD-CE3 4.26Å; K92-W126 HydrophobicContact CD-CG 4.06Å; K92-W126 HydrophobicContact CD-CZ2 4.15Å; K92-W126 HydrophobicContact CG-CD2 3.84Å; K92-W126 HydrophobicContact CG-CE3 3.96Å; K92-W126 HydrophobicContact CG-CH2 3.63Å; K92-W126 HydrophobicContact CG-CZ2 3.47Å; K92-W126 VanDerWaalsContact CG-CZ2 3.47Å; K92-W126 HydrophobicContact CG-CZ3 3.87Å
93	S	94.8	Very high	93	Very high	52 Å²	52	37.4 Å²	37.4	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-63.6	-47.7	179.8	-174.5	0	0	0	0	112.3	D89 F90 I91 C95 L96 Q97	D89-S93 VanDerWaalsContact O-CB 3.3Å; D89-S93 WeakPolarHBondContact O-CB 3.5Å; D89-S93 PolarHBondContact O-N 3.15Å; F90-S93 PolarHBondContact O-N 3.26Å; I91-S93 VanDerWaalsContact C-N 3.33Å; I91-S93 PolarHBondContact O-N 3.3Å; S93-C95 PolarHBondContact O-N 3.05Å; S93-L96 PolarHBondContact O-N 3Å; S93-Q97 VanDerWaalsContact O-CG 3.29Å; S93-Q97 WeakPolarHBondContact O-CG 3.31Å; S93-Q97 PolarHBondContact O-N 3.1Å; S93-Q97 PolarHBondContact OG-NE2 3.26Å; S93-Q97 VanDerWaalsContact OG-NE2 3.1Å
94	E	95.5	Very high	93	Very high	11 Å²	11	40.6 Å²	40.6	5%	0.051	25%	0.249	C	C	.	.	H	α-helix	trans	-65.4	-38	-179.9	-74.4	-58	145.7	0	0	112.7	I51 T55 K56 F90 I91 Q97 N98	I51-E94 HydrophobicContact CD1-CB 4.28Å; I51-E94 HydrophobicContact CG1-CB 3.68Å; I51-E94 HydrophobicContact CG1-CG 4.36Å; T55-E94 HydrophobicContact CG2-CB 4.23Å; T55-E94 PolarHBondContact OG1-OE2 2.96Å; K56-E94 WeakPolarHBondContact CE-OE1 3.33Å; K56-E94 WeakPolarHBondContact CE-OE2 3.27Å; K56-E94 IonicContact NZ-OE1 3.71Å; K56-E94 PolarHBondContact NZ-OE1 3.27Å; K56-E94 IonicContact NZ-OE2 3.71Å; K56-E94 PolarHBondContact NZ-OE2 2.99Å; F90-E94 HydrophobicContact CD2-CG 4.15Å; F90-E94 HydrophobicContact CE1-CG 4.45Å; F90-E94 HydrophobicContact CE2-CG 3.7Å; F90-E94 HydrophobicContact CZ-CG 3.87Å; F90-E94 WeakPolarHBondContact O-CG 3.46Å; F90-E94 PolarHBondContact O-N 2.94Å; I91-E94 PolarHBondContact O-N 3.19Å; E94-Q97 PolarHBondContact O-N 3.23Å; E94-N98 WeakPolarHBondContact O-CB 3.34Å; E94-N98 PolarHBondContact O-N 3.04Å; E94-N98 VanDerWaalsContact O-N 3.17Å; E94-N98 PolarHBondContact O-ND2 3Å; E94-N98 PolarHBondContact OE2-ND2 3.48Å
95	C	95.9	Very high	93.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-50.9	174	-75.4	0	0	0	0	111.6	I91 S93 Q97 N98 I99 V110 I114	I91-C95 WeakPolarHBondContact O-CB 3.48Å; I91-C95 PolarHBondContact O-N 2.97Å; I91-C95 PolarHBondContact O-SG 2.98Å; I91-C95 VanDerWaalsContact O-SG 3.34Å; S93-C95 PolarHBondContact O-N 3.05Å; C95-Q97 VanDerWaalsContact C-N 3.3Å; C95-Q97 PolarHBondContact O-N 3.47Å; C95-N98 PolarHBondContact O-N 3.36Å; C95-I99 PolarHBondContact O-N 3.28Å; C95-I99 VanDerWaalsContact O-N 3.09Å; C95-V110 HydrophobicContact CB-CG1 4.1Å; C95-V110 VanDerWaalsContact O-CG1 3.26Å; C95-V110 WeakPolarHBondContact O-CG1 3.14Å; C95-I114 HydrophobicContact CB-CD1 4.11Å; C95-I114 HydrophobicContact CB-CG1 3.68Å
96	L	94.8	Very high	93.5	Very high	19 Å²	19	35.3 Å²	35.3	10%	0.099	22%	0.217	C	C	.	.	H	α-helix	trans	-65.3	-31.4	-178.8	-69.5	174.6	0	0	0	113.1	K92 S93 I114 W126 L129 K132 L133	K92-L96 WeakPolarHBondContact O-CG 3.36Å; K92-L96 PolarHBondContact O-N 3.11Å; K92-L96 VanDerWaalsContact O-N 3.17Å; S93-L96 PolarHBondContact O-N 3Å; L96-I114 HydrophobicContact CD2-CD1 4.33Å; L96-W126 HydrophobicContact CD1-CZ2 3.64Å; L96-W126 HydrophobicContact CD2-CZ2 4.45Å; L96-W126 HydrophobicContact CG-CH2 4.47Å; L96-W126 HydrophobicContact CG-CZ2 3.89Å; L96-L129 HydrophobicContact CD2-CD1 3.86Å; L96-K132 HydrophobicContact CD1-CG 4.19Å; L96-L133 HydrophobicContact CD2-CD2 4.05Å; L96-L133 HydrophobicContact CD2-CG 4.49Å
97	Q	94.2	Very high	93.7	Very high	120 Å²	120	33.8 Å²	33.8	56%	0.561	19%	0.194	S	C	*	.	H	α-helix	trans	-72.8	-26.8	176.1	-72.1	176.7	28.1	0	0	113.4	S93 E94 C95	S93-Q97 VanDerWaalsContact O-CG 3.29Å; S93-Q97 WeakPolarHBondContact O-CG 3.31Å; S93-Q97 PolarHBondContact O-N 3.1Å; S93-Q97 PolarHBondContact OG-NE2 3.26Å; S93-Q97 VanDerWaalsContact OG-NE2 3.1Å; E94-Q97 PolarHBondContact O-N 3.23Å; C95-Q97 VanDerWaalsContact C-N 3.3Å; C95-Q97 PolarHBondContact O-N 3.47Å
98	N	95.3	Very high	93.6	Very high	22 Å²	22	35.8 Å²	35.8	12%	0.118	21%	0.212	C	C	.	.	S	Bend	trans	-112.3	13.2	-173.9	-67.3	-93.7	0	0	0	113.4	T55 K58 E94 C95 G100 D101	T55-N98 WeakPolarHBondContact CB-ND2 3.46Å; T55-N98 HydrophobicContact CG2-CB 4.03Å; T55-N98 PolarHBondContact O-OD1 3.06Å; K58-N98 PolarHBondContact NZ-OD1 3.24Å; E94-N98 WeakPolarHBondContact O-CB 3.34Å; E94-N98 PolarHBondContact O-N 3.04Å; E94-N98 VanDerWaalsContact O-N 3.17Å; E94-N98 PolarHBondContact O-ND2 3Å; E94-N98 PolarHBondContact OE2-ND2 3.48Å; C95-N98 PolarHBondContact O-N 3.36Å; N98-G100 PolarHBondContact O-N 3.47Å; N98-D101 PolarHBondContact O-N 3.16Å; N98-D101 VanDerWaalsContact O-N 3.13Å
99	I	95.1	Very high	93.7	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.7	178.8	-159.8	169.8	0	0	0	112.8	C95 R107 I114 L133 L136 T144 A148 A151	C95-I99 PolarHBondContact O-N 3.28Å; C95-I99 VanDerWaalsContact O-N 3.09Å; I99-R107 WeakPolarHBondContact O-CD 3.49Å; I99-R107 WeakPolarHBondContact O-CG 3.1Å; I99-I114 HydrophobicContact CD1-CD1 3.69Å; I99-I114 HydrophobicContact CG1-CD1 4.1Å; I99-L133 HydrophobicContact CD1-CD2 3.39Å; I99-L136 HydrophobicContact CG2-CD1 4.06Å; I99-T144 HydrophobicContact CG2-CG2 4.31Å; I99-A148 HydrophobicContact CD1-CB 4.21Å; I99-A151 HydrophobicContact CD1-CB 4.15Å
100	G	94.6	Very high	93.9	Very high	17 Å²	17	31.4 Å²	31.4	18%	0.175	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	27.4	176.1	0	0	0	0	0	115.3	N98 N143	N98-G100 PolarHBondContact O-N 3.47Å; G100-N143 WeakPolarHBondContact O-CB 3.46Å
101	D	95.4	Very high	93.8	Very high	15 Å²	15	30.3 Å²	30.3	8%	0.08	19%	0.186	C	C	.	.			trans	-51.9	145.3	176.9	-167	-71.6	0	0	0	111.2	K58 R65 N98 S103 I106 R107	K58-D101 IonicContact NZ-OD2 3.17Å; K58-D101 PolarHBondContact NZ-OD2 3.18Å; R65-D101 IonicContact NH2-OD2 3.18Å; R65-D101 PolarHBondContact NH2-OD2 3.21Å; N98-D101 PolarHBondContact O-N 3.16Å; N98-D101 VanDerWaalsContact O-N 3.13Å; D101-S103 VanDerWaalsContact C-N 3.25Å; D101-S103 PolarHBondContact O-N 3.14Å; D101-S103 WeakPolarHBondContact OD1-CB 3.38Å; D101-S103 PolarHBondContact OD1-N 3.13Å; D101-I106 HydrophobicContact CB-CB 4.14Å; D101-I106 HydrophobicContact CB-CG2 3.82Å; D101-R107 HydrophobicContact CB-CG 4.06Å; D101-R107 WeakPolarHBondContact O-CD 3.42Å; D101-R107 WeakPolarHBondContact O-CG 3.46Å; D101-R107 PolarHBondContact O-NH1 3.04Å
102	S	93.1	Very high	93.6	Very high	101 Å²	101	33.4 Å²	33.4	71%	0.706	20%	0.202	S	C	*	.	S	Bend	trans	-66.1	-28	-179.4	50.7	0	0	0	0	113.1	P104 R107	S102-P104 WeakPolarHBondContact O-CD 3.3Å; S102-R107 PolarHBondContact O-NH1 3.09Å
103	S	93.1	Very high	93.6	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.028	20%	0.199	C	C	.	.	S	Bend	trans	-80	123.2	176.5	170.4	0	0	0	0	110.7	E62 D101 L105 I106 R107	E62-S103 WeakPolarHBondContact OE1-CB 3.45Å; E62-S103 PolarHBondContact OE1-OG 3Å; E62-S103 PolarHBondContact OE2-OG 3Å; D101-S103 VanDerWaalsContact C-N 3.25Å; D101-S103 PolarHBondContact O-N 3.14Å; D101-S103 WeakPolarHBondContact OD1-CB 3.38Å; D101-S103 PolarHBondContact OD1-N 3.13Å; S103-L105 VanDerWaalsContact C-N 3.25Å; S103-L105 PolarHBondContact O-N 3.22Å; S103-L105 PolarHBondContact OG-N 2.96Å; S103-I106 PolarHBondContact O-N 2.85Å; S103-I106 PolarHBondContact OG-N 3.09Å; S103-R107 PolarHBondContact O-N 2.96Å
104	P	89.1	Confident	93.6	Very high	86 Å²	86	30.2 Å²	30.2	56%	0.558	18%	0.182	S	C	*	.	H	α-helix	trans	-58.6	-36.5	174.5	-23.5	33.9	0	0	0	113	S102 R107 A108	S102-P104 WeakPolarHBondContact O-CD 3.3Å; P104-R107 PolarHBondContact O-N 3.04Å; P104-A108 WeakPolarHBondContact O-CB 3.44Å; P104-A108 PolarHBondContact O-N 3.4Å
105	L	91.8	Very high	93.4	Very high	74 Å²	74	30.4 Å²	30.4	39%	0.387	18%	0.184	S	C	.	.	H	α-helix	trans	-63.7	-43.2	178.7	178.2	61.6	0	0	0	111	E62 S103 A108 T109	E62-L105 HydrophobicContact CB-CD2 4.18Å; S103-L105 VanDerWaalsContact C-N 3.25Å; S103-L105 PolarHBondContact O-N 3.22Å; S103-L105 PolarHBondContact OG-N 2.96Å; L105-A108 PolarHBondContact O-N 3.38Å; L105-T109 PolarHBondContact O-N 3.06Å; L105-T109 VanDerWaalsContact O-N 3.08Å; L105-T109 PolarHBondContact O-OG1 3.5Å; L105-T109 VanDerWaalsContact O-OG1 3.08Å
106	I	94.1	Very high	93.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-69.4	-42.1	178.6	-57.5	-60	0	0	0	111.1	L54 R65 D101 S103 A108 T109 V110	L54-I106 HydrophobicContact CD1-CD1 4.04Å; L54-I106 HydrophobicContact CD1-CG2 4.13Å; R65-I106 HydrophobicContact CB-CD1 3.6Å; D101-I106 HydrophobicContact CB-CB 4.14Å; D101-I106 HydrophobicContact CB-CG2 3.82Å; S103-I106 PolarHBondContact O-N 2.85Å; S103-I106 PolarHBondContact OG-N 3.09Å; I106-A108 VanDerWaalsContact C-N 3.33Å; I106-A108 PolarHBondContact O-N 3.37Å; I106-T109 PolarHBondContact O-N 3.35Å; I106-V110 HydrophobicContact CG2-CG2 4.28Å; I106-V110 WeakPolarHBondContact O-CG2 3.27Å; I106-V110 PolarHBondContact O-N 3.05Å
107	R	92.4	Very high	93.1	Very high	24 Å²	24	30.7 Å²	30.7	9%	0.091	19%	0.186	C	C	.	.	H	α-helix	trans	-58	-45.9	174.5	-71.8	-159.5	-55.6	-82.7	5.7	112	I99 D101 S102 S103 P104 T109 V110 G111 N143 E146	I99-R107 WeakPolarHBondContact O-CD 3.49Å; I99-R107 WeakPolarHBondContact O-CG 3.1Å; D101-R107 HydrophobicContact CB-CG 4.06Å; D101-R107 WeakPolarHBondContact O-CD 3.42Å; D101-R107 WeakPolarHBondContact O-CG 3.46Å; D101-R107 PolarHBondContact O-NH1 3.04Å; S102-R107 PolarHBondContact O-NH1 3.09Å; S103-R107 PolarHBondContact O-N 2.96Å; P104-R107 PolarHBondContact O-N 3.04Å; R107-T109 VanDerWaalsContact C-N 3.35Å; R107-T109 PolarHBondContact O-N 3.22Å; R107-V110 PolarHBondContact O-N 3.34Å; R107-G111 PolarHBondContact O-N 3.08Å; R107-N143 PolarHBondContact NH1-OD1 3.16Å; R107-E146 IonicContact CZ-OE2 2.82Å; R107-E146 VanDerWaalsContact CZ-OE2 3.28Å; R107-E146 IonicContact NE-OE2 3.97Å; R107-E146 PolarHBondContact NE-OE2 3.47Å; R107-E146 IonicContact NH2-OE2 3.04Å; R107-E146 PolarHBondContact NH2-OE2 3.22Å
108	A	89.5	Confident	93	Very high	55 Å²	55	25.1 Å²	25.1	46%	0.455	16%	0.161	S	C	.	.	H	α-helix	trans	-58.3	-47.1	176.9	0	0	0	0	0	111.3	P104 L105 I106 V110 G111 I112	P104-A108 WeakPolarHBondContact O-CB 3.44Å; P104-A108 PolarHBondContact O-N 3.4Å; L105-A108 PolarHBondContact O-N 3.38Å; I106-A108 VanDerWaalsContact C-N 3.33Å; I106-A108 PolarHBondContact O-N 3.37Å; A108-V110 PolarHBondContact O-N 3.47Å; A108-G111 PolarHBondContact O-N 3.07Å; A108-I112 VanDerWaalsContact O-CG1 3.29Å; A108-I112 WeakPolarHBondContact O-CG1 3.31Å; A108-I112 PolarHBondContact O-N 2.83Å
109	T	94.1	Very high	92.6	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-40.1	179	-59.2	0	0	0	0	112.8	L54 S66 L70 L105 I106 R107 I112 L113	L54-T109 HydrophobicContact CD1-CG2 3.92Å; L54-T109 HydrophobicContact CD2-CG2 4.17Å; S66-T109 PolarHBondContact OG-OG1 3.19Å; L70-T109 HydrophobicContact CD2-CG2 4.48Å; L70-T109 HydrophobicContact CG-CG2 4.4Å; L105-T109 PolarHBondContact O-N 3.06Å; L105-T109 VanDerWaalsContact O-N 3.08Å; L105-T109 PolarHBondContact O-OG1 3.5Å; L105-T109 VanDerWaalsContact O-OG1 3.08Å; I106-T109 PolarHBondContact O-N 3.35Å; R107-T109 VanDerWaalsContact C-N 3.35Å; R107-T109 PolarHBondContact O-N 3.22Å; T109-I112 PolarHBondContact O-N 3.02Å; T109-L113 PolarHBondContact O-N 3.27Å
110	V	95.8	Very high	92.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.3	-44.3	173.9	170.3	0	0	0	0	110.8	L54 C95 I106 R107 A108 I112 L113 I114	L54-V110 HydrophobicContact CD2-CG2 3.94Å; L54-V110 HydrophobicContact CG-CG2 4.36Å; C95-V110 HydrophobicContact CB-CG1 4.1Å; C95-V110 VanDerWaalsContact O-CG1 3.26Å; C95-V110 WeakPolarHBondContact O-CG1 3.14Å; I106-V110 HydrophobicContact CG2-CG2 4.28Å; I106-V110 WeakPolarHBondContact O-CG2 3.27Å; I106-V110 PolarHBondContact O-N 3.05Å; R107-V110 PolarHBondContact O-N 3.34Å; A108-V110 PolarHBondContact O-N 3.47Å; V110-I112 PolarHBondContact O-N 3.1Å; V110-L113 WeakPolarHBondContact O-CB 3.19Å; V110-L113 PolarHBondContact O-N 2.95Å; V110-I114 HydrophobicContact CG1-CD1 4.04Å; V110-I114 WeakPolarHBondContact O-CG1 3.3Å; V110-I114 PolarHBondContact O-N 3.23Å
111	G	91.5	Very high	91.8	Very high	12 Å²	12	31.5 Å²	31.5	12%	0.124	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-47.4	175.5	0	0	0	0	0	112.3	R107 A108 L113 I114 T115	R107-G111 PolarHBondContact O-N 3.08Å; A108-G111 PolarHBondContact O-N 3.07Å; G111-L113 VanDerWaalsContact C-N 3.3Å; G111-L113 PolarHBondContact O-N 3.01Å; G111-I114 PolarHBondContact O-N 2.97Å; G111-T115 VanDerWaalsContact O-CG2 3.32Å; G111-T115 WeakPolarHBondContact O-CG2 3.29Å; G111-T115 PolarHBondContact O-N 3Å; G111-T115 PolarHBondContact O-OG1 3.09Å
112	I	90.8	Very high	91.3	Very high	68 Å²	68	35.8 Å²	35.8	35%	0.349	21%	0.212	S	C	.	.	H	α-helix	trans	-59.3	-39.7	175.8	-70.8	165.4	0	0	0	111.6	K73 A108 T109 V110 T115 T116	K73-I112 HydrophobicContact CD-CG2 3.45Å; K73-I112 VanDerWaalsContact CD-CG2 3.45Å; K73-I112 HydrophobicContact CG-CG2 3.77Å; A108-I112 VanDerWaalsContact O-CG1 3.29Å; A108-I112 WeakPolarHBondContact O-CG1 3.31Å; A108-I112 PolarHBondContact O-N 2.83Å; T109-I112 PolarHBondContact O-N 3.02Å; V110-I112 PolarHBondContact O-N 3.1Å; I112-T115 WeakPolarHBondContact CA-OG1 3.16Å; I112-T115 PolarHBondContact O-OG1 3.27Å; I112-T116 VanDerWaalsContact O-CB 3.26Å; I112-T116 WeakPolarHBondContact O-CB 3.31Å; I112-T116 PolarHBondContact O-N 3.07Å; I112-T116 PolarHBondContact O-OG1 3.38Å
113	L	95	Very high	91	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.2	-45.3	175.7	-83.9	169.1	0	0	0	111.7	I51 L54 L72 K73 T109 V110 G111 T115 T116 I117	I51-L113 HydrophobicContact CD1-CD1 4.32Å; L54-L113 HydrophobicContact CD2-CD1 3.5Å; L54-L113 VanDerWaalsContact CD2-CD1 3.5Å; L72-L113 HydrophobicContact CB-CD2 4.14Å; L72-L113 HydrophobicContact CD2-CD1 4.1Å; L72-L113 HydrophobicContact CD2-CD2 4.06Å; L72-L113 HydrophobicContact CG-CD2 3.82Å; K73-L113 HydrophobicContact CB-CD2 3.88Å; T109-L113 PolarHBondContact O-N 3.27Å; V110-L113 WeakPolarHBondContact O-CB 3.19Å; V110-L113 PolarHBondContact O-N 2.95Å; G111-L113 VanDerWaalsContact C-N 3.3Å; G111-L113 PolarHBondContact O-N 3.01Å; L113-T115 VanDerWaalsContact C-N 3.34Å; L113-T115 PolarHBondContact O-N 3.45Å; L113-T116 PolarHBondContact O-N 2.89Å; L113-I117 WeakPolarHBondContact O-CB 3.43Å; L113-I117 WeakPolarHBondContact O-CD1 3.45Å; L113-I117 WeakPolarHBondContact O-CG1 3.21Å; L113-I117 PolarHBondContact O-N 3.47Å
114	I	94.9	Very high	90.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-57.3	-49.6	177.2	-68.7	169.9	0	0	0	110.1	C95 L96 I99 V110 G111 I117 A118 W126 L129 A151	C95-I114 HydrophobicContact CB-CD1 4.11Å; C95-I114 HydrophobicContact CB-CG1 3.68Å; L96-I114 HydrophobicContact CD2-CD1 4.33Å; I99-I114 HydrophobicContact CD1-CD1 3.69Å; I99-I114 HydrophobicContact CG1-CD1 4.1Å; V110-I114 HydrophobicContact CG1-CD1 4.04Å; V110-I114 WeakPolarHBondContact O-CG1 3.3Å; V110-I114 PolarHBondContact O-N 3.23Å; G111-I114 PolarHBondContact O-N 2.97Å; I114-I117 PolarHBondContact O-N 2.94Å; I114-A118 WeakPolarHBondContact O-CB 3.3Å; I114-A118 PolarHBondContact O-N 2.99Å; I114-W126 HydrophobicContact CG1-CH2 4.47Å; I114-W126 HydrophobicContact CG2-CZ3 4.41Å; I114-L129 HydrophobicContact CG2-CD1 3.81Å; I114-L129 HydrophobicContact CG2-CD2 4.36Å; I114-A151 HydrophobicContact CG2-CB 4.36Å
115	T	90.7	Very high	90.8	Very high	14 Å²	14	35.9 Å²	35.9	9%	0.086	20%	0.196	C	C	.	.	H	α-helix	trans	-68.2	-38.7	-177.1	60.3	0	0	0	0	111.7	G111 I112 L113 I117 A118 S119 K154 I155	G111-T115 VanDerWaalsContact O-CG2 3.32Å; G111-T115 WeakPolarHBondContact O-CG2 3.29Å; G111-T115 PolarHBondContact O-N 3Å; G111-T115 PolarHBondContact O-OG1 3.09Å; I112-T115 WeakPolarHBondContact CA-OG1 3.16Å; I112-T115 PolarHBondContact O-OG1 3.27Å; L113-T115 VanDerWaalsContact C-N 3.34Å; L113-T115 PolarHBondContact O-N 3.45Å; T115-I117 PolarHBondContact O-N 3.02Å; T115-A118 PolarHBondContact O-N 3.29Å; T115-S119 WeakPolarHBondContact O-CB 3.43Å; T115-S119 PolarHBondContact O-N 3.23Å; T115-K154 HydrophobicContact CG2-CB 3.54Å; T115-K154 HydrophobicContact CG2-CG 3.58Å; T115-I155 HydrophobicContact CG2-CG1 4.33Å
116	T	92.3	Very high	90.8	Very high	22 Å²	22	32.6 Å²	32.6	14%	0.135	18%	0.179	C	C	.	.	H	α-helix	trans	-64.2	-42.1	175.5	-55.8	0	0	0	0	111.6	K73 V76 K77 I112 L113 S119 K120	K73-T116 HydrophobicContact CG-CG2 4.01Å; K73-T116 WeakPolarHBondContact CG-OG1 3.45Å; V76-T116 HydrophobicContact CB-CG2 4.28Å; V76-T116 HydrophobicContact CG1-CG2 3.83Å; K77-T116 HydrophobicContact CB-CG2 4.49Å; I112-T116 VanDerWaalsContact O-CB 3.26Å; I112-T116 WeakPolarHBondContact O-CB 3.31Å; I112-T116 PolarHBondContact O-N 3.07Å; I112-T116 PolarHBondContact O-OG1 3.38Å; L113-T116 PolarHBondContact O-N 2.89Å; T116-S119 PolarHBondContact O-N 2.94Å; T116-K120 WeakPolarHBondContact O-CB 3.44Å; T116-K120 PolarHBondContact O-N 3.41Å
117	I	93.5	Very high	90.6	Very high	3 Å²	3	37 Å²	37	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-42.9	176.5	-68.7	165.6	0	0	0	110.3	V76 Y80 I91 K92 L113 I114 T115 S119 G121 W126	V76-I117 HydrophobicContact CG1-CG1 3.81Å; V76-I117 HydrophobicContact CG2-CG1 4.13Å; Y80-I117 HydrophobicContact CE2-CG1 4.3Å; Y80-I117 HydrophobicContact CE2-CG2 3.94Å; Y80-I117 WeakPolarHBondContact OH-CG2 3.48Å; I91-I117 HydrophobicContact CG2-CD1 3.68Å; K92-I117 HydrophobicContact CG-CG2 4.45Å; L113-I117 WeakPolarHBondContact O-CB 3.43Å; L113-I117 WeakPolarHBondContact O-CD1 3.45Å; L113-I117 WeakPolarHBondContact O-CG1 3.21Å; L113-I117 PolarHBondContact O-N 3.47Å; I114-I117 PolarHBondContact O-N 2.94Å; T115-I117 PolarHBondContact O-N 3.02Å; I117-S119 VanDerWaalsContact C-N 3.35Å; I117-S119 PolarHBondContact O-N 3.25Å; I117-G121 VanDerWaalsContact O-CA 3.24Å; I117-G121 WeakPolarHBondContact O-CA 3.1Å; I117-G121 PolarHBondContact O-N 2.88Å; I117-W126 HydrophobicContact CB-CE3 4.37Å; I117-W126 HydrophobicContact CB-CZ3 3.95Å; I117-W126 HydrophobicContact CD1-CZ3 4.47Å; I117-W126 HydrophobicContact CG2-CE3 3.59Å; I117-W126 HydrophobicContact CG2-CZ3 3.54Å
118	A	90.4	Very high	90.5	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.033	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-41.6	178.4	0	0	0	0	0	112	I114 T115 E122 L123 L129 I155	I114-A118 WeakPolarHBondContact O-CB 3.3Å; I114-A118 PolarHBondContact O-N 2.99Å; T115-A118 PolarHBondContact O-N 3.29Å; A118-E122 CarbonylContact O-C 3.56Å; A118-E122 WeakPolarHBondContact O-CA 3.42Å; A118-E122 PolarHBondContact O-N 3.22Å; A118-L123 HydrophobicContact CB-CD1 3.76Å; A118-L123 PolarHBondContact O-N 3.42Å; A118-L129 HydrophobicContact CB-CD2 3.86Å; A118-I155 HydrophobicContact CB-CG1 4.46Å
119	S	88	Confident	90.8	Very high	65 Å²	65	37.8 Å²	37.8	46%	0.455	20%	0.202	S	C	.	.	H	α-helix	trans	-70	-52.2	177.6	173.3	0	0	0	0	112.6	T115 T116 I117	T115-S119 WeakPolarHBondContact O-CB 3.43Å; T115-S119 PolarHBondContact O-N 3.23Å; T116-S119 PolarHBondContact O-N 2.94Å; I117-S119 VanDerWaalsContact C-N 3.35Å; I117-S119 PolarHBondContact O-N 3.25Å
120	K	88.3	Confident	90.8	Very high	105 Å²	105	38.3 Å²	38.3	46%	0.457	21%	0.205	S	C	.	.	H	α-helix	trans	-82.4	-25.9	-174.7	-71.1	-68.9	179.8	-163.7	0	114.5	T116	T116-K120 WeakPolarHBondContact O-CB 3.44Å; T116-K120 PolarHBondContact O-N 3.41Å
121	G	83.7	Confident	90.7	Very high	5 Å²	5	42.3 Å²	42.3	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-88.7	-5.9	176.2	0	0	0	0	0	114.2	Y80 I117 N125	Y80-G121 VanDerWaalsContact CD1-CA 3.5Å; I117-G121 VanDerWaalsContact O-CA 3.24Å; I117-G121 WeakPolarHBondContact O-CA 3.1Å; I117-G121 PolarHBondContact O-N 2.88Å; G121-N125 WeakPolarHBondContact O-CB 3.26Å; G121-N125 PolarHBondContact O-ND2 2.82Å
122	E	85.5	Confident	90.9	Very high	104 Å²	104	46.1 Å²	46.1	49%	0.486	24%	0.244	S	C	.	.			trans	61.8	131.7	-168.1	-48.7	170.4	168.3	0	0	112.7	A118 Q124 N125	A118-E122 CarbonylContact O-C 3.56Å; A118-E122 WeakPolarHBondContact O-CA 3.42Å; A118-E122 PolarHBondContact O-N 3.22Å; E122-Q124 HydrophobicContact CB-CG 3.97Å; E122-Q124 PolarHBondContact O-N 3.27Å; E122-Q124 VanDerWaalsContact O-N 3.1Å; E122-Q124 PolarHBondContact OE2-NE2 2.95Å; E122-N125 PolarHBondContact O-N 3.45Å; E122-N125 PolarHBondContact OE2-ND2 3.17Å
123	L	87.6	Confident	91.2	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.042	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-55.5	-34.8	-176.4	-115.4	89.5	0	0	0	113.5	A118 N125 W126 L130 I155 L163 L168	A118-L123 HydrophobicContact CB-CD1 3.76Å; A118-L123 PolarHBondContact O-N 3.42Å; L123-N125 PolarHBondContact O-N 3.45Å; L123-W126 CarbonylContact O-C 3.2Å; L123-W126 PolarHBondContact O-N 2.91Å; L123-L130 HydrophobicContact CD2-CD1 3.74Å; L123-L130 HydrophobicContact CD2-CD2 4.16Å; L123-L130 HydrophobicContact CD2-CG 4.05Å; L123-I155 HydrophobicContact CD1-CG2 4.09Å; L123-I155 HydrophobicContact CD2-CG2 4.19Å; L123-L163 HydrophobicContact CD2-CD2 3.84Å; L123-L168 HydrophobicContact CB-CD1 4.08Å; L123-L168 HydrophobicContact CD2-CD1 3.73Å
124	Q	87.6	Confident	91.2	Very high	95 Å²	95	43.4 Å²	43.4	44%	0.444	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-60	-26.5	179.3	62.1	-170.5	4	0	0	113.7	E122 W126 L168	E122-Q124 HydrophobicContact CB-CG 3.97Å; E122-Q124 PolarHBondContact O-N 3.27Å; E122-Q124 VanDerWaalsContact O-N 3.1Å; E122-Q124 PolarHBondContact OE2-NE2 2.95Å; Q124-W126 VanDerWaalsContact C-N 3.26Å; Q124-W126 PolarHBondContact O-N 3.43Å; Q124-L168 HydrophobicContact CB-CD2 4.2Å
125	N	89.3	Confident	91.2	Very high	90 Å²	90	48.3 Å²	48.3	48%	0.481	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-87.8	6.1	178.5	-59	-42.4	0	0	0	112.6	K92 G121 E122 L123	K92-N125 PolarHBondContact NZ-O 3.08Å; G121-N125 WeakPolarHBondContact O-CB 3.26Å; G121-N125 PolarHBondContact O-ND2 2.82Å; E122-N125 PolarHBondContact O-N 3.45Å; E122-N125 PolarHBondContact OE2-ND2 3.17Å; L123-N125 PolarHBondContact O-N 3.45Å
126	W	92.1	Very high	91.5	Very high	6 Å²	6	48.7 Å²	48.7	2%	0.023	26%	0.258	C	S	.	.			trans	-136.5	64.5	172.3	-161.8	-4.4	0	0	0	111.6	K92 L96 I114 I117 L123 Q124 E128 L129	K92-W126 HydrophobicContact CB-CH2 3.8Å; K92-W126 HydrophobicContact CB-CZ2 3.33Å; K92-W126 HydrophobicContact CD-CD2 3.78Å; K92-W126 HydrophobicContact CD-CE3 4.26Å; K92-W126 HydrophobicContact CD-CG 4.06Å; K92-W126 HydrophobicContact CD-CZ2 4.15Å; K92-W126 HydrophobicContact CG-CD2 3.84Å; K92-W126 HydrophobicContact CG-CE3 3.96Å; K92-W126 HydrophobicContact CG-CH2 3.63Å; K92-W126 HydrophobicContact CG-CZ2 3.47Å; K92-W126 VanDerWaalsContact CG-CZ2 3.47Å; K92-W126 HydrophobicContact CG-CZ3 3.87Å; L96-W126 HydrophobicContact CD1-CZ2 3.64Å; L96-W126 HydrophobicContact CD2-CZ2 4.45Å; L96-W126 HydrophobicContact CG-CH2 4.47Å; L96-W126 HydrophobicContact CG-CZ2 3.89Å; I114-W126 HydrophobicContact CG1-CH2 4.47Å; I114-W126 HydrophobicContact CG2-CZ3 4.41Å; I117-W126 HydrophobicContact CB-CE3 4.37Å; I117-W126 HydrophobicContact CB-CZ3 3.95Å; I117-W126 HydrophobicContact CD1-CZ3 4.47Å; I117-W126 HydrophobicContact CG2-CE3 3.59Å; I117-W126 HydrophobicContact CG2-CZ3 3.54Å; L123-W126 CarbonylContact O-C 3.2Å; L123-W126 PolarHBondContact O-N 2.91Å; Q124-W126 VanDerWaalsContact C-N 3.26Å; Q124-W126 PolarHBondContact O-N 3.43Å; W126-E128 VanDerWaalsContact C-N 3.27Å; W126-E128 PolarHBondContact NE1-OE1 3.09Å; W126-E128 PolarHBondContact O-N 3.17Å; W126-L129 HydrophobicContact CB-CB 4.27Å; W126-L129 HydrophobicContact CD2-CB 3.85Å; W126-L129 HydrophobicContact CD2-CD1 4.21Å; W126-L129 HydrophobicContact CD2-CD2 4.08Å; W126-L129 HydrophobicContact CD2-CG 4.26Å; W126-L129 HydrophobicContact CE3-CB 4.44Å; W126-L129 HydrophobicContact CE3-CD1 4.26Å; W126-L129 HydrophobicContact CE3-CD2 3.8Å; W126-L129 HydrophobicContact CE3-CG 4.39Å; W126-L129 HydrophobicContact CG-CB 3.75Å; W126-L129 HydrophobicContact CH2-CD1 4.05Å; W126-L129 HydrophobicContact CZ2-CD1 4Å; W126-L129 HydrophobicContact CZ3-CD1 4.18Å; W126-L129 HydrophobicContact CZ3-CD2 4.24Å; W126-L129 VanDerWaalsContact O-CB 3.26Å; W126-L129 WeakPolarHBondContact O-CB 3.23Å; W126-L129 PolarHBondContact O-N 3.41Å; W126-L129 VanDerWaalsContact O-N 3.08Å
127	P	89.4	Confident	91.7	Very high	92 Å²	92	47.7 Å²	47.7	60%	0.597	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.3	-169.3	25.7	-34.7	0	0	0	114	L129 P131	P127-L129 VanDerWaalsContact C-N 3.32Å; P127-L129 PolarHBondContact O-N 3.17Å; P127-P131 WeakPolarHBondContact O-CD 3.28Å
128	E	91.4	Very high	91.7	Very high	95 Å²	95	52.2 Å²	52.2	44%	0.444	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-9.4	178.7	69.3	-81.3	-177.6	0	0	114.5	W126 K132	W126-E128 VanDerWaalsContact C-N 3.27Å; W126-E128 PolarHBondContact NE1-OE1 3.09Å; W126-E128 PolarHBondContact O-N 3.17Å; E128-K132 WeakPolarHBondContact O-CB 3.33Å; E128-K132 PolarHBondContact O-N 3.35Å
129	L	94.6	Very high	92	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-60.9	-174.8	178.2	59.7	0	0	0	112.4	L96 I114 A118 W126 P127 K132 L133 I155	L96-L129 HydrophobicContact CD2-CD1 3.86Å; I114-L129 HydrophobicContact CG2-CD1 3.81Å; I114-L129 HydrophobicContact CG2-CD2 4.36Å; A118-L129 HydrophobicContact CB-CD2 3.86Å; W126-L129 HydrophobicContact CB-CB 4.27Å; W126-L129 HydrophobicContact CD2-CB 3.85Å; W126-L129 HydrophobicContact CD2-CD1 4.21Å; W126-L129 HydrophobicContact CD2-CD2 4.08Å; W126-L129 HydrophobicContact CD2-CG 4.26Å; W126-L129 HydrophobicContact CE3-CB 4.44Å; W126-L129 HydrophobicContact CE3-CD1 4.26Å; W126-L129 HydrophobicContact CE3-CD2 3.8Å; W126-L129 HydrophobicContact CE3-CG 4.39Å; W126-L129 HydrophobicContact CG-CB 3.75Å; W126-L129 HydrophobicContact CH2-CD1 4.05Å; W126-L129 HydrophobicContact CZ2-CD1 4Å; W126-L129 HydrophobicContact CZ3-CD1 4.18Å; W126-L129 HydrophobicContact CZ3-CD2 4.24Å; W126-L129 VanDerWaalsContact O-CB 3.26Å; W126-L129 WeakPolarHBondContact O-CB 3.23Å; W126-L129 PolarHBondContact O-N 3.41Å; W126-L129 VanDerWaalsContact O-N 3.08Å; P127-L129 VanDerWaalsContact C-N 3.32Å; P127-L129 PolarHBondContact O-N 3.17Å; L129-K132 PolarHBondContact O-N 2.98Å; L129-L133 HydrophobicContact CD1-CD1 3.7Å; L129-L133 HydrophobicContact CD1-CG 3.98Å; L129-L133 HydrophobicContact CG-CD1 3.96Å; L129-L133 WeakPolarHBondContact O-CG 3.22Å; L129-L133 PolarHBondContact O-N 3.3Å; L129-I155 HydrophobicContact CD2-CD1 3.99Å
130	L	94.4	Very high	92.2	Very high	16 Å²	16	60.8 Å²	60.8	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-46.8	-175.9	-59.7	176.9	0	0	0	112.4	L123 K132 L133 C134 L152 I155 L163 P171 M175	L123-L130 HydrophobicContact CD2-CD1 3.74Å; L123-L130 HydrophobicContact CD2-CD2 4.16Å; L123-L130 HydrophobicContact CD2-CG 4.05Å; L130-K132 VanDerWaalsContact C-N 3.28Å; L130-K132 PolarHBondContact O-N 3.42Å; L130-L133 PolarHBondContact O-N 2.92Å; L130-C134 WeakPolarHBondContact O-CB 3.08Å; L130-C134 PolarHBondContact O-N 2.98Å; L130-C134 PolarHBondContact O-SG 2.82Å; L130-L152 HydrophobicContact CD2-CD2 4.2Å; L130-I155 HydrophobicContact CD2-CD1 4.48Å; L130-I155 HydrophobicContact CD2-CG2 4.11Å; L130-L163 HydrophobicContact CD1-CD2 3.49Å; L130-L163 VanDerWaalsContact CD1-CD2 3.49Å; L130-L163 HydrophobicContact CD2-CD2 4.31Å; L130-P171 HydrophobicContact CD1-CB 3.8Å; L130-P171 HydrophobicContact CD1-CG 3.89Å; L130-M175 HydrophobicContact CB-SD 4.5Å; L130-M175 HydrophobicContact CD1-SD 4.19Å; L130-M175 HydrophobicContact CD2-CE 4.35Å; L130-M175 HydrophobicContact CD2-SD 4.43Å
131	P	94.3	Very high	92.5	Very high	84 Å²	84	58.9 Å²	58.9	55%	0.545	31%	0.309	S	S	.	.	H	α-helix	trans	-59.2	-39.7	175.5	-24.4	35.1	0	0	0	112.6	P127 L135	P127-P131 WeakPolarHBondContact O-CD 3.28Å; P131-L135 PolarHBondContact O-N 3.4Å; P131-L135 VanDerWaalsContact O-N 3.08Å
132	K	95.3	Very high	93	Very high	92 Å²	92	63.3 Å²	63.3	40%	0.4	32%	0.324	S	S	.	.	H	α-helix	trans	-68.9	-44.4	179.9	-174.4	59.7	173.4	179.8	0	111.8	L96 E128 L129 L130 C134 L135 L136	L96-K132 HydrophobicContact CD1-CG 4.19Å; E128-K132 WeakPolarHBondContact O-CB 3.33Å; E128-K132 PolarHBondContact O-N 3.35Å; L129-K132 PolarHBondContact O-N 2.98Å; L130-K132 VanDerWaalsContact C-N 3.28Å; L130-K132 PolarHBondContact O-N 3.42Å; K132-C134 VanDerWaalsContact C-N 3.34Å; K132-C134 PolarHBondContact O-N 2.99Å; K132-L135 PolarHBondContact O-N 2.7Å; K132-L136 HydrophobicContact CG-CD1 4.14Å; K132-L136 VanDerWaalsContact O-CG 3.27Å; K132-L136 WeakPolarHBondContact O-CG 3.43Å; K132-L136 PolarHBondContact O-N 3.25Å
133	L	96.2	Very high	93.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-43.6	175.4	-69.8	175.8	0	0	0	111.2	L96 I99 L129 L130 L135 L136 L137 A148 A151 L152 I155	L96-L133 HydrophobicContact CD2-CD2 4.05Å; L96-L133 HydrophobicContact CD2-CG 4.49Å; I99-L133 HydrophobicContact CD1-CD2 3.39Å; L129-L133 HydrophobicContact CD1-CD1 3.7Å; L129-L133 HydrophobicContact CD1-CG 3.98Å; L129-L133 HydrophobicContact CG-CD1 3.96Å; L129-L133 WeakPolarHBondContact O-CG 3.22Å; L129-L133 PolarHBondContact O-N 3.3Å; L130-L133 PolarHBondContact O-N 2.92Å; L133-L135 VanDerWaalsContact C-N 3.26Å; L133-L135 PolarHBondContact O-N 2.66Å; L133-L136 HydrophobicContact CD2-CD1 4.34Å; L133-L136 WeakPolarHBondContact O-CB 3.45Å; L133-L136 PolarHBondContact O-N 3.05Å; L133-L136 VanDerWaalsContact O-N 3.11Å; L133-L137 PolarHBondContact O-N 2.7Å; L133-A148 HydrophobicContact CD2-CB 4.3Å; L133-A151 HydrophobicContact CD1-CB 4.29Å; L133-A151 HydrophobicContact CD2-CB 4.3Å; L133-L152 HydrophobicContact CB-CD1 4.01Å; L133-L152 HydrophobicContact CB-CD2 3.8Å; L133-L152 HydrophobicContact CB-CG 3.85Å; L133-L152 HydrophobicContact CD1-CD2 3.84Å; L133-L152 HydrophobicContact CD1-CG 4.04Å; L133-L152 HydrophobicContact CG-CD2 4.49Å; L133-I155 HydrophobicContact CD1-CD1 3.79Å
134	C	95.3	Very high	93.8	Very high	12 Å²	12	61 Å²	61	8%	0.081	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-31	176.2	-70	0	0	0	0	113.6	L130 K132 K178	L130-C134 WeakPolarHBondContact O-CB 3.08Å; L130-C134 PolarHBondContact O-N 2.98Å; L130-C134 PolarHBondContact O-SG 2.82Å; K132-C134 VanDerWaalsContact C-N 3.34Å; K132-C134 PolarHBondContact O-N 2.99Å; C134-K178 VanDerWaalsContact O-CE 3.27Å; C134-K178 WeakPolarHBondContact O-CE 3.18Å; C134-K178 PolarHBondContact O-NZ 3.41Å
135	L	95.8	Very high	94.2	Very high	102 Å²	102	56.7 Å²	56.7	53%	0.534	30%	0.297	S	S	.	.	H	α-helix	trans	-75.7	-35.6	174.1	-179.6	138.5	0	0	0	111.7	P131 K132 L133 L137 D138	P131-L135 PolarHBondContact O-N 3.4Å; P131-L135 VanDerWaalsContact O-N 3.08Å; K132-L135 PolarHBondContact O-N 2.7Å; L133-L135 VanDerWaalsContact C-N 3.26Å; L133-L135 PolarHBondContact O-N 2.66Å; L135-L137 PolarHBondContact O-N 3.13Å; L135-D138 PolarHBondContact O-N 2.92Å; L135-D138 VanDerWaalsContact O-N 3.12Å
136	L	96.1	Very high	94.5	Very high	22 Å²	22	53.2 Å²	53.2	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-22.3	176.9	-70.6	164.2	0	0	0	112.9	I99 K132 L133 D138 S139 T144 A148	I99-L136 HydrophobicContact CG2-CD1 4.06Å; K132-L136 HydrophobicContact CG-CD1 4.14Å; K132-L136 VanDerWaalsContact O-CG 3.27Å; K132-L136 WeakPolarHBondContact O-CG 3.43Å; K132-L136 PolarHBondContact O-N 3.25Å; L133-L136 HydrophobicContact CD2-CD1 4.34Å; L133-L136 WeakPolarHBondContact O-CB 3.45Å; L133-L136 PolarHBondContact O-N 3.05Å; L133-L136 VanDerWaalsContact O-N 3.11Å; L136-D138 PolarHBondContact O-N 3.2Å; L136-S139 WeakPolarHBondContact O-CB 3.4Å; L136-S139 PolarHBondContact O-N 3.09Å; L136-S139 VanDerWaalsContact O-N 3.14Å; L136-T144 HydrophobicContact CB-CG2 4.16Å; L136-T144 HydrophobicContact CD2-CG2 3.65Å; L136-T144 HydrophobicContact CG-CG2 4.45Å; L136-A148 HydrophobicContact CB-CB 3.83Å
137	L	96.3	Very high	94.5	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.01	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.9	170.9	-62.9	-173	0	0	0	113.4	L133 L135 S139 C145 A148 F149 L152 F179 F182	L133-L137 PolarHBondContact O-N 2.7Å; L135-L137 PolarHBondContact O-N 3.13Å; L137-S139 VanDerWaalsContact C-N 3.25Å; L137-S139 PolarHBondContact O-N 2.75Å; L137-C145 PolarHBondContact O-SG 2.92Å; L137-C145 VanDerWaalsContact O-SG 3.33Å; L137-A148 HydrophobicContact CD2-CB 3.86Å; L137-F149 HydrophobicContact CD1-CE1 4.32Å; L137-F149 HydrophobicContact CD1-CE2 4.06Å; L137-F149 HydrophobicContact CD1-CZ 3.95Å; L137-F149 HydrophobicContact CD2-CB 4.27Å; L137-F149 HydrophobicContact CD2-CD1 4.36Å; L137-F149 HydrophobicContact CD2-CD2 3.39Å; L137-F149 HydrophobicContact CD2-CE2 3.68Å; L137-F149 HydrophobicContact CD2-CG 3.76Å; L137-F149 HydrophobicContact CD2-CZ 4.28Å; L137-F149 HydrophobicContact CG-CE2 4.38Å; L137-L152 HydrophobicContact CD1-CD1 3.82Å; L137-L152 HydrophobicContact CD2-CD1 4.1Å; L137-L152 HydrophobicContact CG-CD1 4.07Å; L137-F179 HydrophobicContact CD1-CD1 4.26Å; L137-F179 HydrophobicContact CD1-CE1 4.04Å; L137-F182 HydrophobicContact CB-CE2 4.06Å; L137-F182 HydrophobicContact CB-CZ 3.81Å; L137-F182 HydrophobicContact CD1-CE2 4.27Å; L137-F182 WeakPolarHBondContact O-CZ 3.47Å
138	D	95.3	Very high	94.8	Very high	97 Å²	97	49 Å²	49	52%	0.519	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	3.3	178.1	-55.9	-31.9	0	0	0	112.9	L135 L136 K178	L135-D138 PolarHBondContact O-N 2.92Å; L135-D138 VanDerWaalsContact O-N 3.12Å; L136-D138 PolarHBondContact O-N 3.2Å; D138-K178 WeakPolarHBondContact OD1-CE 3.47Å; D138-K178 IonicContact OD1-NZ 2.89Å; D138-K178 PolarHBondContact OD1-NZ 3.08Å; D138-K178 IonicContact OD2-NZ 3.69Å; D138-K178 PolarHBondContact OD2-NZ 3.44Å
139	S	94.7	Very high	95	Very high	46 Å²	46	44.5 Å²	44.5	32%	0.322	23%	0.231	S	C	.	.			trans	-63.5	140.1	179.2	-173.9	0	0	0	0	111.4	L136 L137 D141	L136-S139 WeakPolarHBondContact O-CB 3.4Å; L136-S139 PolarHBondContact O-N 3.09Å; L136-S139 VanDerWaalsContact O-N 3.14Å; L137-S139 VanDerWaalsContact C-N 3.25Å; L137-S139 PolarHBondContact O-N 2.75Å; S139-D141 PolarHBondContact O-N 2.89Å; S139-D141 PolarHBondContact OG-N 2.86Å
140	E	92.1	Very high	94.9	Very high	203 Å²	203	45.8 Å²	45.8	95%	0.949	25%	0.245	S	C	*	.	S	Bend	trans	-69.6	-20.4	171.1	-64.5	-172.8	172.1	0	0	112.2	Y142	E140-Y142 PolarHBondContact O-N 3.44Å
141	D	94.9	Very high	94.8	Very high	66 Å²	66	45.1 Å²	45.1	35%	0.353	24%	0.241	S	C	.	.			trans	-79.6	116.9	175.5	175.2	55.3	0	0	0	111.3	S139 N143 T144 C145	S139-D141 PolarHBondContact O-N 2.89Å; S139-D141 PolarHBondContact OG-N 2.86Å; D141-N143 VanDerWaalsContact C-N 3.31Å; D141-N143 PolarHBondContact O-N 3.47Å; D141-T144 WeakPolarHBondContact O-CB 3.36Å; D141-T144 PolarHBondContact O-N 3.22Å; D141-T144 VanDerWaalsContact OD2-CB 3.31Å; D141-T144 WeakPolarHBondContact OD2-CB 3.43Å; D141-T144 PolarHBondContact OD2-N 2.85Å; D141-T144 PolarHBondContact OD2-OG1 3.01Å; D141-C145 PolarHBondContact O-N 3.4Å; D141-C145 VanDerWaalsContact O-N 3.09Å
142	Y	94.6	Very high	94.9	Very high	98 Å²	98	41.1 Å²	41.1	38%	0.384	22%	0.215	S	C	.	.	H	α-helix	trans	-55.2	-43.8	-179.9	173.8	-100	0	0	0	112.8	E140 T144 C145 E146 S187 I190	E140-Y142 PolarHBondContact O-N 3.44Å; Y142-T144 VanDerWaalsContact C-N 3.33Å; Y142-T144 PolarHBondContact O-N 2.74Å; Y142-C145 PolarHBondContact O-N 3.36Å; Y142-E146 HydrophobicContact CE1-CB 4.39Å; Y142-E146 VanDerWaalsContact O-CB 3.31Å; Y142-E146 WeakPolarHBondContact O-CB 3.2Å; Y142-E146 PolarHBondContact O-N 3.44Å; Y142-S187 WeakPolarHBondContact CE2-OG 3.09Å; Y142-S187 PolarHBondContact OH-OG 3.44Å; Y142-I190 HydrophobicContact CD2-CD1 3.93Å; Y142-I190 HydrophobicContact CE2-CD1 3.66Å; Y142-I190 HydrophobicContact CE2-CG1 4.28Å
143	N	95.3	Very high	94.8	Very high	40 Å²	40	38.7 Å²	38.7	21%	0.214	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-37	-176.2	-66.8	-45.5	0	0	0	111.5	G100 R107 D141 G147	G100-N143 WeakPolarHBondContact O-CB 3.46Å; R107-N143 PolarHBondContact NH1-OD1 3.16Å; D141-N143 VanDerWaalsContact C-N 3.31Å; D141-N143 PolarHBondContact O-N 3.47Å; N143-G147 PolarHBondContact O-N 3.02Å
144	T	95.6	Very high	94.5	Very high	23 Å²	23	42.3 Å²	42.3	14%	0.141	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-47	174	-60.2	0	0	0	0	111.4	I99 L136 D141 Y142 A148	I99-T144 HydrophobicContact CG2-CG2 4.31Å; L136-T144 HydrophobicContact CB-CG2 4.16Å; L136-T144 HydrophobicContact CD2-CG2 3.65Å; L136-T144 HydrophobicContact CG-CG2 4.45Å; D141-T144 WeakPolarHBondContact O-CB 3.36Å; D141-T144 PolarHBondContact O-N 3.22Å; D141-T144 VanDerWaalsContact OD2-CB 3.31Å; D141-T144 WeakPolarHBondContact OD2-CB 3.43Å; D141-T144 PolarHBondContact OD2-N 2.85Å; D141-T144 PolarHBondContact OD2-OG1 3.01Å; Y142-T144 VanDerWaalsContact C-N 3.33Å; Y142-T144 PolarHBondContact O-N 2.74Å; T144-A148 VanDerWaalsContact O-CB 3.28Å; T144-A148 WeakPolarHBondContact O-CB 3.32Å; T144-A148 PolarHBondContact O-N 3.42Å
145	C	95.6	Very high	94.4	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.034	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-47.5	176.5	-176.6	0	0	0	0	111.3	L137 D141 Y142 A148 F149 I190	L137-C145 PolarHBondContact O-SG 2.92Å; L137-C145 VanDerWaalsContact O-SG 3.33Å; D141-C145 PolarHBondContact O-N 3.4Å; D141-C145 VanDerWaalsContact O-N 3.09Å; Y142-C145 PolarHBondContact O-N 3.36Å; C145-A148 PolarHBondContact O-N 3.33Å; C145-F149 PolarHBondContact O-N 2.95Å; C145-I190 HydrophobicContact CB-CD1 4.42Å
146	E	94.3	Very high	94.3	Very high	17 Å²	17	37 Å²	37	8%	0.079	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-46	179.4	-173.9	-97.2	164	0	0	112.6	R107 Y142 A148 F149 G150 K189	R107-E146 IonicContact CZ-OE2 2.82Å; R107-E146 VanDerWaalsContact CZ-OE2 3.28Å; R107-E146 IonicContact NE-OE2 3.97Å; R107-E146 PolarHBondContact NE-OE2 3.47Å; R107-E146 IonicContact NH2-OE2 3.04Å; R107-E146 PolarHBondContact NH2-OE2 3.22Å; Y142-E146 HydrophobicContact CE1-CB 4.39Å; Y142-E146 VanDerWaalsContact O-CB 3.31Å; Y142-E146 WeakPolarHBondContact O-CB 3.2Å; Y142-E146 PolarHBondContact O-N 3.44Å; E146-A148 VanDerWaalsContact C-N 3.34Å; E146-A148 PolarHBondContact O-N 2.99Å; E146-F149 PolarHBondContact O-N 3.2Å; E146-G150 PolarHBondContact O-N 3.25Å; E146-K189 HydrophobicContact CG-CD 4.07Å; E146-K189 WeakPolarHBondContact OE1-CE 3.49Å; E146-K189 IonicContact OE1-NZ 2.7Å; E146-K189 PolarHBondContact OE1-NZ 2.71Å
147	G	93.7	Very high	94	Very high	9 Å²	9	39.4 Å²	39.4	9%	0.093	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-38.3	176.9	0	0	0	0	0	112.8	N143 G150 A151	N143-G147 PolarHBondContact O-N 3.02Å; G147-G150 PolarHBondContact O-N 2.86Å; G147-A151 PolarHBondContact O-N 2.89Å; G147-A151 VanDerWaalsContact O-N 3.08Å
148	A	96.1	Very high	93.5	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.6	-41.6	174.4	0	0	0	0	0	112.1	I99 L133 L136 L137 T144 C145 E146 A151 L152	I99-A148 HydrophobicContact CD1-CB 4.21Å; L133-A148 HydrophobicContact CD2-CB 4.3Å; L136-A148 HydrophobicContact CB-CB 3.83Å; L137-A148 HydrophobicContact CD2-CB 3.86Å; T144-A148 VanDerWaalsContact O-CB 3.28Å; T144-A148 WeakPolarHBondContact O-CB 3.32Å; T144-A148 PolarHBondContact O-N 3.42Å; C145-A148 PolarHBondContact O-N 3.33Å; E146-A148 VanDerWaalsContact C-N 3.34Å; E146-A148 PolarHBondContact O-N 2.99Å; A148-A151 PolarHBondContact O-N 3.42Å; A148-L152 WeakPolarHBondContact O-CB 3.29Å; A148-L152 VanDerWaalsContact O-CG 3.3Å; A148-L152 WeakPolarHBondContact O-CG 3.41Å; A148-L152 PolarHBondContact O-N 3.16Å
149	F	95.4	Very high	93.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-43.5	173.7	-106.9	-58.7	0	0	0	112.5	L137 C145 E146 A151 L152 Q153 F179 F182 I190 H193 A194	L137-F149 HydrophobicContact CD1-CE1 4.32Å; L137-F149 HydrophobicContact CD1-CE2 4.06Å; L137-F149 HydrophobicContact CD1-CZ 3.95Å; L137-F149 HydrophobicContact CD2-CB 4.27Å; L137-F149 HydrophobicContact CD2-CD1 4.36Å; L137-F149 HydrophobicContact CD2-CD2 3.39Å; L137-F149 HydrophobicContact CD2-CE2 3.68Å; L137-F149 HydrophobicContact CD2-CG 3.76Å; L137-F149 HydrophobicContact CD2-CZ 4.28Å; L137-F149 HydrophobicContact CG-CE2 4.38Å; C145-F149 PolarHBondContact O-N 2.95Å; E146-F149 PolarHBondContact O-N 3.2Å; F149-A151 VanDerWaalsContact C-N 3.33Å; F149-A151 PolarHBondContact O-N 2.98Å; F149-L152 PolarHBondContact O-N 3.17Å; F149-Q153 WeakPolarHBondContact O-CB 3.49Å; F149-Q153 PolarHBondContact O-N 2.94Å; F149-F179 AromaticContact CE1-CD1 3.74Å; F149-F179 HydrophobicContact CE1-CD1 3.74Å; F149-F179 HydrophobicContact CE1-CE1 4.12Å; F149-F179 HydrophobicContact CE1-CG 4.47Å; F149-F179 HydrophobicContact CZ-CD1 4.1Å; F149-F182 HydrophobicContact CE2-CB 3.94Å; F149-F182 AromaticContact CE2-CD1 3.83Å; F149-F182 HydrophobicContact CE2-CD1 3.83Å; F149-F182 AromaticContact CE2-CD2 3.92Å; F149-F182 HydrophobicContact CE2-CD2 3.92Å; F149-F182 HydrophobicContact CE2-CE1 4.31Å; F149-F182 HydrophobicContact CE2-CE2 4.42Å; F149-F182 AromaticContact CE2-CG 3.62Å; F149-F182 HydrophobicContact CE2-CG 3.62Å; F149-F182 HydrophobicContact CZ-CB 3.8Å; F149-F182 HydrophobicContact CZ-CD1 4.43Å; F149-F182 AromaticContact CZ-CD2 3.8Å; F149-F182 HydrophobicContact CZ-CD2 3.8Å; F149-F182 AromaticContact CZ-CG 3.76Å; F149-F182 HydrophobicContact CZ-CG 3.76Å; F149-I190 HydrophobicContact CD2-CG2 3.97Å; F149-I190 HydrophobicContact CE2-CG2 3.76Å; F149-H193 HydrophobicContact CB-CB 3.75Å; F149-H193 HydrophobicContact CD1-CB 3.65Å; F149-H193 HydrophobicContact CE1-CB 4.44Å; F149-H193 HydrophobicContact CG-CB 3.76Å; F149-A194 HydrophobicContact CE1-CB 4.08Å; F149-A194 HydrophobicContact CZ-CB 3.99Å
150	G	91.6	Very high	92.9	Very high	28 Å²	28	38 Å²	38	29%	0.289	20%	0.197	S	C	.	.	H	α-helix	trans	-60.2	-41.4	176.8	0	0	0	0	0	112.8	E146 G147 K154	E146-G150 PolarHBondContact O-N 3.25Å; G147-G150 PolarHBondContact O-N 2.86Å; G150-K154 PolarHBondContact O-N 3.37Å
151	A	93.4	Very high	92.6	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-65.9	-44.4	174.1	0	0	0	0	0	112.1	I99 I114 L133 G147 A148 F149 K154 I155	I99-A151 HydrophobicContact CD1-CB 4.15Å; I114-A151 HydrophobicContact CG2-CB 4.36Å; L133-A151 HydrophobicContact CD1-CB 4.29Å; L133-A151 HydrophobicContact CD2-CB 4.3Å; G147-A151 PolarHBondContact O-N 2.89Å; G147-A151 VanDerWaalsContact O-N 3.08Å; A148-A151 PolarHBondContact O-N 3.42Å; F149-A151 VanDerWaalsContact C-N 3.33Å; F149-A151 PolarHBondContact O-N 2.98Å; A151-K154 PolarHBondContact O-N 3.29Å; A151-I155 WeakPolarHBondContact O-CD1 3.32Å; A151-I155 VanDerWaalsContact O-CG1 3.25Å; A151-I155 WeakPolarHBondContact O-CG1 3.32Å; A151-I155 PolarHBondContact O-N 3.29Å
152	L	95.5	Very high	92.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-42.9	178.7	-76.4	168.2	0	0	0	112.3	L130 L133 L137 A148 F149 K154 I155 C156 M175 F179	L130-L152 HydrophobicContact CD2-CD2 4.2Å; L133-L152 HydrophobicContact CB-CD1 4.01Å; L133-L152 HydrophobicContact CB-CD2 3.8Å; L133-L152 HydrophobicContact CB-CG 3.85Å; L133-L152 HydrophobicContact CD1-CD2 3.84Å; L133-L152 HydrophobicContact CD1-CG 4.04Å; L133-L152 HydrophobicContact CG-CD2 4.49Å; L137-L152 HydrophobicContact CD1-CD1 3.82Å; L137-L152 HydrophobicContact CD2-CD1 4.1Å; L137-L152 HydrophobicContact CG-CD1 4.07Å; A148-L152 WeakPolarHBondContact O-CB 3.29Å; A148-L152 VanDerWaalsContact O-CG 3.3Å; A148-L152 WeakPolarHBondContact O-CG 3.41Å; A148-L152 PolarHBondContact O-N 3.16Å; F149-L152 PolarHBondContact O-N 3.17Å; L152-K154 VanDerWaalsContact C-N 3.32Å; L152-K154 PolarHBondContact O-N 2.99Å; L152-I155 PolarHBondContact O-N 3.01Å; L152-C156 PolarHBondContact O-N 3.22Å; L152-C156 PolarHBondContact O-SG 3.36Å; L152-M175 HydrophobicContact CD2-CE 4Å; L152-F179 HydrophobicContact CD1-CE1 4.04Å; L152-F179 HydrophobicContact CD1-CZ 4.4Å
153	Q	93.9	Very high	91.8	Very high	41 Å²	41	32.4 Å²	32.4	19%	0.192	17%	0.174	C	C	.	.	H	α-helix	trans	-56.3	-50.2	176.2	-179.1	-173.1	-18.9	0	0	110.2	F149 I155 C156 E157 H193 A196 C197	F149-Q153 WeakPolarHBondContact O-CB 3.49Å; F149-Q153 PolarHBondContact O-N 2.94Å; Q153-I155 VanDerWaalsContact C-N 3.32Å; Q153-I155 PolarHBondContact O-N 3.36Å; Q153-C156 WeakPolarHBondContact O-CB 3.33Å; Q153-C156 PolarHBondContact O-N 2.98Å; Q153-E157 WeakPolarHBondContact CG-OE1 3.45Å; Q153-E157 PolarHBondContact NE2-OE1 3.19Å; Q153-E157 WeakPolarHBondContact O-CG 3.28Å; Q153-E157 PolarHBondContact O-N 2.97Å; Q153-H193 PolarHBondContact OE1-CE1 3.04Å; Q153-H193 PolarHBondContact OE1-ND1 3.01Å; Q153-A196 HydrophobicContact CG-CB 4.22Å; Q153-C197 WeakPolarHBondContact CA-SG 3.21Å
154	K	89.9	Confident	91.2	Very high	77 Å²	77	33.3 Å²	33.3	34%	0.335	18%	0.179	S	C	.	.	H	α-helix	trans	-66.9	-34.2	-177.9	-170.8	52.2	172.8	160.1	0	112.9	T115 G150 A151 L152 C156 E157 D158	T115-K154 HydrophobicContact CG2-CB 3.54Å; T115-K154 HydrophobicContact CG2-CG 3.58Å; G150-K154 PolarHBondContact O-N 3.37Å; A151-K154 PolarHBondContact O-N 3.29Å; L152-K154 VanDerWaalsContact C-N 3.32Å; L152-K154 PolarHBondContact O-N 2.99Å; K154-C156 VanDerWaalsContact C-N 3.34Å; K154-E157 HydrophobicContact CD-CB 4.47Å; K154-E157 WeakPolarHBondContact CD-OE2 3.36Å; K154-E157 IonicContact NZ-OE2 2.65Å; K154-E157 PolarHBondContact NZ-OE2 3.19Å; K154-E157 VanDerWaalsContact NZ-OE2 3.12Å; K154-E157 PolarHBondContact O-N 2.95Å; K154-D158 VanDerWaalsContact CE-OD1 3.24Å; K154-D158 WeakPolarHBondContact CE-OD1 3.4Å; K154-D158 VanDerWaalsContact CE-OD2 3.25Å; K154-D158 WeakPolarHBondContact CE-OD2 3.45Å; K154-D158 IonicContact NZ-OD1 3.93Å; K154-D158 PolarHBondContact NZ-OD1 3.26Å; K154-D158 IonicContact NZ-OD2 3.85Å; K154-D158 WeakPolarHBondContact O-CB 3.26Å; K154-D158 VanDerWaalsContact O-CG 3.32Å; K154-D158 PolarHBondContact O-N 3.04Å
155	I	92.9	Very high	90.5	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-65.5	-38.2	171.2	-67.6	163.7	0	0	0	111.2	T115 A118 L123 L129 L130 L133 A151 L152 Q153 S159 L163	T115-I155 HydrophobicContact CG2-CG1 4.33Å; A118-I155 HydrophobicContact CB-CG1 4.46Å; L123-I155 HydrophobicContact CD1-CG2 4.09Å; L123-I155 HydrophobicContact CD2-CG2 4.19Å; L129-I155 HydrophobicContact CD2-CD1 3.99Å; L130-I155 HydrophobicContact CD2-CD1 4.48Å; L130-I155 HydrophobicContact CD2-CG2 4.11Å; L133-I155 HydrophobicContact CD1-CD1 3.79Å; A151-I155 WeakPolarHBondContact O-CD1 3.32Å; A151-I155 VanDerWaalsContact O-CG1 3.25Å; A151-I155 WeakPolarHBondContact O-CG1 3.32Å; A151-I155 PolarHBondContact O-N 3.29Å; L152-I155 PolarHBondContact O-N 3.01Å; Q153-I155 VanDerWaalsContact C-N 3.32Å; Q153-I155 PolarHBondContact O-N 3.36Å; I155-S159 WeakPolarHBondContact O-CA 3.44Å; I155-S159 VanDerWaalsContact O-CB 3.31Å; I155-S159 WeakPolarHBondContact O-CB 3.3Å; I155-S159 PolarHBondContact O-N 3.43Å; I155-L163 HydrophobicContact CG2-CD1 4.31Å
156	C	93.4	Very high	89.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.9	-41.5	176.2	-63.4	0	0	0	0	111.3	L152 Q153 K154 A160 Q200 F201	L152-C156 PolarHBondContact O-N 3.22Å; L152-C156 PolarHBondContact O-SG 3.36Å; Q153-C156 WeakPolarHBondContact O-CB 3.33Å; Q153-C156 PolarHBondContact O-N 2.98Å; K154-C156 VanDerWaalsContact C-N 3.34Å; C156-A160 WeakPolarHBondContact O-CA 3.42Å; C156-A160 WeakPolarHBondContact O-CB 3.26Å; C156-A160 PolarHBondContact O-N 2.97Å; C156-Q200 HydrophobicContact CB-CB 4.23Å; C156-Q200 HydrophobicContact CB-CG 3.82Å; C156-F201 HydrophobicContact CB-CE2 3.98Å; C156-F201 HydrophobicContact CB-CZ 3.81Å
157	E	89.9	Confident	89	Confident	72 Å²	72	44.8 Å²	44.8	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-48.2	175.3	-70.1	168.6	-169.4	0	0	112.1	Q153 K154 Q200	Q153-E157 WeakPolarHBondContact CG-OE1 3.45Å; Q153-E157 PolarHBondContact NE2-OE1 3.19Å; Q153-E157 WeakPolarHBondContact O-CG 3.28Å; Q153-E157 PolarHBondContact O-N 2.97Å; K154-E157 HydrophobicContact CD-CB 4.47Å; K154-E157 WeakPolarHBondContact CD-OE2 3.36Å; K154-E157 IonicContact NZ-OE2 2.65Å; K154-E157 PolarHBondContact NZ-OE2 3.19Å; K154-E157 VanDerWaalsContact NZ-OE2 3.12Å; K154-E157 PolarHBondContact O-N 2.95Å; E157-Q200 HydrophobicContact CG-CG 4.39Å
158	D	86.3	Confident	88.4	Confident	78 Å²	78	46.2 Å²	46.2	42%	0.417	24%	0.244	S	C	.	.	H	α-helix	trans	-86.4	-10.5	-171.4	-63.5	-13.6	0	0	0	113.2	K154	K154-D158 VanDerWaalsContact CE-OD1 3.24Å; K154-D158 WeakPolarHBondContact CE-OD1 3.4Å; K154-D158 VanDerWaalsContact CE-OD2 3.25Å; K154-D158 WeakPolarHBondContact CE-OD2 3.45Å; K154-D158 IonicContact NZ-OD1 3.93Å; K154-D158 PolarHBondContact NZ-OD1 3.26Å; K154-D158 IonicContact NZ-OD2 3.85Å; K154-D158 WeakPolarHBondContact O-CB 3.26Å; K154-D158 VanDerWaalsContact O-CG 3.32Å; K154-D158 PolarHBondContact O-N 3.04Å
159	S	88.9	Confident	87.9	Confident	12 Å²	12	53.2 Å²	53.2	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-146.2	28.4	-170.8	-58.4	0	0	0	0	114.2	I155 E161 I162 L163	I155-S159 WeakPolarHBondContact O-CA 3.44Å; I155-S159 VanDerWaalsContact O-CB 3.31Å; I155-S159 WeakPolarHBondContact O-CB 3.3Å; I155-S159 PolarHBondContact O-N 3.43Å; S159-E161 VanDerWaalsContact C-N 3.33Å; S159-E161 PolarHBondContact O-N 2.98Å; S159-I162 PolarHBondContact O-N 2.83Å; S159-L163 VanDerWaalsContact O-CG 3.31Å; S159-L163 WeakPolarHBondContact O-CG 3.43Å; S159-L163 PolarHBondContact O-N 3.15Å; S159-L163 VanDerWaalsContact O-N 3.1Å
160	A	87.9	Confident	87.5	Confident	26 Å²	26	58.9 Å²	58.9	22%	0.215	30%	0.303	C	S	.	.	H	α-helix	trans	-50.9	-48	-178.8	0	0	0	0	0	113.2	C156 I162 L163 D164 F201	C156-A160 WeakPolarHBondContact O-CA 3.42Å; C156-A160 WeakPolarHBondContact O-CB 3.26Å; C156-A160 PolarHBondContact O-N 2.97Å; A160-I162 PolarHBondContact O-N 3.37Å; A160-L163 PolarHBondContact O-N 3.01Å; A160-D164 PolarHBondContact O-N 2.96Å; A160-F201 HydrophobicContact CB-CE1 4.07Å
161	E	85.6	Confident	87.5	Confident	175 Å²	175	58.5 Å²	58.5	82%	0.818	30%	0.295	S	S	*	.	H	α-helix	trans	-62.4	-42.4	-179.2	-62.7	-177	173.2	0	0	112.8	S159 L163 D164 S165	S159-E161 VanDerWaalsContact C-N 3.33Å; S159-E161 PolarHBondContact O-N 2.98Å; E161-L163 VanDerWaalsContact C-N 3.29Å; E161-L163 PolarHBondContact O-N 3.25Å; E161-D164 PolarHBondContact O-N 3.33Å; E161-S165 PolarHBondContact O-N 2.67Å
162	I	86.2	Confident	87.5	Confident	74 Å²	74	58.5 Å²	58.5	38%	0.379	30%	0.295	S	S	.	.	H	α-helix	trans	-66.7	-37.3	-179.3	-57.7	173.5	0	0	0	109.9	S159 A160 D164 S165 L168	S159-I162 PolarHBondContact O-N 2.83Å; A160-I162 PolarHBondContact O-N 3.37Å; I162-D164 VanDerWaalsContact C-N 3.3Å; I162-D164 PolarHBondContact O-N 3.06Å; I162-S165 WeakPolarHBondContact O-CB 3.35Å; I162-S165 PolarHBondContact O-N 3.27Å; I162-S165 VanDerWaalsContact O-N 3.15Å; I162-S165 PolarHBondContact O-OG 3.11Å; I162-L168 HydrophobicContact CG2-CD1 3.79Å; I162-L168 HydrophobicContact CG2-CG 4.42Å
163	L	86.8	Confident	87.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-28.9	179.1	-67.1	171	0	0	0	113	L123 L130 I155 S159 A160 E161 S165 L168 P171 L172 F201	L123-L163 HydrophobicContact CD2-CD2 3.84Å; L130-L163 HydrophobicContact CD1-CD2 3.49Å; L130-L163 VanDerWaalsContact CD1-CD2 3.49Å; L130-L163 HydrophobicContact CD2-CD2 4.31Å; I155-L163 HydrophobicContact CG2-CD1 4.31Å; S159-L163 VanDerWaalsContact O-CG 3.31Å; S159-L163 WeakPolarHBondContact O-CG 3.43Å; S159-L163 PolarHBondContact O-N 3.15Å; S159-L163 VanDerWaalsContact O-N 3.1Å; A160-L163 PolarHBondContact O-N 3.01Å; E161-L163 VanDerWaalsContact C-N 3.29Å; E161-L163 PolarHBondContact O-N 3.25Å; L163-S165 VanDerWaalsContact C-N 3.33Å; L163-L168 HydrophobicContact CD2-CD1 4.48Å; L163-P171 HydrophobicContact CD2-CG 4.02Å; L163-P171 WeakPolarHBondContact O-CD 3.46Å; L163-L172 HydrophobicContact CB-CD1 3.93Å; L163-L172 HydrophobicContact CB-CD2 3.92Å; L163-L172 HydrophobicContact CB-CG 3.88Å; L163-L172 HydrophobicContact CD1-CD2 4.41Å; L163-L172 WeakPolarHBondContact O-CG 3.4Å; L163-F201 HydrophobicContact CB-CE1 4.29Å; L163-F201 HydrophobicContact CD1-CE1 4.2Å; L163-F201 HydrophobicContact CD1-CZ 3.79Å
164	D	82.1	Confident	87.4	Confident	59 Å²	59	65.2 Å²	65.2	32%	0.316	34%	0.335	S	S	.	.	H	α-helix	trans	-85.6	-8.4	174.8	-150.8	7.8	0	0	0	112.8	A160 E161 I162 L172 T206	A160-D164 PolarHBondContact O-N 2.96Å; E161-D164 PolarHBondContact O-N 3.33Å; I162-D164 VanDerWaalsContact C-N 3.3Å; I162-D164 PolarHBondContact O-N 3.06Å; D164-L172 HydrophobicContact CB-CD1 3.97Å; D164-T206 WeakPolarHBondContact OD1-CG2 3.23Å; D164-T206 WeakPolarHBondContact OD2-CA 3.47Å; D164-T206 WeakPolarHBondContact OD2-CB 3.49Å; D164-T206 PolarHBondContact OD2-OG1 2.92Å
165	S	80.9	Confident	87.7	Confident	28 Å²	28	61.7 Å²	61.7	20%	0.196	32%	0.32	C	S	.	.	S	Bend	trans	-76.5	152.4	-179.1	82.3	0	0	0	0	113.3	E161 I162 L163 M167	E161-S165 PolarHBondContact O-N 2.67Å; I162-S165 WeakPolarHBondContact O-CB 3.35Å; I162-S165 PolarHBondContact O-N 3.27Å; I162-S165 VanDerWaalsContact O-N 3.15Å; I162-S165 PolarHBondContact O-OG 3.11Å; L163-S165 VanDerWaalsContact C-N 3.33Å; S165-M167 PolarHBondContact O-N 3.19Å; S165-M167 WeakPolarHBondContact OG-CB 3.36Å; S165-M167 PolarHBondContact OG-N 3.21Å
166	D	78.9	Confident	87.9	Confident	110 Å²	110	61.5 Å²	61.5	59%	0.588	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-66.4	-12.3	172.6	-74.3	-28.6	0	0	0	113	L168 D169 R170	D166-L168 VanDerWaalsContact C-N 3.26Å; D166-L168 PolarHBondContact O-N 3.44Å; D166-D169 PolarHBondContact O-N 3.49Å; D166-R170 IonicContact OD1-CZ 3.3Å; D166-R170 IonicContact OD1-NE 3.52Å; D166-R170 PolarHBondContact OD1-NE 3.03Å; D166-R170 IonicContact OD1-NH2 3.33Å; D166-R170 PolarHBondContact OD1-NH2 2.76Å; D166-R170 IonicContact OD2-NH2 3.79Å
167	M	79.4	Confident	88	Confident	148 Å²	148	63.1 Å²	63.1	73%	0.729	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-65.1	-28.2	-175.7	-59.2	-161.8	-167.7	0	0	113.3	S165	S165-M167 PolarHBondContact O-N 3.19Å; S165-M167 WeakPolarHBondContact OG-CB 3.36Å; S165-M167 PolarHBondContact OG-N 3.21Å
168	L	81.6	Confident	88.4	Confident	38 Å²	38	61.2 Å²	61.2	20%	0.199	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-106.2	16.4	-178.6	-66.7	177.2	0	0	0	113.5	L123 Q124 I162 L163 D166 R170 P171	L123-L168 HydrophobicContact CB-CD1 4.08Å; L123-L168 HydrophobicContact CD2-CD1 3.73Å; Q124-L168 HydrophobicContact CB-CD2 4.2Å; I162-L168 HydrophobicContact CG2-CD1 3.79Å; I162-L168 HydrophobicContact CG2-CG 4.42Å; L163-L168 HydrophobicContact CD2-CD1 4.48Å; D166-L168 VanDerWaalsContact C-N 3.26Å; D166-L168 PolarHBondContact O-N 3.44Å; L168-R170 VanDerWaalsContact C-N 3.3Å; L168-R170 PolarHBondContact O-N 3.5Å; L168-P171 HydrophobicContact CB-CG 4.01Å; L168-P171 HydrophobicContact CD1-CG 4.44Å
169	D	85.9	Confident	88.9	Confident	148 Å²	148	57.5 Å²	57.5	79%	0.791	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	38.6	-175.1	-161.6	29.3	0	0	0	113	D166	D166-D169 PolarHBondContact O-N 3.49Å
170	R	85.6	Confident	89.3	Confident	119 Å²	119	57.5 Å²	57.5	45%	0.449	30%	0.3	S	S	.	.			trans	49.6	63.6	176.1	-58.2	-174.8	-177.4	-152.3	-8.7	114	D166 L168 L172 N173	D166-R170 IonicContact OD1-CZ 3.3Å; D166-R170 IonicContact OD1-NE 3.52Å; D166-R170 PolarHBondContact OD1-NE 3.03Å; D166-R170 IonicContact OD1-NH2 3.33Å; D166-R170 PolarHBondContact OD1-NH2 2.76Å; D166-R170 IonicContact OD2-NH2 3.79Å; L168-R170 VanDerWaalsContact C-N 3.3Å; L168-R170 PolarHBondContact O-N 3.5Å; R170-L172 PolarHBondContact O-N 3.07Å; R170-L172 VanDerWaalsContact O-N 3.11Å; R170-N173 VanDerWaalsContact CB-ND2 3.31Å; R170-N173 WeakPolarHBondContact CB-ND2 3.26Å; R170-N173 WeakPolarHBondContact O-CB 3.39Å; R170-N173 PolarHBondContact O-N 3.08Å; R170-N173 PolarHBondContact O-ND2 3.21Å
171	P	92.3	Very high	89.7	Confident	19 Å²	19	62.7 Å²	62.7	12%	0.123	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-26	-175.5	27	-36.4	0	0	0	113.4	L130 L163 L168 N173 V174 M175	L130-P171 HydrophobicContact CD1-CB 3.8Å; L130-P171 HydrophobicContact CD1-CG 3.89Å; L163-P171 HydrophobicContact CD2-CG 4.02Å; L163-P171 WeakPolarHBondContact O-CD 3.46Å; L168-P171 HydrophobicContact CB-CG 4.01Å; L168-P171 HydrophobicContact CD1-CG 4.44Å; P171-N173 PolarHBondContact O-N 3.38Å; P171-V174 PolarHBondContact O-N 3.41Å; P171-M175 HydrophobicContact CB-SD 3.92Å; P171-M175 WeakPolarHBondContact O-CG 3.35Å; P171-M175 PolarHBondContact O-N 2.83Å; P171-M175 VanDerWaalsContact O-N 3.13Å
172	L	94.1	Very high	90.2	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-26.2	179.3	-65.3	178.3	0	0	0	114	L163 D164 R170 V174 M175 I176 F201 T206 A208	L163-L172 HydrophobicContact CB-CD1 3.93Å; L163-L172 HydrophobicContact CB-CD2 3.92Å; L163-L172 HydrophobicContact CB-CG 3.88Å; L163-L172 HydrophobicContact CD1-CD2 4.41Å; L163-L172 WeakPolarHBondContact O-CG 3.4Å; D164-L172 HydrophobicContact CB-CD1 3.97Å; R170-L172 PolarHBondContact O-N 3.07Å; R170-L172 VanDerWaalsContact O-N 3.11Å; L172-V174 PolarHBondContact O-N 3.28Å; L172-V174 VanDerWaalsContact O-N 3.14Å; L172-M175 HydrophobicContact CD2-CE 4.48Å; L172-M175 HydrophobicContact CD2-SD 4.4Å; L172-M175 PolarHBondContact O-N 2.9Å; L172-I176 HydrophobicContact CB-CD1 4.06Å; L172-I176 HydrophobicContact CB-CG1 4.45Å; L172-I176 HydrophobicContact CD2-CD1 4.4Å; L172-I176 HydrophobicContact CD2-CG1 4.41Å; L172-I176 PolarHBondContact O-N 3.09Å; L172-I176 VanDerWaalsContact O-N 3.09Å; L172-F201 HydrophobicContact CD1-CD1 3.68Å; L172-F201 HydrophobicContact CD1-CE1 3.59Å; L172-F201 HydrophobicContact CD1-CG 4.37Å; L172-F201 HydrophobicContact CD1-CZ 4.23Å; L172-F201 HydrophobicContact CD2-CD1 4.3Å; L172-F201 HydrophobicContact CD2-CD2 4.36Å; L172-F201 HydrophobicContact CD2-CE1 3.72Å; L172-F201 HydrophobicContact CD2-CE2 3.79Å; L172-F201 HydrophobicContact CD2-CZ 3.45Å; L172-F201 VanDerWaalsContact CD2-CZ 3.45Å; L172-F201 HydrophobicContact CG-CE1 4.31Å; L172-F201 HydrophobicContact CG-CZ 4.5Å; L172-T206 HydrophobicContact CB-CG2 4.36Å; L172-T206 HydrophobicContact CD1-CG2 3.55Å; L172-A208 HydrophobicContact CB-CB 4.13Å
173	N	93.5	Very high	90.7	Very high	81 Å²	81	52 Å²	52	43%	0.433	27%	0.267	S	S	.	.	H	α-helix	trans	-60.2	-23.7	174.8	-70.7	-30.5	0	0	0	112.8	R170 P171 P177	R170-N173 VanDerWaalsContact CB-ND2 3.31Å; R170-N173 WeakPolarHBondContact CB-ND2 3.26Å; R170-N173 WeakPolarHBondContact O-CB 3.39Å; R170-N173 PolarHBondContact O-N 3.08Å; R170-N173 PolarHBondContact O-ND2 3.21Å; P171-N173 PolarHBondContact O-N 3.38Å; N173-P177 WeakPolarHBondContact O-CG 3.37Å
174	V	93.9	Very high	91.1	Very high	100 Å²	100	59.5 Å²	59.5	61%	0.606	30%	0.3	S	S	*	.	H	α-helix	trans	-102.5	-41.1	177.7	-178.2	0	0	0	0	111	P171 L172 K178	P171-V174 PolarHBondContact O-N 3.41Å; L172-V174 PolarHBondContact O-N 3.28Å; L172-V174 VanDerWaalsContact O-N 3.14Å; V174-K178 WeakPolarHBondContact O-CB 3.3Å; V174-K178 PolarHBondContact O-N 3.36Å
175	M	96.3	Very high	91.8	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.015	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-48.3	-174.5	-67.5	169.2	60.8	0	0	112.5	L130 L152 P171 L172 K178 F179	L130-M175 HydrophobicContact CB-SD 4.5Å; L130-M175 HydrophobicContact CD1-SD 4.19Å; L130-M175 HydrophobicContact CD2-CE 4.35Å; L130-M175 HydrophobicContact CD2-SD 4.43Å; L152-M175 HydrophobicContact CD2-CE 4Å; P171-M175 HydrophobicContact CB-SD 3.92Å; P171-M175 WeakPolarHBondContact O-CG 3.35Å; P171-M175 PolarHBondContact O-N 2.83Å; P171-M175 VanDerWaalsContact O-N 3.13Å; L172-M175 HydrophobicContact CD2-CE 4.48Å; L172-M175 HydrophobicContact CD2-SD 4.4Å; L172-M175 PolarHBondContact O-N 2.9Å; M175-K178 WeakPolarHBondContact O-CA 3.45Å; M175-K178 WeakPolarHBondContact O-CB 3.42Å; M175-K178 PolarHBondContact O-N 3.17Å; M175-K178 VanDerWaalsContact O-N 3.11Å; M175-F179 HydrophobicContact CB-CE1 4.48Å; M175-F179 HydrophobicContact CB-CE2 3.89Å; M175-F179 HydrophobicContact CB-CZ 3.85Å; M175-F179 HydrophobicContact CE-CE2 4.15Å; M175-F179 HydrophobicContact CE-CZ 3.74Å; M175-F179 HydrophobicContact CG-CZ 4.45Å; M175-F179 WeakPolarHBondContact O-CD1 3.43Å; M175-F179 WeakPolarHBondContact O-CD2 3.25Å; M175-F179 VanDerWaalsContact O-CG 3.25Å; M175-F179 WeakPolarHBondContact O-CG 3.4Å; M175-F179 PolarHBondContact O-N 3.01Å
176	I	96.4	Very high	92.4	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-63	-51.3	-174.5	-69.2	174.2	0	0	0	112	L172 K178 F179 L180 F201 T206 A208 L209	L172-I176 HydrophobicContact CB-CD1 4.06Å; L172-I176 HydrophobicContact CB-CG1 4.45Å; L172-I176 HydrophobicContact CD2-CD1 4.4Å; L172-I176 HydrophobicContact CD2-CG1 4.41Å; L172-I176 PolarHBondContact O-N 3.09Å; L172-I176 VanDerWaalsContact O-N 3.09Å; I176-K178 PolarHBondContact O-N 3.47Å; I176-K178 VanDerWaalsContact O-N 3.13Å; I176-F179 PolarHBondContact O-N 3.05Å; I176-F179 VanDerWaalsContact O-N 3.14Å; I176-L180 WeakPolarHBondContact O-CG 3.47Å; I176-L180 PolarHBondContact O-N 2.86Å; I176-L180 VanDerWaalsContact O-N 3.13Å; I176-F201 HydrophobicContact CD1-CB 4.33Å; I176-F201 HydrophobicContact CD1-CD2 4.2Å; I176-F201 HydrophobicContact CD1-CG 4.33Å; I176-F201 HydrophobicContact CG1-CD2 4.46Å; I176-T206 HydrophobicContact CD1-CG2 4.19Å; I176-A208 HydrophobicContact CD1-CB 3.88Å; I176-L209 HydrophobicContact CD1-CB 4.05Å; I176-L209 HydrophobicContact CG2-CB 4.48Å; I176-L209 HydrophobicContact CG2-CD1 4.03Å
177	P	96.6	Very high	93.2	Very high	34 Å²	34	61.2 Å²	61.2	22%	0.221	31%	0.306	C	S	.	.	H	α-helix	trans	-58.2	-29.9	175.9	-25	34.7	0	0	0	113.1	N173	N173-P177 WeakPolarHBondContact O-CG 3.37Å
178	K	96.5	Very high	94	Very high	32 Å²	32	56 Å²	56	14%	0.139	28%	0.284	C	S	.	.	H	α-helix	trans	-72.6	-46	176.9	-171.2	147.6	-171.5	170.9	0	111.7	C134 D138 V174 M175 I176 L180 Q181 F182	C134-K178 VanDerWaalsContact O-CE 3.27Å; C134-K178 WeakPolarHBondContact O-CE 3.18Å; C134-K178 PolarHBondContact O-NZ 3.41Å; D138-K178 WeakPolarHBondContact OD1-CE 3.47Å; D138-K178 IonicContact OD1-NZ 2.89Å; D138-K178 PolarHBondContact OD1-NZ 3.08Å; D138-K178 IonicContact OD2-NZ 3.69Å; D138-K178 PolarHBondContact OD2-NZ 3.44Å; V174-K178 WeakPolarHBondContact O-CB 3.3Å; V174-K178 PolarHBondContact O-N 3.36Å; M175-K178 WeakPolarHBondContact O-CA 3.45Å; M175-K178 WeakPolarHBondContact O-CB 3.42Å; M175-K178 PolarHBondContact O-N 3.17Å; M175-K178 VanDerWaalsContact O-N 3.11Å; I176-K178 PolarHBondContact O-N 3.47Å; I176-K178 VanDerWaalsContact O-N 3.13Å; K178-L180 VanDerWaalsContact C-N 3.3Å; K178-L180 PolarHBondContact O-N 3.37Å; K178-Q181 WeakPolarHBondContact O-CB 3.39Å; K178-Q181 PolarHBondContact O-N 2.99Å; K178-Q181 VanDerWaalsContact O-N 3.1Å; K178-F182 HydrophobicContact CG-CE2 4.08Å; K178-F182 VanDerWaalsContact O-CD2 3.28Å; K178-F182 WeakPolarHBondContact O-CD2 3.37Å
179	F	97.8	Very high	94.7	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.1	-43.1	176.3	-59.5	-25.9	0	0	0	112.1	L137 F149 L152 M175 I176 Q181 F182 F183 C197 V198	L137-F179 HydrophobicContact CD1-CD1 4.26Å; L137-F179 HydrophobicContact CD1-CE1 4.04Å; F149-F179 AromaticContact CE1-CD1 3.74Å; F149-F179 HydrophobicContact CE1-CD1 3.74Å; F149-F179 HydrophobicContact CE1-CE1 4.12Å; F149-F179 HydrophobicContact CE1-CG 4.47Å; F149-F179 HydrophobicContact CZ-CD1 4.1Å; L152-F179 HydrophobicContact CD1-CE1 4.04Å; L152-F179 HydrophobicContact CD1-CZ 4.4Å; M175-F179 HydrophobicContact CB-CE1 4.48Å; M175-F179 HydrophobicContact CB-CE2 3.89Å; M175-F179 HydrophobicContact CB-CZ 3.85Å; M175-F179 HydrophobicContact CE-CE2 4.15Å; M175-F179 HydrophobicContact CE-CZ 3.74Å; M175-F179 HydrophobicContact CG-CZ 4.45Å; M175-F179 WeakPolarHBondContact O-CD1 3.43Å; M175-F179 WeakPolarHBondContact O-CD2 3.25Å; M175-F179 VanDerWaalsContact O-CG 3.25Å; M175-F179 WeakPolarHBondContact O-CG 3.4Å; M175-F179 PolarHBondContact O-N 3.01Å; I176-F179 PolarHBondContact O-N 3.05Å; I176-F179 VanDerWaalsContact O-N 3.14Å; F179-Q181 PolarHBondContact O-N 3.35Å; F179-Q181 VanDerWaalsContact O-N 3.09Å; F179-F182 PolarHBondContact O-N 3.05Å; F179-F183 WeakPolarHBondContact O-CD1 3.45Å; F179-C197 HydrophobicContact CD2-CB 3.7Å; F179-C197 HydrophobicContact CE2-CB 3.7Å; F179-C197 HydrophobicContact CG-CB 4.28Å; F179-C197 HydrophobicContact CZ-CB 4.28Å; F179-V198 HydrophobicContact CB-CG2 3.82Å; F179-V198 HydrophobicContact CD2-CG2 4.19Å
180	L	96.7	Very high	95.2	Very high	12 Å²	12	51.9 Å²	51.9	6%	0.063	26%	0.257	C	S	.	.	H	α-helix	trans	-56.7	-27.9	178.1	-65.8	178.5	0	0	0	113.6	I176 K178 F182 F183 V198 H212 F216	I176-L180 WeakPolarHBondContact O-CG 3.47Å; I176-L180 PolarHBondContact O-N 2.86Å; I176-L180 VanDerWaalsContact O-N 3.13Å; K178-L180 VanDerWaalsContact C-N 3.3Å; K178-L180 PolarHBondContact O-N 3.37Å; L180-F182 VanDerWaalsContact C-N 3.3Å; L180-F182 PolarHBondContact O-N 3.35Å; L180-F183 HydrophobicContact CD2-CE1 4.01Å; L180-F183 HydrophobicContact CD2-CE2 4.38Å; L180-F183 HydrophobicContact CD2-CZ 3.92Å; L180-F183 PolarHBondContact O-N 2.95Å; L180-V198 HydrophobicContact CD2-CG2 4.34Å; L180-H212 HydrophobicContact CD1-CB 3.97Å; L180-F216 HydrophobicContact CD2-CB 3.97Å; L180-F216 HydrophobicContact CD2-CD2 3.63Å; L180-F216 HydrophobicContact CD2-CG 4.21Å
181	Q	96.1	Very high	95.7	Very high	134 Å²	134	47.8 Å²	47.8	63%	0.626	24%	0.242	S	C	*	.	H	α-helix	trans	-68.7	-30.6	176.4	-62.7	170.3	19.5	0	0	112.1	K178 F179 F183	K178-Q181 WeakPolarHBondContact O-CB 3.39Å; K178-Q181 PolarHBondContact O-N 2.99Å; K178-Q181 VanDerWaalsContact O-N 3.1Å; F179-Q181 PolarHBondContact O-N 3.35Å; F179-Q181 VanDerWaalsContact O-N 3.09Å; Q181-F183 VanDerWaalsContact C-N 3.3Å; Q181-F183 PolarHBondContact O-N 3.37Å
182	F	97.3	Very high	95.9	Very high	23 Å²	23	47.4 Å²	47.4	10%	0.101	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-82.2	-4.4	-178.2	-70.8	-86	0	0	0	113.8	L137 F149 K178 F179 L180 K184 H185 I190 A194	L137-F182 HydrophobicContact CB-CE2 4.06Å; L137-F182 HydrophobicContact CB-CZ 3.81Å; L137-F182 HydrophobicContact CD1-CE2 4.27Å; L137-F182 WeakPolarHBondContact O-CZ 3.47Å; F149-F182 HydrophobicContact CE2-CB 3.94Å; F149-F182 AromaticContact CE2-CD1 3.83Å; F149-F182 HydrophobicContact CE2-CD1 3.83Å; F149-F182 AromaticContact CE2-CD2 3.92Å; F149-F182 HydrophobicContact CE2-CD2 3.92Å; F149-F182 HydrophobicContact CE2-CE1 4.31Å; F149-F182 HydrophobicContact CE2-CE2 4.42Å; F149-F182 AromaticContact CE2-CG 3.62Å; F149-F182 HydrophobicContact CE2-CG 3.62Å; F149-F182 HydrophobicContact CZ-CB 3.8Å; F149-F182 HydrophobicContact CZ-CD1 4.43Å; F149-F182 AromaticContact CZ-CD2 3.8Å; F149-F182 HydrophobicContact CZ-CD2 3.8Å; F149-F182 AromaticContact CZ-CG 3.76Å; F149-F182 HydrophobicContact CZ-CG 3.76Å; K178-F182 HydrophobicContact CG-CE2 4.08Å; K178-F182 VanDerWaalsContact O-CD2 3.28Å; K178-F182 WeakPolarHBondContact O-CD2 3.37Å; F179-F182 PolarHBondContact O-N 3.05Å; L180-F182 VanDerWaalsContact C-N 3.3Å; L180-F182 PolarHBondContact O-N 3.35Å; F182-K184 PolarHBondContact O-N 3.44Å; F182-H185 HydrophobicContact CD1-CB 4.46Å; F182-H185 WeakPolarHBondContact O-CB 3.23Å; F182-H185 PolarHBondContact O-N 2.93Å; F182-I190 HydrophobicContact CB-CG2 4.03Å; F182-I190 HydrophobicContact CD1-CG2 3.81Å; F182-I190 HydrophobicContact CG-CG2 4.3Å; F182-A194 HydrophobicContact CB-CB 3.9Å
183	F	97.1	Very high	96.1	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62.6	-26.9	172.1	-78.8	46.6	0	0	0	111	F179 L180 Q181 R191 A194 I195 V198 F216 N219 L220 L223	F179-F183 WeakPolarHBondContact O-CD1 3.45Å; L180-F183 HydrophobicContact CD2-CE1 4.01Å; L180-F183 HydrophobicContact CD2-CE2 4.38Å; L180-F183 HydrophobicContact CD2-CZ 3.92Å; L180-F183 PolarHBondContact O-N 2.95Å; Q181-F183 VanDerWaalsContact C-N 3.3Å; Q181-F183 PolarHBondContact O-N 3.37Å; F183-R191 WeakPolarHBondContact O-CD 3.39Å; F183-R191 WeakPolarHBondContact O-CG 3.44Å; F183-A194 HydrophobicContact CD1-CB 3.73Å; F183-A194 HydrophobicContact CE1-CB 3.8Å; F183-I195 HydrophobicContact CD2-CG1 3.97Å; F183-I195 HydrophobicContact CE1-CG1 4.15Å; F183-I195 HydrophobicContact CE2-CB 4.4Å; F183-I195 HydrophobicContact CE2-CG1 3.59Å; F183-I195 HydrophobicContact CG-CG1 4.44Å; F183-I195 HydrophobicContact CZ-CB 4.13Å; F183-I195 HydrophobicContact CZ-CG1 3.69Å; F183-I195 HydrophobicContact CZ-CG2 4.49Å; F183-V198 HydrophobicContact CE1-CG2 4.14Å; F183-V198 HydrophobicContact CZ-CB 4.39Å; F183-V198 HydrophobicContact CZ-CG2 4.17Å; F183-F216 AromaticContact CE2-CD2 3.85Å; F183-F216 HydrophobicContact CE2-CD2 3.85Å; F183-F216 AromaticContact CE2-CE2 3.74Å; F183-F216 HydrophobicContact CE2-CE2 3.74Å; F183-F216 AromaticContact CZ-CD2 3.92Å; F183-F216 HydrophobicContact CZ-CD2 3.92Å; F183-F216 AromaticContact CZ-CE2 3.71Å; F183-F216 HydrophobicContact CZ-CE2 3.71Å; F183-N219 HydrophobicContact CB-CB 4.05Å; F183-N219 HydrophobicContact CD2-CB 3.59Å; F183-N219 HydrophobicContact CE2-CB 4.36Å; F183-N219 HydrophobicContact CG-CB 4.11Å; F183-L220 HydrophobicContact CE2-CD2 4.09Å; F183-L223 HydrophobicContact CB-CD1 3.98Å; F183-L223 HydrophobicContact CD2-CD1 3.85Å; F183-L223 HydrophobicContact CG-CD1 4.2Å; F183-L223 WeakPolarHBondContact O-CD2 3.26Å
184	K	95	Very high	96.3	Very high	158 Å²	158	44.4 Å²	44.4	69%	0.687	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-94.6	11.6	177.4	-59.6	-178.3	-173.9	176.1	0	113.2	F182 N219	F182-K184 PolarHBondContact O-N 3.44Å; K184-N219 WeakPolarHBondContact CE-OD1 3.34Å
185	H	96.1	Very high	96.5	Very high	59 Å²	59	39.7 Å²	39.7	27%	0.273	19%	0.194	S	C	.	.			trans	-69.3	147.5	-177.4	-168.9	-93.4	0	0	0	111.5	F182 S187 I190 R191	F182-H185 HydrophobicContact CD1-CB 4.46Å; F182-H185 WeakPolarHBondContact O-CB 3.23Å; F182-H185 PolarHBondContact O-N 2.93Å; H185-S187 VanDerWaalsContact C-N 3.32Å; H185-S187 PolarHBondContact ND1-N 3.28Å; H185-S187 PolarHBondContact O-N 3.39Å; H185-I190 HydrophobicContact CB-CB 4.38Å; H185-I190 HydrophobicContact CB-CG2 3.82Å; H185-I190 WeakPolarHBondContact CE1-CD1 3.49Å; H185-R191 HydrophobicContact CB-CG 4.39Å; H185-R191 WeakPolarHBondContact O-CD 3.43Å; H185-R191 WeakPolarHBondContact O-CG 3.48Å; H185-R191 PolarHBondContact O-NH1 3.4Å
186	N	94.4	Very high	96.5	Very high	156 Å²	156	39.7 Å²	39.7	83%	0.834	20%	0.195	S	C	*	.	S	Bend	trans	-67.3	-31.5	-176.6	-66.4	-36	0	0	0	113	R191	N186-R191 PolarHBondContact O-NH1 3.43Å; N186-R191 VanDerWaalsContact O-NH1 3.08Å
187	S	95.8	Very high	96.5	Very high	18 Å²	18	39.7 Å²	39.7	13%	0.126	20%	0.195	C	C	.	.	S	Bend	trans	-82	124.7	177.3	174.4	0	0	0	0	111.6	Y142 H185 K189 I190 R191	Y142-S187 WeakPolarHBondContact CE2-OG 3.09Å; Y142-S187 PolarHBondContact OH-OG 3.44Å; H185-S187 VanDerWaalsContact C-N 3.32Å; H185-S187 PolarHBondContact ND1-N 3.28Å; H185-S187 PolarHBondContact O-N 3.39Å; S187-K189 VanDerWaalsContact C-N 3.26Å; S187-K189 PolarHBondContact O-N 2.97Å; S187-K189 PolarHBondContact OG-N 3.19Å; S187-I190 PolarHBondContact O-N 3Å; S187-R191 PolarHBondContact O-N 2.96Å
188	P	96	Very high	96.6	Very high	40 Å²	40	38.1 Å²	38.1	26%	0.26	18%	0.184	S	C	.	.	H	α-helix	trans	-61.8	-33.9	176.7	24.3	-32.5	0	0	0	112.7	I190 R191 S192 E228 V231	P188-I190 VanDerWaalsContact C-N 3.33Å; P188-I190 PolarHBondContact O-N 3.38Å; P188-R191 WeakPolarHBondContact O-CB 3.05Å; P188-R191 PolarHBondContact O-N 2.84Å; P188-S192 PolarHBondContact O-N 3.26Å; P188-E228 HydrophobicContact CB-CB 3.71Å; P188-E228 HydrophobicContact CB-CG 3.74Å; P188-E228 HydrophobicContact CG-CG 4.45Å; P188-V231 HydrophobicContact CB-CG2 4.22Å; P188-V231 WeakPolarHBondContact O-CG2 3.08Å
189	K	94.7	Very high	96.6	Very high	99 Å²	99	36.7 Å²	36.7	43%	0.43	18%	0.178	S	C	.	.	H	α-helix	trans	-62.8	-40.7	178.8	-164.8	173.4	-171.6	-172.5	0	112.3	E146 S187 S192 H193	E146-K189 HydrophobicContact CG-CD 4.07Å; E146-K189 WeakPolarHBondContact OE1-CE 3.49Å; E146-K189 IonicContact OE1-NZ 2.7Å; E146-K189 PolarHBondContact OE1-NZ 2.71Å; S187-K189 VanDerWaalsContact C-N 3.26Å; S187-K189 PolarHBondContact O-N 2.97Å; S187-K189 PolarHBondContact OG-N 3.19Å; K189-S192 PolarHBondContact O-N 2.71Å; K189-H193 PolarHBondContact O-CD2 3.48Å; K189-H193 PolarHBondContact O-N 2.74Å
190	I	96.4	Very high	96.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-38	176.4	-71	171	0	0	0	110.9	Y142 C145 F149 F182 H185 S187 P188 S192 H193 A194	Y142-I190 HydrophobicContact CD2-CD1 3.93Å; Y142-I190 HydrophobicContact CE2-CD1 3.66Å; Y142-I190 HydrophobicContact CE2-CG1 4.28Å; C145-I190 HydrophobicContact CB-CD1 4.42Å; F149-I190 HydrophobicContact CD2-CG2 3.97Å; F149-I190 HydrophobicContact CE2-CG2 3.76Å; F182-I190 HydrophobicContact CB-CG2 4.03Å; F182-I190 HydrophobicContact CD1-CG2 3.81Å; F182-I190 HydrophobicContact CG-CG2 4.3Å; H185-I190 HydrophobicContact CB-CB 4.38Å; H185-I190 HydrophobicContact CB-CG2 3.82Å; H185-I190 WeakPolarHBondContact CE1-CD1 3.49Å; S187-I190 PolarHBondContact O-N 3Å; P188-I190 VanDerWaalsContact C-N 3.33Å; P188-I190 PolarHBondContact O-N 3.38Å; I190-S192 VanDerWaalsContact C-N 3.35Å; I190-H193 PolarHBondContact O-N 3.49Å; I190-A194 WeakPolarHBondContact O-CB 3.32Å; I190-A194 PolarHBondContact O-N 3.27Å
191	R	97.4	Very high	96.5	Very high	33 Å²	33	38.2 Å²	38.2	13%	0.125	19%	0.185	C	C	.	.	H	α-helix	trans	-59.9	-46.6	173.2	-63.7	-164.1	-65.3	-82.4	4.9	111.1	F183 H185 N186 S187 P188 A194 I195 D226 V231	F183-R191 WeakPolarHBondContact O-CD 3.39Å; F183-R191 WeakPolarHBondContact O-CG 3.44Å; H185-R191 HydrophobicContact CB-CG 4.39Å; H185-R191 WeakPolarHBondContact O-CD 3.43Å; H185-R191 WeakPolarHBondContact O-CG 3.48Å; H185-R191 PolarHBondContact O-NH1 3.4Å; N186-R191 PolarHBondContact O-NH1 3.43Å; N186-R191 VanDerWaalsContact O-NH1 3.08Å; S187-R191 PolarHBondContact O-N 2.96Å; P188-R191 WeakPolarHBondContact O-CB 3.05Å; P188-R191 PolarHBondContact O-N 2.84Å; R191-A194 PolarHBondContact O-N 3.17Å; R191-I195 WeakPolarHBondContact O-CD1 3.33Å; R191-I195 VanDerWaalsContact O-CG1 3.3Å; R191-I195 WeakPolarHBondContact O-CG1 3.28Å; R191-I195 PolarHBondContact O-N 2.86Å; R191-D226 IonicContact CZ-OD2 3.67Å; R191-D226 IonicContact NE-OD2 3.5Å; R191-D226 PolarHBondContact NE-OD2 3.49Å; R191-D226 VanDerWaalsContact NH2-CG 3.31Å; R191-D226 IonicContact NH2-OD1 3.83Å; R191-D226 PolarHBondContact NH2-OD1 2.72Å; R191-D226 VanDerWaalsContact NH2-OD1 3.12Å; R191-D226 IonicContact NH2-OD2 3.54Å; R191-D226 PolarHBondContact NH2-OD2 2.95Å; R191-V231 HydrophobicContact CB-CG2 4.04Å
192	S	96.8	Very high	96.5	Very high	11 Å²	11	31.9 Å²	31.9	8%	0.077	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-52	176.3	172.3	0	0	0	0	111.7	P188 K189 I190 A194 I195 A196 N234	P188-S192 PolarHBondContact O-N 3.26Å; K189-S192 PolarHBondContact O-N 2.71Å; I190-S192 VanDerWaalsContact C-N 3.35Å; S192-A194 VanDerWaalsContact C-N 3.31Å; S192-A194 PolarHBondContact O-N 3.04Å; S192-I195 PolarHBondContact O-N 3.27Å; S192-A196 WeakPolarHBondContact O-CB 2.73Å; S192-A196 PolarHBondContact O-N 2.89Å; S192-N234 PolarHBondContact OG-ND2 2.69Å
193	H	96.6	Very high	96.3	Very high	20 Å²	20	34.6 Å²	34.6	9%	0.093	17%	0.17	C	C	.	.	H	α-helix	trans	-56.8	-42.7	175.8	-73.3	-52.5	0	0	0	112.8	F149 Q153 K189 I190 I195 A196 C197	F149-H193 HydrophobicContact CB-CB 3.75Å; F149-H193 HydrophobicContact CD1-CB 3.65Å; F149-H193 HydrophobicContact CE1-CB 4.44Å; F149-H193 HydrophobicContact CG-CB 3.76Å; Q153-H193 PolarHBondContact OE1-CE1 3.04Å; Q153-H193 PolarHBondContact OE1-ND1 3.01Å; K189-H193 PolarHBondContact O-CD2 3.48Å; K189-H193 PolarHBondContact O-N 2.74Å; I190-H193 PolarHBondContact O-N 3.49Å; H193-I195 PolarHBondContact O-N 2.84Å; H193-A196 PolarHBondContact O-N 2.9Å; H193-C197 WeakPolarHBondContact O-CB 3.44Å; H193-C197 PolarHBondContact O-N 3.25Å; H193-C197 PolarHBondContact O-SG 3.45Å
194	A	97.9	Very high	96.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-43.4	179.9	0	0	0	0	0	112.1	F149 F182 F183 I190 R191 S192 V198	F149-A194 HydrophobicContact CE1-CB 4.08Å; F149-A194 HydrophobicContact CZ-CB 3.99Å; F182-A194 HydrophobicContact CB-CB 3.9Å; F183-A194 HydrophobicContact CD1-CB 3.73Å; F183-A194 HydrophobicContact CE1-CB 3.8Å; I190-A194 WeakPolarHBondContact O-CB 3.32Å; I190-A194 PolarHBondContact O-N 3.27Å; R191-A194 PolarHBondContact O-N 3.17Å; S192-A194 VanDerWaalsContact C-N 3.31Å; S192-A194 PolarHBondContact O-N 3.04Å; A194-V198 WeakPolarHBondContact O-CG2 3.29Å; A194-V198 PolarHBondContact O-N 3.12Å
195	I	97.9	Very high	96	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.8	-47.9	176.6	-56	155.7	0	0	0	110.1	F183 R191 S192 H193 C197 V198 N199 L220 L223 V231 N234 V235 A238	F183-I195 HydrophobicContact CD2-CG1 3.97Å; F183-I195 HydrophobicContact CE1-CG1 4.15Å; F183-I195 HydrophobicContact CE2-CB 4.4Å; F183-I195 HydrophobicContact CE2-CG1 3.59Å; F183-I195 HydrophobicContact CG-CG1 4.44Å; F183-I195 HydrophobicContact CZ-CB 4.13Å; F183-I195 HydrophobicContact CZ-CG1 3.69Å; F183-I195 HydrophobicContact CZ-CG2 4.49Å; R191-I195 WeakPolarHBondContact O-CD1 3.33Å; R191-I195 VanDerWaalsContact O-CG1 3.3Å; R191-I195 WeakPolarHBondContact O-CG1 3.28Å; R191-I195 PolarHBondContact O-N 2.86Å; S192-I195 PolarHBondContact O-N 3.27Å; H193-I195 PolarHBondContact O-N 2.84Å; I195-C197 VanDerWaalsContact C-N 3.29Å; I195-C197 PolarHBondContact O-N 3.49Å; I195-V198 PolarHBondContact O-N 3.33Å; I195-N199 VanDerWaalsContact O-CG 3.32Å; I195-N199 PolarHBondContact O-N 3.48Å; I195-N199 PolarHBondContact O-OD1 3.08Å; I195-L220 HydrophobicContact CG2-CD2 4.22Å; I195-L223 HydrophobicContact CD1-CD1 3.83Å; I195-L223 HydrophobicContact CG1-CD1 4.34Å; I195-V231 HydrophobicContact CD1-CG1 3.86Å; I195-N234 HydrophobicContact CB-CB 3.94Å; I195-N234 HydrophobicContact CD1-CB 4.36Å; I195-N234 HydrophobicContact CG2-CB 3.68Å; I195-V235 HydrophobicContact CD1-CG2 3.96Å; I195-A238 HydrophobicContact CG2-CB 4.41Å
196	A	96.8	Very high	95.9	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.033	17%	0.173	C	C	.	.	H	α-helix	trans	-57.8	-39.7	-178.9	0	0	0	0	0	112.7	Q153 S192 H193 Q200	Q153-A196 HydrophobicContact CG-CB 4.22Å; S192-A196 WeakPolarHBondContact O-CB 2.73Å; S192-A196 PolarHBondContact O-N 2.89Å; H193-A196 PolarHBondContact O-N 2.9Å; A196-Q200 PolarHBondContact O-NE2 3.45Å
197	C	97.2	Very high	95.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-45.3	172.5	-73	0	0	0	0	112.2	Q153 F179 H193 I195 F201	Q153-C197 WeakPolarHBondContact CA-SG 3.21Å; F179-C197 HydrophobicContact CD2-CB 3.7Å; F179-C197 HydrophobicContact CE2-CB 3.7Å; F179-C197 HydrophobicContact CG-CB 4.28Å; F179-C197 HydrophobicContact CZ-CB 4.28Å; H193-C197 WeakPolarHBondContact O-CB 3.44Å; H193-C197 PolarHBondContact O-N 3.25Å; H193-C197 PolarHBondContact O-SG 3.45Å; I195-C197 VanDerWaalsContact C-N 3.29Å; I195-C197 PolarHBondContact O-N 3.49Å; C197-F201 WeakPolarHBondContact O-CD2 3.41Å; C197-F201 WeakPolarHBondContact O-CE2 3.36Å
198	V	97.7	Very high	95.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-69.2	-35.6	-178.3	175.6	0	0	0	0	111.3	F179 L180 F183 A194 I195 Q200 F201 L209 F216	F179-V198 HydrophobicContact CB-CG2 3.82Å; F179-V198 HydrophobicContact CD2-CG2 4.19Å; L180-V198 HydrophobicContact CD2-CG2 4.34Å; F183-V198 HydrophobicContact CE1-CG2 4.14Å; F183-V198 HydrophobicContact CZ-CB 4.39Å; F183-V198 HydrophobicContact CZ-CG2 4.17Å; A194-V198 WeakPolarHBondContact O-CG2 3.29Å; A194-V198 PolarHBondContact O-N 3.12Å; I195-V198 PolarHBondContact O-N 3.33Å; V198-Q200 PolarHBondContact O-N 2.87Å; V198-F201 PolarHBondContact O-N 2.99Å; V198-L209 HydrophobicContact CG1-CD1 3.66Å; V198-L209 HydrophobicContact CG1-CD2 4.06Å; V198-F216 HydrophobicContact CB-CE2 4.2Å; V198-F216 HydrophobicContact CG1-CD2 3.88Å; V198-F216 HydrophobicContact CG1-CE1 4.24Å; V198-F216 HydrophobicContact CG1-CE2 3.53Å; V198-F216 HydrophobicContact CG1-CG 4.37Å; V198-F216 HydrophobicContact CG1-CZ 3.71Å
199	N	97	Very high	95.7	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.011	14%	0.14	C	C	.	.	H	α-helix	trans	-57.3	-32.7	-179.6	-73.6	1.2	0	0	0	113.1	I195 F201 I202 N234 A238 M241	I195-N199 VanDerWaalsContact O-CG 3.32Å; I195-N199 PolarHBondContact O-N 3.48Å; I195-N199 PolarHBondContact O-OD1 3.08Å; N199-F201 PolarHBondContact O-N 3Å; N199-I202 HydrophobicContact CB-CD1 4.3Å; N199-I202 PolarHBondContact O-N 3.19Å; N199-N234 PolarHBondContact ND2-O 3.45Å; N199-N234 VanDerWaalsContact ND2-O 3.07Å; N199-A238 VanDerWaalsContact OD1-CB 3.22Å; N199-A238 WeakPolarHBondContact OD1-CB 3.22Å; N199-M241 HydrophobicContact CB-SD 4.12Å
200	Q	96.1	Very high	95.7	Very high	45 Å²	45	26.2 Å²	26.2	21%	0.21	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.2	178.3	-54.2	-51.3	-48.6	0	0	113.8	C156 E157 A196 V198	C156-Q200 HydrophobicContact CB-CB 4.23Å; C156-Q200 HydrophobicContact CB-CG 3.82Å; E157-Q200 HydrophobicContact CG-CG 4.39Å; A196-Q200 PolarHBondContact O-NE2 3.45Å; V198-Q200 PolarHBondContact O-N 2.87Å
201	F	96.2	Very high	95.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	9.1	-172.4	-52.4	-69.5	0	0	0	113.6	C156 A160 L163 L172 I176 C197 V198 N199 S204 T206 L209	C156-F201 HydrophobicContact CB-CE2 3.98Å; C156-F201 HydrophobicContact CB-CZ 3.81Å; A160-F201 HydrophobicContact CB-CE1 4.07Å; L163-F201 HydrophobicContact CB-CE1 4.29Å; L163-F201 HydrophobicContact CD1-CE1 4.2Å; L163-F201 HydrophobicContact CD1-CZ 3.79Å; L172-F201 HydrophobicContact CD1-CD1 3.68Å; L172-F201 HydrophobicContact CD1-CE1 3.59Å; L172-F201 HydrophobicContact CD1-CG 4.37Å; L172-F201 HydrophobicContact CD1-CZ 4.23Å; L172-F201 HydrophobicContact CD2-CD1 4.3Å; L172-F201 HydrophobicContact CD2-CD2 4.36Å; L172-F201 HydrophobicContact CD2-CE1 3.72Å; L172-F201 HydrophobicContact CD2-CE2 3.79Å; L172-F201 HydrophobicContact CD2-CZ 3.45Å; L172-F201 VanDerWaalsContact CD2-CZ 3.45Å; L172-F201 HydrophobicContact CG-CE1 4.31Å; L172-F201 HydrophobicContact CG-CZ 4.5Å; I176-F201 HydrophobicContact CD1-CB 4.33Å; I176-F201 HydrophobicContact CD1-CD2 4.2Å; I176-F201 HydrophobicContact CD1-CG 4.33Å; I176-F201 HydrophobicContact CG1-CD2 4.46Å; C197-F201 WeakPolarHBondContact O-CD2 3.41Å; C197-F201 WeakPolarHBondContact O-CE2 3.36Å; V198-F201 PolarHBondContact O-N 2.99Å; N199-F201 PolarHBondContact O-N 3Å; F201-S204 WeakPolarHBondContact CA-OG 3.36Å; F201-S204 PolarHBondContact O-OG 2.77Å; F201-T206 HydrophobicContact CB-CG2 4.44Å; F201-T206 PolarHBondContact O-N 3.42Å; F201-L209 HydrophobicContact CB-CD2 4.4Å
202	I	95.8	Very high	95.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-57.7	-179.7	-60.9	172.2	0	0	0	110.2	N199 S204 R205 L209 F216 A238 M241 L242 V245	N199-I202 HydrophobicContact CB-CD1 4.3Å; N199-I202 PolarHBondContact O-N 3.19Å; I202-S204 VanDerWaalsContact C-N 3.34Å; I202-S204 PolarHBondContact O-N 2.91Å; I202-R205 PolarHBondContact O-N 3.38Å; I202-L209 HydrophobicContact CB-CD2 4.43Å; I202-L209 HydrophobicContact CG1-CD2 3.76Å; I202-F216 HydrophobicContact CD1-CE1 3.84Å; I202-F216 HydrophobicContact CD1-CZ 3.9Å; I202-F216 HydrophobicContact CG1-CE1 4.18Å; I202-F216 HydrophobicContact CG1-CZ 4.49Å; I202-A238 HydrophobicContact CD1-CB 4.24Å; I202-M241 HydrophobicContact CB-CB 3.91Å; I202-M241 HydrophobicContact CB-SD 4.36Å; I202-M241 HydrophobicContact CD1-CB 3.96Å; I202-M241 HydrophobicContact CD1-SD 4.06Å; I202-M241 HydrophobicContact CG2-CB 3.56Å; I202-L242 HydrophobicContact CG2-CD2 4.04Å; I202-L242 HydrophobicContact CG2-CG 4.23Å; I202-V245 HydrophobicContact CG2-CG2 3.52Å
203	I	94	Very high	95.6	Very high	80 Å²	80	33.2 Å²	33.2	41%	0.41	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-39.1	-175.7	-58.8	-54	0	0	0	112	R205 M241 E244 V245	I203-R205 PolarHBondContact O-N 2.86Å; I203-M241 HydrophobicContact CD1-CB 3.77Å; I203-M241 HydrophobicContact CD1-CG 3.98Å; I203-M241 HydrophobicContact CG1-CB 4.33Å; I203-M241 HydrophobicContact CG1-CG 4.16Å; I203-E244 HydrophobicContact CD1-CB 4.47Å; I203-E244 VanDerWaalsContact CD1-OE2 3.23Å; I203-E244 WeakPolarHBondContact CD1-OE2 3.41Å; I203-V245 HydrophobicContact CD1-CG1 4.17Å
204	S	91.8	Very high	95.5	Very high	66 Å²	66	35.5 Å²	35.5	46%	0.462	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-10.5	175.8	59.7	0	0	0	0	114	F201 I202 T206	F201-S204 WeakPolarHBondContact CA-OG 3.36Å; F201-S204 PolarHBondContact O-OG 2.77Å; I202-S204 VanDerWaalsContact C-N 3.34Å; I202-S204 PolarHBondContact O-N 2.91Å; S204-T206 PolarHBondContact O-N 2.92Å; S204-T206 PolarHBondContact OG-OG1 2.86Å
205	R	93.9	Very high	95.4	Very high	147 Å²	147	38 Å²	38	56%	0.555	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	36.2	-175.3	-53.3	-177.7	-175.9	-151.4	-2.7	112.9	I202 I203 Q207 M210 V245	I202-R205 PolarHBondContact O-N 3.38Å; I203-R205 PolarHBondContact O-N 2.86Å; R205-Q207 PolarHBondContact O-N 3.25Å; R205-M210 HydrophobicContact CB-CE 4.31Å; R205-M210 HydrophobicContact CB-CG 4.42Å; R205-M210 WeakPolarHBondContact O-CG 3.43Å; R205-V245 HydrophobicContact CG-CB 4.16Å; R205-V245 HydrophobicContact CG-CG1 4.06Å
206	T	92.9	Very high	95.4	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.192	C	C	.	.			trans	-51.4	128.5	-177.3	-68.5	0	0	0	0	110.8	D164 L172 I176 F201 S204 A208 L209 M210	D164-T206 WeakPolarHBondContact OD1-CG2 3.23Å; D164-T206 WeakPolarHBondContact OD2-CA 3.47Å; D164-T206 WeakPolarHBondContact OD2-CB 3.49Å; D164-T206 PolarHBondContact OD2-OG1 2.92Å; L172-T206 HydrophobicContact CB-CG2 4.36Å; L172-T206 HydrophobicContact CD1-CG2 3.55Å; I176-T206 HydrophobicContact CD1-CG2 4.19Å; F201-T206 HydrophobicContact CB-CG2 4.44Å; F201-T206 PolarHBondContact O-N 3.42Å; S204-T206 PolarHBondContact O-N 2.92Å; S204-T206 PolarHBondContact OG-OG1 2.86Å; T206-A208 VanDerWaalsContact C-N 3.25Å; T206-A208 HydrophobicContact CG2-CB 4.23Å; T206-A208 PolarHBondContact O-N 3.22Å; T206-A208 VanDerWaalsContact O-N 3.16Å; T206-L209 PolarHBondContact O-N 3.44Å; T206-M210 WeakPolarHBondContact O-CG 3.14Å; T206-M210 PolarHBondContact O-N 3.18Å
207	Q	92.6	Very high	95.3	Very high	108 Å²	108	38.3 Å²	38.3	51%	0.505	19%	0.193	S	C	.	.	H	α-helix	trans	-56.6	-39	-171.4	-175.6	62.4	24.4	0	0	112.8	R205 L209 M210 L211	R205-Q207 PolarHBondContact O-N 3.25Å; Q207-L209 PolarHBondContact O-N 3.44Å; Q207-M210 PolarHBondContact O-N 3.07Å; Q207-L211 HydrophobicContact CG-CD1 4.35Å; Q207-L211 WeakPolarHBondContact O-CG 3.27Å; Q207-L211 PolarHBondContact O-N 3.1Å
208	A	94	Very high	95.2	Very high	4 Å²	4	44.9 Å²	44.9	3%	0.033	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-43	177.8	0	0	0	0	0	112.1	L172 I176 T206 H212	L172-A208 HydrophobicContact CB-CB 4.13Å; I176-A208 HydrophobicContact CD1-CB 3.88Å; T206-A208 VanDerWaalsContact C-N 3.25Å; T206-A208 HydrophobicContact CG2-CB 4.23Å; T206-A208 PolarHBondContact O-N 3.22Å; T206-A208 VanDerWaalsContact O-N 3.16Å; A208-H212 PolarHBondContact O-CD2 3.19Å
209	L	96	Very high	95.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69.3	-42.8	174.7	-175.3	54.4	0	0	0	111.6	I176 V198 F201 I202 T206 Q207 L211 H212 I213 F216	I176-L209 HydrophobicContact CD1-CB 4.05Å; I176-L209 HydrophobicContact CG2-CB 4.48Å; I176-L209 HydrophobicContact CG2-CD1 4.03Å; V198-L209 HydrophobicContact CG1-CD1 3.66Å; V198-L209 HydrophobicContact CG1-CD2 4.06Å; F201-L209 HydrophobicContact CB-CD2 4.4Å; I202-L209 HydrophobicContact CB-CD2 4.43Å; I202-L209 HydrophobicContact CG1-CD2 3.76Å; T206-L209 PolarHBondContact O-N 3.44Å; Q207-L209 PolarHBondContact O-N 3.44Å; L209-L211 PolarHBondContact O-N 3.08Å; L209-H212 CarbonylContact O-C 3.48Å; L209-H212 WeakPolarHBondContact O-CA 3.48Å; L209-H212 PolarHBondContact O-N 3.49Å; L209-I213 PolarHBondContact O-N 2.94Å; L209-F216 HydrophobicContact CD1-CB 4.27Å; L209-F216 HydrophobicContact CD1-CD1 4.1Å; L209-F216 HydrophobicContact CD1-CG 4.16Å
210	M	95.6	Very high	95.1	Very high	29 Å²	29	45.7 Å²	45.7	14%	0.143	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-31	-176.6	-67.2	-58	134	0	0	113.1	R205 T206 Q207 H212 I213 R246	R205-M210 HydrophobicContact CB-CE 4.31Å; R205-M210 HydrophobicContact CB-CG 4.42Å; R205-M210 WeakPolarHBondContact O-CG 3.43Å; T206-M210 WeakPolarHBondContact O-CG 3.14Å; T206-M210 PolarHBondContact O-N 3.18Å; Q207-M210 PolarHBondContact O-N 3.07Å; M210-H212 VanDerWaalsContact C-N 3.31Å; M210-I213 HydrophobicContact CE-CD1 4.33Å; M210-I213 HydrophobicContact SD-CD1 4.41Å; M210-R246 HydrophobicContact CE-CG 4.35Å; M210-R246 HydrophobicContact SD-CG 3.98Å
211	L	95.3	Very high	95	Very high	118 Å²	118	46.8 Å²	46.8	62%	0.618	23%	0.232	S	C	*	.	H	α-helix	trans	-72.5	-22.3	172	-68.5	174.4	0	0	0	113.5	Q207 L209	Q207-L211 HydrophobicContact CG-CD1 4.35Å; Q207-L211 WeakPolarHBondContact O-CG 3.27Å; Q207-L211 PolarHBondContact O-N 3.1Å; L209-L211 PolarHBondContact O-N 3.08Å
212	H	96.6	Very high	94.9	Very high	69 Å²	69	49.9 Å²	49.9	32%	0.319	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	21.2	-179	-67.4	-66.4	0	0	0	113	L180 A208 L209 M210 D214 P215 F216	L180-H212 HydrophobicContact CD1-CB 3.97Å; A208-H212 PolarHBondContact O-CD2 3.19Å; L209-H212 CarbonylContact O-C 3.48Å; L209-H212 WeakPolarHBondContact O-CA 3.48Å; L209-H212 PolarHBondContact O-N 3.49Å; M210-H212 VanDerWaalsContact C-N 3.31Å; H212-D214 PolarHBondContact O-N 3.46Å; H212-P215 VanDerWaalsContact O-CD 3.32Å; H212-P215 WeakPolarHBondContact O-CD 3.28Å; H212-F216 PolarHBondContact O-N 3.08Å; H212-F216 VanDerWaalsContact O-N 3.08Å
213	I	95.9	Very high	94.8	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-40.1	-173.8	-162.6	68.1	0	0	0	112.7	L209 M210 F216 I217 L242 R246	L209-I213 PolarHBondContact O-N 2.94Å; M210-I213 HydrophobicContact CE-CD1 4.33Å; M210-I213 HydrophobicContact SD-CD1 4.41Å; I213-F216 HydrophobicContact CD1-CD1 4.28Å; I213-F216 WeakPolarHBondContact O-CB 3.1Å; I213-F216 PolarHBondContact O-N 3.08Å; I213-I217 HydrophobicContact CG1-CD1 4.13Å; I213-I217 WeakPolarHBondContact O-CG1 3.3Å; I213-I217 PolarHBondContact O-N 3.11Å; I213-L242 HydrophobicContact CD1-CD2 3.62Å; I213-R246 HydrophobicContact CD1-CG 4.28Å; I213-R246 HydrophobicContact CG1-CG 4.39Å
214	D	94.3	Very high	94.7	Very high	69 Å²	69	47.6 Å²	47.6	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-68.6	-48.4	-177.5	-56.3	-32.4	0	0	0	110.7	H212 F216 I217 E218 R249	H212-D214 PolarHBondContact O-N 3.46Å; D214-F216 VanDerWaalsContact C-N 3.25Å; D214-F216 PolarHBondContact O-N 2.9Å; D214-I217 PolarHBondContact O-N 3.04Å; D214-E218 WeakPolarHBondContact O-CG 3.46Å; D214-E218 PolarHBondContact O-N 3.33Å; D214-R249 IonicContact OD1-CZ 3.1Å; D214-R249 IonicContact OD1-NE 2.7Å; D214-R249 PolarHBondContact OD1-NE 3.25Å; D214-R249 IonicContact OD1-NH2 3.1Å; D214-R249 PolarHBondContact OD1-NH2 2.99Å; D214-R249 VanDerWaalsContact OD1-NH2 3.14Å; D214-R249 IonicContact OD2-CZ 3.52Å; D214-R249 IonicContact OD2-NH2 2.83Å; D214-R249 PolarHBondContact OD2-NH2 2.87Å
215	P	95.9	Very high	94.6	Very high	53 Å²	53	50.4 Å²	50.4	34%	0.344	26%	0.263	S	S	.	.	H	α-helix	trans	-56.5	-34.8	169.5	-26.9	32.9	0	0	0	114.5	H212 N219	H212-P215 VanDerWaalsContact O-CD 3.32Å; H212-P215 WeakPolarHBondContact O-CD 3.28Å; P215-N219 PolarHBondContact O-N 2.89Å; P215-N219 VanDerWaalsContact O-N 3.14Å; P215-N219 PolarHBondContact O-ND2 3.1Å
216	F	97.1	Very high	94.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-51.3	177.7	174.8	-130.4	0	0	0	111.2	L180 F183 V198 I202 L209 H212 I213 D214 E218 N219 L220 A238 L242	L180-F216 HydrophobicContact CD2-CB 3.97Å; L180-F216 HydrophobicContact CD2-CD2 3.63Å; L180-F216 HydrophobicContact CD2-CG 4.21Å; F183-F216 AromaticContact CE2-CD2 3.85Å; F183-F216 HydrophobicContact CE2-CD2 3.85Å; F183-F216 AromaticContact CE2-CE2 3.74Å; F183-F216 HydrophobicContact CE2-CE2 3.74Å; F183-F216 AromaticContact CZ-CD2 3.92Å; F183-F216 HydrophobicContact CZ-CD2 3.92Å; F183-F216 AromaticContact CZ-CE2 3.71Å; F183-F216 HydrophobicContact CZ-CE2 3.71Å; V198-F216 HydrophobicContact CB-CE2 4.2Å; V198-F216 HydrophobicContact CG1-CD2 3.88Å; V198-F216 HydrophobicContact CG1-CE1 4.24Å; V198-F216 HydrophobicContact CG1-CE2 3.53Å; V198-F216 HydrophobicContact CG1-CG 4.37Å; V198-F216 HydrophobicContact CG1-CZ 3.71Å; I202-F216 HydrophobicContact CD1-CE1 3.84Å; I202-F216 HydrophobicContact CD1-CZ 3.9Å; I202-F216 HydrophobicContact CG1-CE1 4.18Å; I202-F216 HydrophobicContact CG1-CZ 4.49Å; L209-F216 HydrophobicContact CD1-CB 4.27Å; L209-F216 HydrophobicContact CD1-CD1 4.1Å; L209-F216 HydrophobicContact CD1-CG 4.16Å; H212-F216 PolarHBondContact O-N 3.08Å; H212-F216 VanDerWaalsContact O-N 3.08Å; I213-F216 HydrophobicContact CD1-CD1 4.28Å; I213-F216 WeakPolarHBondContact O-CB 3.1Å; I213-F216 PolarHBondContact O-N 3.08Å; D214-F216 VanDerWaalsContact C-N 3.25Å; D214-F216 PolarHBondContact O-N 2.9Å; F216-E218 PolarHBondContact O-N 3.41Å; F216-N219 PolarHBondContact O-N 2.97Å; F216-N219 VanDerWaalsContact O-N 3.15Å; F216-L220 HydrophobicContact CD1-CD1 4.28Å; F216-L220 HydrophobicContact CD2-CD1 4.35Å; F216-L220 HydrophobicContact CD2-CG 4.17Å; F216-L220 HydrophobicContact CE1-CD1 3.86Å; F216-L220 HydrophobicContact CE2-CD1 3.92Å; F216-L220 HydrophobicContact CE2-CD2 3.88Å; F216-L220 HydrophobicContact CE2-CG 3.85Å; F216-L220 HydrophobicContact CZ-CD1 3.68Å; F216-L220 HydrophobicContact CZ-CD2 4.2Å; F216-L220 HydrophobicContact CZ-CG 4.13Å; F216-L220 WeakPolarHBondContact O-CG 3.16Å; F216-L220 PolarHBondContact O-N 3.48Å; F216-A238 HydrophobicContact CZ-CB 4.02Å; F216-L242 HydrophobicContact CD1-CD1 4.14Å; F216-L242 HydrophobicContact CD1-CD2 4.37Å; F216-L242 HydrophobicContact CE1-CD1 3.77Å; F216-L242 HydrophobicContact CE1-CD2 4.16Å; F216-L242 HydrophobicContact CE1-CG 4.13Å
217	I	95.3	Very high	94.7	Very high	10 Å²	10	52.7 Å²	52.7	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-44.1	178.2	-67.9	168.7	0	0	0	111.3	I213 D214 N219 L220 F221 L242 R249 L250	I213-I217 HydrophobicContact CG1-CD1 4.13Å; I213-I217 WeakPolarHBondContact O-CG1 3.3Å; I213-I217 PolarHBondContact O-N 3.11Å; D214-I217 PolarHBondContact O-N 3.04Å; I217-N219 VanDerWaalsContact C-N 3.3Å; I217-N219 PolarHBondContact O-N 3.22Å; I217-L220 PolarHBondContact O-N 3.46Å; I217-F221 HydrophobicContact CG2-CD2 3.93Å; I217-F221 HydrophobicContact CG2-CE1 4.25Å; I217-F221 HydrophobicContact CG2-CE2 3.32Å; I217-F221 HydrophobicContact CG2-CZ 3.5Å; I217-F221 WeakPolarHBondContact O-CG 3.49Å; I217-F221 PolarHBondContact O-N 3.37Å; I217-L242 HydrophobicContact CG1-CD1 3.99Å; I217-R249 HydrophobicContact CD1-CB 3.55Å; I217-R249 HydrophobicContact CD1-CG 4.32Å; I217-L250 HydrophobicContact CD1-CD2 4.22Å
218	E	94.8	Very high	94.9	Very high	138 Å²	138	51.6 Å²	51.6	65%	0.645	28%	0.276	S	S	*	.	H	α-helix	trans	-58.3	-41.5	176.4	-74.1	179.2	-176.3	0	0	112.4	D214 F216 A222	D214-E218 WeakPolarHBondContact O-CG 3.46Å; D214-E218 PolarHBondContact O-N 3.33Å; F216-E218 PolarHBondContact O-N 3.41Å; E218-A222 PolarHBondContact O-N 3.34Å; E218-A222 VanDerWaalsContact O-N 3.14Å
219	N	95.9	Very high	95	Very high	19 Å²	19	53.1 Å²	53.1	10%	0.102	29%	0.285	C	S	.	.	H	α-helix	trans	-72.1	-34.4	177.9	-73.6	-56.2	0	0	0	112.5	F183 K184 P215 F216 I217 A222 L223	F183-N219 HydrophobicContact CB-CB 4.05Å; F183-N219 HydrophobicContact CD2-CB 3.59Å; F183-N219 HydrophobicContact CE2-CB 4.36Å; F183-N219 HydrophobicContact CG-CB 4.11Å; K184-N219 WeakPolarHBondContact CE-OD1 3.34Å; P215-N219 PolarHBondContact O-N 2.89Å; P215-N219 VanDerWaalsContact O-N 3.14Å; P215-N219 PolarHBondContact O-ND2 3.1Å; F216-N219 PolarHBondContact O-N 2.97Å; F216-N219 VanDerWaalsContact O-N 3.15Å; I217-N219 VanDerWaalsContact C-N 3.3Å; I217-N219 PolarHBondContact O-N 3.22Å; N219-A222 PolarHBondContact O-N 3.1Å; N219-L223 WeakPolarHBondContact O-CG 3.26Å; N219-L223 PolarHBondContact O-N 3.18Å
220	L	96.3	Very high	95	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-47.1	173.1	-71.3	176.7	0	0	0	111.1	F183 I195 F216 I217 A222 L223 A224 V235 A238 L239 L242	F183-L220 HydrophobicContact CE2-CD2 4.09Å; I195-L220 HydrophobicContact CG2-CD2 4.22Å; F216-L220 HydrophobicContact CD1-CD1 4.28Å; F216-L220 HydrophobicContact CD2-CD1 4.35Å; F216-L220 HydrophobicContact CD2-CG 4.17Å; F216-L220 HydrophobicContact CE1-CD1 3.86Å; F216-L220 HydrophobicContact CE2-CD1 3.92Å; F216-L220 HydrophobicContact CE2-CD2 3.88Å; F216-L220 HydrophobicContact CE2-CG 3.85Å; F216-L220 HydrophobicContact CZ-CD1 3.68Å; F216-L220 HydrophobicContact CZ-CD2 4.2Å; F216-L220 HydrophobicContact CZ-CG 4.13Å; F216-L220 WeakPolarHBondContact O-CG 3.16Å; F216-L220 PolarHBondContact O-N 3.48Å; I217-L220 PolarHBondContact O-N 3.46Å; L220-A222 VanDerWaalsContact C-N 3.28Å; L220-A222 PolarHBondContact O-N 3.26Å; L220-L223 CarbonylContact O-C 3.48Å; L220-L223 WeakPolarHBondContact O-CA 3.28Å; L220-L223 PolarHBondContact O-N 2.63Å; L220-A224 PolarHBondContact O-N 2.85Å; L220-A224 VanDerWaalsContact O-N 3.07Å; L220-V235 HydrophobicContact CD2-CG2 4.2Å; L220-A238 HydrophobicContact CD1-CB 3.79Å; L220-A238 HydrophobicContact CD2-CB 3.79Å; L220-A238 HydrophobicContact CG-CB 4.47Å; L220-L239 HydrophobicContact CD1-CD2 4.43Å; L220-L242 HydrophobicContact CD1-CD1 3.67Å
221	F	94.1	Very high	95.1	Very high	67 Å²	67	55.5 Å²	55.5	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-63.4	-34.6	177.6	-64.2	-25	0	0	0	112.7	I217 L223 A224 L239 H253 I257	I217-F221 HydrophobicContact CG2-CD2 3.93Å; I217-F221 HydrophobicContact CG2-CE1 4.25Å; I217-F221 HydrophobicContact CG2-CE2 3.32Å; I217-F221 HydrophobicContact CG2-CZ 3.5Å; I217-F221 WeakPolarHBondContact O-CG 3.49Å; I217-F221 PolarHBondContact O-N 3.37Å; F221-L223 PolarHBondContact O-N 3.27Å; F221-A224 WeakPolarHBondContact O-CB 3.46Å; F221-A224 PolarHBondContact O-N 2.66Å; F221-L239 HydrophobicContact CE1-CD2 4.1Å; F221-H253 HydrophobicContact CE2-CB 4.05Å; F221-H253 AromaticContact CE2-CD2 3.77Å; F221-H253 AromaticContact CE2-CG 3.72Å; F221-H253 HydrophobicContact CZ-CB 3.82Å; F221-I257 HydrophobicContact CE1-CD1 4.13Å; F221-I257 HydrophobicContact CE1-CG1 3.98Å; F221-I257 HydrophobicContact CZ-CD1 4.05Å; F221-I257 HydrophobicContact CZ-CG1 4.25Å
222	A	94	Very high	95.2	Very high	65 Å²	65	51.2 Å²	51.2	54%	0.537	27%	0.272	S	S	.	.	H	α-helix	trans	-64.9	-24.3	173.5	0	0	0	0	0	113.2	E218 N219 L220	E218-A222 PolarHBondContact O-N 3.34Å; E218-A222 VanDerWaalsContact O-N 3.14Å; N219-A222 PolarHBondContact O-N 3.1Å; L220-A222 VanDerWaalsContact C-N 3.28Å; L220-A222 PolarHBondContact O-N 3.26Å
223	L	95.5	Very high	95.2	Very high	15 Å²	15	50 Å²	50	8%	0.079	27%	0.266	C	S	.	.	H	α-helix	trans	-98.7	-1.9	178.8	-65.7	-179.8	0	0	0	114	F183 I195 N219 L220 F221 T225 D226 V231 V235	F183-L223 HydrophobicContact CB-CD1 3.98Å; F183-L223 HydrophobicContact CD2-CD1 3.85Å; F183-L223 HydrophobicContact CG-CD1 4.2Å; F183-L223 WeakPolarHBondContact O-CD2 3.26Å; I195-L223 HydrophobicContact CD1-CD1 3.83Å; I195-L223 HydrophobicContact CG1-CD1 4.34Å; N219-L223 WeakPolarHBondContact O-CG 3.26Å; N219-L223 PolarHBondContact O-N 3.18Å; L220-L223 CarbonylContact O-C 3.48Å; L220-L223 WeakPolarHBondContact O-CA 3.28Å; L220-L223 PolarHBondContact O-N 2.63Å; F221-L223 PolarHBondContact O-N 3.27Å; L223-T225 PolarHBondContact O-N 3.11Å; L223-T225 VanDerWaalsContact O-N 3.15Å; L223-D226 VanDerWaalsContact O-CB 3.26Å; L223-D226 WeakPolarHBondContact O-CB 3.37Å; L223-D226 PolarHBondContact O-N 3.05Å; L223-V231 HydrophobicContact CB-CG1 4.32Å; L223-V231 HydrophobicContact CD1-CG1 4.36Å; L223-V235 HydrophobicContact CB-CG2 3.99Å
224	A	90.4	Very high	95.3	Very high	18 Å²	18	50.3 Å²	50.3	15%	0.149	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.7	178.9	0	0	0	0	0	112.7	L220 F221 Y260	L220-A224 PolarHBondContact O-N 2.85Å; L220-A224 VanDerWaalsContact O-N 3.07Å; F221-A224 WeakPolarHBondContact O-CB 3.46Å; F221-A224 PolarHBondContact O-N 2.66Å; A224-Y260 HydrophobicContact CB-CD2 4.08Å; A224-Y260 HydrophobicContact CB-CE2 3.81Å; A224-Y260 WeakPolarHBondContact O-CE2 3.25Å
225	T	90.1	Very high	95.4	Very high	124 Å²	124	47 Å²	47	76%	0.761	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	14.1	178.8	63.8	0	0	0	0	113.7	L223	L223-T225 PolarHBondContact O-N 3.11Å; L223-T225 VanDerWaalsContact O-N 3.15Å
226	D	95.1	Very high	95.5	Very high	22 Å²	22	44.5 Å²	44.5	12%	0.118	23%	0.234	C	C	.	.			trans	-63.9	139.2	176.4	-155.3	-49.6	0	0	0	110.6	R191 L223 E228 V231 R232	R191-D226 IonicContact CZ-OD2 3.67Å; R191-D226 IonicContact NE-OD2 3.5Å; R191-D226 PolarHBondContact NE-OD2 3.49Å; R191-D226 VanDerWaalsContact NH2-CG 3.31Å; R191-D226 IonicContact NH2-OD1 3.83Å; R191-D226 PolarHBondContact NH2-OD1 2.72Å; R191-D226 VanDerWaalsContact NH2-OD1 3.12Å; R191-D226 IonicContact NH2-OD2 3.54Å; R191-D226 PolarHBondContact NH2-OD2 2.95Å; L223-D226 VanDerWaalsContact O-CB 3.26Å; L223-D226 WeakPolarHBondContact O-CB 3.37Å; L223-D226 PolarHBondContact O-N 3.05Å; D226-E228 PolarHBondContact OD1-N 3.49Å; D226-V231 HydrophobicContact CB-CB 4.17Å; D226-V231 HydrophobicContact CB-CG1 3.8Å; D226-R232 WeakPolarHBondContact O-CD 3.34Å; D226-R232 VanDerWaalsContact O-CG 3.26Å; D226-R232 WeakPolarHBondContact O-CG 3.44Å; D226-R232 PolarHBondContact O-NE 2.73Å
227	E	93.3	Very high	95.5	Very high	175 Å²	175	48.8 Å²	48.8	82%	0.818	25%	0.25	S	C	*	.			trans	-82.1	-23.5	-179.4	-65.1	-174.3	169.3	0	0	111.7	P229 R232	E227-P229 WeakPolarHBondContact O-CD 3.23Å; E227-R232 PolarHBondContact O-NE 3.45Å; E227-R232 PolarHBondContact O-NH2 3.38Å
228	E	96.9	Very high	95.7	Very high	84 Å²	84	48.3 Å²	48.3	39%	0.393	25%	0.247	S	C	.	.			trans	-70.1	124.7	-178.1	-172.1	72	-150.5	0	0	111.2	P188 D226 E230 V231 R232	P188-E228 HydrophobicContact CB-CB 3.71Å; P188-E228 HydrophobicContact CB-CG 3.74Å; P188-E228 HydrophobicContact CG-CG 4.45Å; D226-E228 PolarHBondContact OD1-N 3.49Å; E228-E230 HydrophobicContact CG-CB 4.36Å; E228-E230 PolarHBondContact O-N 2.73Å; E228-V231 HydrophobicContact CB-CB 4.25Å; E228-V231 HydrophobicContact CB-CG2 3.93Å; E228-V231 HydrophobicContact CG-CG2 4.23Å; E228-V231 PolarHBondContact O-N 3.47Å; E228-R232 PolarHBondContact O-N 3.19Å; E228-R232 VanDerWaalsContact O-N 3.13Å
229	P	96.2	Very high	95.8	Very high	36 Å²	36	42 Å²	42	23%	0.234	22%	0.218	C	C	.	.	H	α-helix	trans	-56.7	-45.3	178.5	-25.2	34.3	0	0	0	113.4	E227 V231 R232 K233 D269 V272	E227-P229 WeakPolarHBondContact O-CD 3.23Å; P229-V231 VanDerWaalsContact C-N 3.26Å; P229-V231 PolarHBondContact O-N 2.71Å; P229-R232 PolarHBondContact O-N 3.01Å; P229-R232 VanDerWaalsContact O-N 3.15Å; P229-K233 WeakPolarHBondContact O-CB 3.42Å; P229-K233 PolarHBondContact O-N 3.47Å; P229-D269 HydrophobicContact CB-CB 4.33Å; P229-V272 HydrophobicContact CB-CG2 4.02Å; P229-V272 WeakPolarHBondContact O-CG2 3.44Å
230	E	96.1	Very high	95.9	Very high	79 Å²	79	41.3 Å²	41.3	37%	0.369	21%	0.214	S	C	.	.	H	α-helix	trans	-63	-30.3	-179.7	-81.8	-60.9	137.5	0	0	113.6	E228 K233 N234	E228-E230 HydrophobicContact CG-CB 4.36Å; E228-E230 PolarHBondContact O-N 2.73Å; E230-K233 IonicContact OE1-NZ 3.12Å; E230-K233 PolarHBondContact OE1-NZ 3.12Å; E230-K233 VanDerWaalsContact OE2-CE 3.29Å; E230-K233 WeakPolarHBondContact OE2-CE 3.49Å; E230-K233 IonicContact OE2-NZ 2.74Å; E230-K233 PolarHBondContact OE2-NZ 3.04Å; E230-N234 PolarHBondContact O-N 3.34Å; E230-N234 PolarHBondContact O-ND2 3.06Å
231	V	97.7	Very high	96	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72.8	-49	174	178.8	0	0	0	0	109.5	P188 R191 I195 L223 D226 E228 P229 K233 N234 V235	P188-V231 HydrophobicContact CB-CG2 4.22Å; P188-V231 WeakPolarHBondContact O-CG2 3.08Å; R191-V231 HydrophobicContact CB-CG2 4.04Å; I195-V231 HydrophobicContact CD1-CG1 3.86Å; L223-V231 HydrophobicContact CB-CG1 4.32Å; L223-V231 HydrophobicContact CD1-CG1 4.36Å; D226-V231 HydrophobicContact CB-CB 4.17Å; D226-V231 HydrophobicContact CB-CG1 3.8Å; E228-V231 HydrophobicContact CB-CB 4.25Å; E228-V231 HydrophobicContact CB-CG2 3.93Å; E228-V231 HydrophobicContact CG-CG2 4.23Å; E228-V231 PolarHBondContact O-N 3.47Å; P229-V231 VanDerWaalsContact C-N 3.26Å; P229-V231 PolarHBondContact O-N 2.71Å; V231-K233 VanDerWaalsContact C-N 3.33Å; V231-K233 PolarHBondContact O-N 3.49Å; V231-N234 PolarHBondContact O-N 3.5Å; V231-V235 HydrophobicContact CG1-CG2 4.33Å; V231-V235 WeakPolarHBondContact O-CG2 3.23Å; V231-V235 PolarHBondContact O-N 3.45Å
232	R	97.1	Very high	96.1	Very high	29 Å²	29	39.4 Å²	39.4	11%	0.109	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-44.6	178.3	-74.3	-176.6	-79.8	156.1	-1	112.2	D226 E227 E228 P229 N234 V235 C236 D267 V272	D226-R232 WeakPolarHBondContact O-CD 3.34Å; D226-R232 VanDerWaalsContact O-CG 3.26Å; D226-R232 WeakPolarHBondContact O-CG 3.44Å; D226-R232 PolarHBondContact O-NE 2.73Å; E227-R232 PolarHBondContact O-NE 3.45Å; E227-R232 PolarHBondContact O-NH2 3.38Å; E228-R232 PolarHBondContact O-N 3.19Å; E228-R232 VanDerWaalsContact O-N 3.13Å; P229-R232 PolarHBondContact O-N 3.01Å; P229-R232 VanDerWaalsContact O-N 3.15Å; R232-N234 PolarHBondContact O-N 3.01Å; R232-V235 PolarHBondContact O-N 3.38Å; R232-C236 PolarHBondContact O-N 3.05Å; R232-C236 PolarHBondContact O-SG 3.5Å; R232-D267 IonicContact CZ-OD1 2.82Å; R232-D267 IonicContact CZ-OD2 3.96Å; R232-D267 IonicContact NH1-OD1 3.34Å; R232-D267 PolarHBondContact NH1-OD1 2.92Å; R232-D267 IonicContact NH1-OD2 3.79Å; R232-D267 PolarHBondContact NH1-OD2 3.4Å; R232-D267 IonicContact NH2-OD1 2.64Å; R232-V272 HydrophobicContact CB-CG1 3.99Å; R232-V272 HydrophobicContact CB-CG2 4.32Å
233	K	97	Very high	96.2	Very high	43 Å²	43	36.3 Å²	36.3	19%	0.187	18%	0.181	C	C	.	.	H	α-helix	trans	-53.1	-53.8	175.5	-167.3	-173.9	70.4	-171.3	0	111.5	P229 E230 V231 V235 C236 R237 N271 V272 E275	P229-K233 WeakPolarHBondContact O-CB 3.42Å; P229-K233 PolarHBondContact O-N 3.47Å; E230-K233 IonicContact OE1-NZ 3.12Å; E230-K233 PolarHBondContact OE1-NZ 3.12Å; E230-K233 VanDerWaalsContact OE2-CE 3.29Å; E230-K233 WeakPolarHBondContact OE2-CE 3.49Å; E230-K233 IonicContact OE2-NZ 2.74Å; E230-K233 PolarHBondContact OE2-NZ 3.04Å; V231-K233 VanDerWaalsContact C-N 3.33Å; V231-K233 PolarHBondContact O-N 3.49Å; K233-V235 VanDerWaalsContact C-N 3.32Å; K233-V235 PolarHBondContact O-N 3.28Å; K233-C236 WeakPolarHBondContact O-CB 3.5Å; K233-C236 PolarHBondContact O-N 3.44Å; K233-R237 PolarHBondContact O-N 3.23Å; K233-N271 HydrophobicContact CD-CB 4Å; K233-V272 HydrophobicContact CB-CG2 4.19Å; K233-E275 HydrophobicContact CD-CG 4.37Å; K233-E275 HydrophobicContact CG-CB 4.22Å; K233-E275 HydrophobicContact CG-CG 3.68Å
234	N	97.6	Very high	96.2	Very high	10 Å²	10	39.6 Å²	39.6	5%	0.053	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-31.4	179.7	-77.8	-61.6	0	0	0	113.3	S192 I195 N199 E230 V231 R232 A238	S192-N234 PolarHBondContact OG-ND2 2.69Å; I195-N234 HydrophobicContact CB-CB 3.94Å; I195-N234 HydrophobicContact CD1-CB 4.36Å; I195-N234 HydrophobicContact CG2-CB 3.68Å; N199-N234 PolarHBondContact ND2-O 3.45Å; N199-N234 VanDerWaalsContact ND2-O 3.07Å; E230-N234 PolarHBondContact O-N 3.34Å; E230-N234 PolarHBondContact O-ND2 3.06Å; V231-N234 PolarHBondContact O-N 3.5Å; R232-N234 PolarHBondContact O-N 3.01Å; N234-A238 VanDerWaalsContact O-CB 3.29Å; N234-A238 WeakPolarHBondContact O-CB 3.47Å; N234-A238 PolarHBondContact O-N 2.81Å
235	V	98.1	Very high	96.4	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-67	-44.2	172.4	171.7	0	0	0	0	110.9	I195 L220 L223 V231 R232 K233 A238 L239 Y260	I195-V235 HydrophobicContact CD1-CG2 3.96Å; L220-V235 HydrophobicContact CD2-CG2 4.2Å; L223-V235 HydrophobicContact CB-CG2 3.99Å; V231-V235 HydrophobicContact CG1-CG2 4.33Å; V231-V235 WeakPolarHBondContact O-CG2 3.23Å; V231-V235 PolarHBondContact O-N 3.45Å; R232-V235 PolarHBondContact O-N 3.38Å; K233-V235 VanDerWaalsContact C-N 3.32Å; K233-V235 PolarHBondContact O-N 3.28Å; V235-A238 PolarHBondContact O-N 3.2Å; V235-L239 HydrophobicContact CG1-CD1 4.19Å; V235-L239 WeakPolarHBondContact O-CG 3.4Å; V235-L239 PolarHBondContact O-N 3.31Å; V235-L239 VanDerWaalsContact O-N 3.09Å; V235-Y260 HydrophobicContact CG1-CE1 4.35Å
236	C	98.1	Very high	96.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.1	-54.3	175.8	-67.2	0	0	0	0	110.1	R232 K233 A238 L239 V240 M261 E275 A276	R232-C236 PolarHBondContact O-N 3.05Å; R232-C236 PolarHBondContact O-SG 3.5Å; K233-C236 WeakPolarHBondContact O-CB 3.5Å; K233-C236 PolarHBondContact O-N 3.44Å; C236-A238 VanDerWaalsContact C-N 3.29Å; C236-A238 PolarHBondContact O-N 3.29Å; C236-L239 WeakPolarHBondContact O-CB 3.5Å; C236-L239 PolarHBondContact O-N 3.37Å; C236-V240 WeakPolarHBondContact O-CG2 3.32Å; C236-V240 PolarHBondContact O-N 2.68Å; C236-M261 HydrophobicContact CB-SD 4.49Å; C236-E275 HydrophobicContact CB-CB 4.11Å; C236-A276 HydrophobicContact CB-CB 4.44Å
237	R	97.1	Very high	96.6	Very high	90 Å²	90	35.8 Å²	35.8	34%	0.34	17%	0.166	S	C	.	.	H	α-helix	trans	-54.2	-42.9	177	-165.4	171	175.6	-170.4	-3.1	113.4	K233 L239 V240 M241 E275	K233-R237 PolarHBondContact O-N 3.23Å; R237-L239 VanDerWaalsContact C-N 3.34Å; R237-L239 PolarHBondContact O-N 3.18Å; R237-V240 PolarHBondContact O-N 3.15Å; R237-M241 HydrophobicContact CG-CE 3.81Å; R237-M241 HydrophobicContact CG-SD 4.36Å; R237-M241 WeakPolarHBondContact O-CG 3.38Å; R237-M241 PolarHBondContact O-N 3.25Å; R237-E275 VanDerWaalsContact CB-OE2 3.23Å; R237-E275 WeakPolarHBondContact CB-OE2 3.39Å; R237-E275 WeakPolarHBondContact CD-OE2 3.26Å; R237-E275 VanDerWaalsContact CG-OE2 3.28Å; R237-E275 WeakPolarHBondContact CG-OE2 3.21Å
238	A	97.9	Very high	96.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-42.5	177.5	0	0	0	0	0	112.1	I195 N199 I202 F216 L220 N234 V235 C236 L242	I195-A238 HydrophobicContact CG2-CB 4.41Å; N199-A238 VanDerWaalsContact OD1-CB 3.22Å; N199-A238 WeakPolarHBondContact OD1-CB 3.22Å; I202-A238 HydrophobicContact CD1-CB 4.24Å; F216-A238 HydrophobicContact CZ-CB 4.02Å; L220-A238 HydrophobicContact CD1-CB 3.79Å; L220-A238 HydrophobicContact CD2-CB 3.79Å; L220-A238 HydrophobicContact CG-CB 4.47Å; N234-A238 VanDerWaalsContact O-CB 3.29Å; N234-A238 WeakPolarHBondContact O-CB 3.47Å; N234-A238 PolarHBondContact O-N 2.81Å; V235-A238 PolarHBondContact O-N 3.2Å; C236-A238 VanDerWaalsContact C-N 3.29Å; C236-A238 PolarHBondContact O-N 3.29Å; A238-L242 VanDerWaalsContact O-CB 3.31Å; A238-L242 WeakPolarHBondContact O-CB 3.34Å; A238-L242 WeakPolarHBondContact O-CG 3.28Å; A238-L242 PolarHBondContact O-N 3.44Å
239	L	98.1	Very high	96.5	Very high	4 Å²	4	32 Å²	32	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-69.9	-36.2	178.9	-71.9	171	0	0	0	112.1	L220 F221 V235 C236 R237 L242 L243 L250 Y260 M261	L220-L239 HydrophobicContact CD1-CD2 4.43Å; F221-L239 HydrophobicContact CE1-CD2 4.1Å; V235-L239 HydrophobicContact CG1-CD1 4.19Å; V235-L239 WeakPolarHBondContact O-CG 3.4Å; V235-L239 PolarHBondContact O-N 3.31Å; V235-L239 VanDerWaalsContact O-N 3.09Å; C236-L239 WeakPolarHBondContact O-CB 3.5Å; C236-L239 PolarHBondContact O-N 3.37Å; R237-L239 VanDerWaalsContact C-N 3.34Å; R237-L239 PolarHBondContact O-N 3.18Å; L239-L242 PolarHBondContact O-N 3.3Å; L239-L243 PolarHBondContact O-N 3.44Å; L239-L250 HydrophobicContact CD2-CD2 4.39Å; L239-Y260 HydrophobicContact CD1-CD1 4.09Å; L239-Y260 HydrophobicContact CD1-CE1 4.05Å; L239-M261 HydrophobicContact CB-CE 3.33Å; L239-M261 HydrophobicContact CD1-CE 3.62Å; L239-M261 HydrophobicContact CG-CE 4.12Å
240	V	97.7	Very high	96.4	Very high	6 Å²	6	30.3 Å²	30.3	4%	0.036	14%	0.135	C	C	.	.	H	α-helix	trans	-59.9	-55	172.2	177	0	0	0	0	110	C236 R237 L242 L243 E278 F279 T282	C236-V240 WeakPolarHBondContact O-CG2 3.32Å; C236-V240 PolarHBondContact O-N 2.68Å; R237-V240 PolarHBondContact O-N 3.15Å; V240-L242 VanDerWaalsContact C-N 3.3Å; V240-L242 PolarHBondContact O-N 3.28Å; V240-L243 WeakPolarHBondContact O-CB 3.25Å; V240-L243 PolarHBondContact O-N 3.28Å; V240-E278 HydrophobicContact CG1-CB 4.25Å; V240-E278 HydrophobicContact CG2-CB 4.29Å; V240-F279 HydrophobicContact CG2-CB 3.91Å; V240-T282 HydrophobicContact CG1-CG2 4.48Å; V240-T282 WeakPolarHBondContact CG1-OG1 3.12Å
241	M	97.3	Very high	96.4	Very high	27 Å²	27	30.2 Å²	30.2	13%	0.133	14%	0.137	C	C	.	.	H	α-helix	trans	-60.2	-39.1	178.7	-66.5	173.4	173.3	0	0	112.5	N199 I202 I203 R237 L243 E244 V245	N199-M241 HydrophobicContact CB-SD 4.12Å; I202-M241 HydrophobicContact CB-CB 3.91Å; I202-M241 HydrophobicContact CB-SD 4.36Å; I202-M241 HydrophobicContact CD1-CB 3.96Å; I202-M241 HydrophobicContact CD1-SD 4.06Å; I202-M241 HydrophobicContact CG2-CB 3.56Å; I203-M241 HydrophobicContact CD1-CB 3.77Å; I203-M241 HydrophobicContact CD1-CG 3.98Å; I203-M241 HydrophobicContact CG1-CB 4.33Å; I203-M241 HydrophobicContact CG1-CG 4.16Å; R237-M241 HydrophobicContact CG-CE 3.81Å; R237-M241 HydrophobicContact CG-SD 4.36Å; R237-M241 WeakPolarHBondContact O-CG 3.38Å; R237-M241 PolarHBondContact O-N 3.25Å; M241-L243 PolarHBondContact O-N 3.1Å; M241-E244 PolarHBondContact O-N 3.46Å; M241-V245 WeakPolarHBondContact O-CG2 3.32Å; M241-V245 PolarHBondContact O-N 3.18Å
242	L	97.2	Very high	96.3	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.7	-27.9	176.4	-78.4	172.3	0	0	0	112.8	I202 I213 F216 I217 L220 A238 L239 V240 E244 R246 L247 L250	I202-L242 HydrophobicContact CG2-CD2 4.04Å; I202-L242 HydrophobicContact CG2-CG 4.23Å; I213-L242 HydrophobicContact CD1-CD2 3.62Å; F216-L242 HydrophobicContact CD1-CD1 4.14Å; F216-L242 HydrophobicContact CD1-CD2 4.37Å; F216-L242 HydrophobicContact CE1-CD1 3.77Å; F216-L242 HydrophobicContact CE1-CD2 4.16Å; F216-L242 HydrophobicContact CE1-CG 4.13Å; I217-L242 HydrophobicContact CG1-CD1 3.99Å; L220-L242 HydrophobicContact CD1-CD1 3.67Å; A238-L242 VanDerWaalsContact O-CB 3.31Å; A238-L242 WeakPolarHBondContact O-CB 3.34Å; A238-L242 WeakPolarHBondContact O-CG 3.28Å; A238-L242 PolarHBondContact O-N 3.44Å; L239-L242 PolarHBondContact O-N 3.3Å; V240-L242 VanDerWaalsContact C-N 3.3Å; V240-L242 PolarHBondContact O-N 3.28Å; L242-E244 VanDerWaalsContact C-N 3.32Å; L242-R246 HydrophobicContact CD2-CB 4.24Å; L242-R246 CarbonylContact O-C 3.43Å; L242-R246 VanDerWaalsContact O-CA 3.31Å; L242-R246 WeakPolarHBondContact O-CA 3.43Å; L242-R246 PolarHBondContact O-N 3.2Å; L242-L247 PolarHBondContact O-N 3Å; L242-L250 HydrophobicContact CB-CD1 3.86Å; L242-L250 HydrophobicContact CB-CD2 4.38Å; L242-L250 HydrophobicContact CB-CG 4.36Å; L242-L250 HydrophobicContact CD1-CD2 4.42Å
243	L	96.6	Very high	96.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-41	177.2	-171.5	65.1	0	0	0	111.1	L239 V240 M241 L247 L250 M254 F279 T282 L283 Q286	L239-L243 PolarHBondContact O-N 3.44Å; V240-L243 WeakPolarHBondContact O-CB 3.25Å; V240-L243 PolarHBondContact O-N 3.28Å; M241-L243 PolarHBondContact O-N 3.1Å; L243-L247 HydrophobicContact CD1-CD1 3.6Å; L243-L247 WeakPolarHBondContact O-CB 3.28Å; L243-L250 HydrophobicContact CB-CD1 4.29Å; L243-L250 HydrophobicContact CD1-CD1 4.32Å; L243-M254 HydrophobicContact CD1-CE 3.7Å; L243-F279 HydrophobicContact CD1-CE2 4.34Å; L243-F279 HydrophobicContact CD2-CD2 3.96Å; L243-F279 HydrophobicContact CD2-CE2 3.77Å; L243-F279 HydrophobicContact CD2-CZ 4.27Å; L243-T282 HydrophobicContact CB-CG2 4.17Å; L243-T282 HydrophobicContact CD2-CG2 3.89Å; L243-T282 HydrophobicContact CG-CG2 4.2Å; L243-L283 HydrophobicContact CD1-CD1 4.17Å; L243-L283 HydrophobicContact CD2-CB 3.7Å; L243-L283 HydrophobicContact CD2-CD1 4.14Å; L243-L283 HydrophobicContact CD2-CG 4.49Å; L243-Q286 HydrophobicContact CG-CG 4.4Å
244	E	94.3	Very high	96.1	Very high	84 Å²	84	35.8 Å²	35.8	39%	0.393	17%	0.174	S	C	.	.	H	α-helix	trans	-68.6	-44.8	178.5	-64.8	177	-165	0	0	112.7	I203 M241 L242 T282	I203-E244 HydrophobicContact CD1-CB 4.47Å; I203-E244 VanDerWaalsContact CD1-OE2 3.23Å; I203-E244 WeakPolarHBondContact CD1-OE2 3.41Å; M241-E244 PolarHBondContact O-N 3.46Å; L242-E244 VanDerWaalsContact C-N 3.32Å; E244-T282 HydrophobicContact CG-CG2 3.3Å
245	V	95	Very high	95.9	Very high	15 Å²	15	40.1 Å²	40.1	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-98.5	-27.1	-169.6	-62.5	0	0	0	0	114.7	I202 I203 R205 M241	I202-V245 HydrophobicContact CG2-CG2 3.52Å; I203-V245 HydrophobicContact CD1-CG1 4.17Å; R205-V245 HydrophobicContact CG-CB 4.16Å; R205-V245 HydrophobicContact CG-CG1 4.06Å; M241-V245 WeakPolarHBondContact O-CG2 3.32Å; M241-V245 PolarHBondContact O-N 3.18Å
246	R	94.6	Very high	95.8	Very high	41 Å²	41	44.9 Å²	44.9	16%	0.155	22%	0.219	C	C	.	.	H	α-helix	trans	-140.2	40.9	-170.4	-67.5	-56.3	-59.1	-93.4	4.9	112.8	M210 I213 L242 D248 R249 L250	M210-R246 HydrophobicContact CE-CG 4.35Å; M210-R246 HydrophobicContact SD-CG 3.98Å; I213-R246 HydrophobicContact CD1-CG 4.28Å; I213-R246 HydrophobicContact CG1-CG 4.39Å; L242-R246 HydrophobicContact CD2-CB 4.24Å; L242-R246 CarbonylContact O-C 3.43Å; L242-R246 VanDerWaalsContact O-CA 3.31Å; L242-R246 WeakPolarHBondContact O-CA 3.43Å; L242-R246 PolarHBondContact O-N 3.2Å; R246-D248 VanDerWaalsContact CA-OD1 3.3Å; R246-D248 WeakPolarHBondContact CA-OD1 3.5Å; R246-D248 IonicContact CZ-OD1 2.91Å; R246-D248 IonicContact CZ-OD2 3.44Å; R246-D248 IonicContact NE-OD1 3Å; R246-D248 PolarHBondContact NE-OD1 3.19Å; R246-D248 IonicContact NE-OD2 2.74Å; R246-D248 IonicContact NH2-OD1 2.69Å; R246-D248 IonicContact NH2-OD2 3.87Å; R246-D248 PolarHBondContact NH2-OD2 3.06Å; R246-D248 PolarHBondContact O-N 3.05Å; R246-D248 VanDerWaalsContact O-N 3.09Å; R246-R249 PolarHBondContact O-N 3.29Å; R246-L250 PolarHBondContact O-N 3.27Å
247	L	94	Very high	95.7	Very high	27 Å²	27	45.1 Å²	45.1	14%	0.141	22%	0.22	C	C	.	.	H	α-helix	trans	-47.4	-37.6	170.3	179.2	62	0	0	0	112.2	L242 L243 R249 L250 L251 M254 Q286 V288	L242-L247 PolarHBondContact O-N 3Å; L243-L247 HydrophobicContact CD1-CD1 3.6Å; L243-L247 WeakPolarHBondContact O-CB 3.28Å; L247-R249 PolarHBondContact O-N 3.21Å; L247-R249 VanDerWaalsContact O-N 3.11Å; L247-L250 PolarHBondContact O-N 3.44Å; L247-L251 HydrophobicContact CD1-CD2 4.04Å; L247-L251 HydrophobicContact CD1-CG 4.04Å; L247-L251 HydrophobicContact CG-CD1 4.28Å; L247-L251 HydrophobicContact CG-CD2 4.37Å; L247-L251 HydrophobicContact CG-CG 4.04Å; L247-L251 WeakPolarHBondContact O-CG 3.31Å; L247-L251 PolarHBondContact O-N 3.01Å; L247-M254 HydrophobicContact CD1-CE 3.58Å; L247-Q286 HydrophobicContact CD2-CB 4.4Å; L247-Q286 HydrophobicContact CD2-CG 4.43Å; L247-V288 HydrophobicContact CD1-CG2 4.19Å; L247-V288 HydrophobicContact CD2-CG1 4.48Å; L247-V288 HydrophobicContact CD2-CG2 3.79Å
248	D	94	Very high	95.7	Very high	83 Å²	83	40.9 Å²	40.9	44%	0.444	20%	0.204	S	C	.	.	H	α-helix	trans	-51.4	-35.8	177.4	69.7	-59.9	0	0	0	113.6	R246	R246-D248 VanDerWaalsContact CA-OD1 3.3Å; R246-D248 WeakPolarHBondContact CA-OD1 3.5Å; R246-D248 IonicContact CZ-OD1 2.91Å; R246-D248 IonicContact CZ-OD2 3.44Å; R246-D248 IonicContact NE-OD1 3Å; R246-D248 PolarHBondContact NE-OD1 3.19Å; R246-D248 IonicContact NE-OD2 2.74Å; R246-D248 IonicContact NH2-OD1 2.69Å; R246-D248 IonicContact NH2-OD2 3.87Å; R246-D248 PolarHBondContact NH2-OD2 3.06Å; R246-D248 PolarHBondContact O-N 3.05Å; R246-D248 VanDerWaalsContact O-N 3.09Å
249	R	94.9	Very high	95.7	Very high	97 Å²	97	45.7 Å²	45.7	37%	0.366	23%	0.227	S	C	.	.	H	α-helix	trans	-88.3	-25.1	179.6	-63.6	-52.3	-137.5	-152.2	8.2	113.7	D214 I217 R246 L247 P252	D214-R249 IonicContact OD1-CZ 3.1Å; D214-R249 IonicContact OD1-NE 2.7Å; D214-R249 PolarHBondContact OD1-NE 3.25Å; D214-R249 IonicContact OD1-NH2 3.1Å; D214-R249 PolarHBondContact OD1-NH2 2.99Å; D214-R249 VanDerWaalsContact OD1-NH2 3.14Å; D214-R249 IonicContact OD2-CZ 3.52Å; D214-R249 IonicContact OD2-NH2 2.83Å; D214-R249 PolarHBondContact OD2-NH2 2.87Å; I217-R249 HydrophobicContact CD1-CB 3.55Å; I217-R249 HydrophobicContact CD1-CG 4.32Å; R246-R249 PolarHBondContact O-N 3.29Å; L247-R249 PolarHBondContact O-N 3.21Å; L247-R249 VanDerWaalsContact O-N 3.11Å; R249-P252 WeakPolarHBondContact O-CD 3.4Å
250	L	95.2	Very high	95.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-82.7	-30.8	179.3	-60.8	-170.2	0	0	0	112.6	I217 L239 L242 L243 R246 L247 P252 H253 M254 I257	I217-L250 HydrophobicContact CD1-CD2 4.22Å; L239-L250 HydrophobicContact CD2-CD2 4.39Å; L242-L250 HydrophobicContact CB-CD1 3.86Å; L242-L250 HydrophobicContact CB-CD2 4.38Å; L242-L250 HydrophobicContact CB-CG 4.36Å; L242-L250 HydrophobicContact CD1-CD2 4.42Å; L243-L250 HydrophobicContact CB-CD1 4.29Å; L243-L250 HydrophobicContact CD1-CD1 4.32Å; R246-L250 PolarHBondContact O-N 3.27Å; L247-L250 PolarHBondContact O-N 3.44Å; L250-P252 VanDerWaalsContact C-CD 3.41Å; L250-H253 CarbonylContact O-C 3.6Å; L250-H253 WeakPolarHBondContact O-CA 3.31Å; L250-H253 PolarHBondContact O-N 2.95Å; L250-M254 HydrophobicContact CB-CE 4.08Å; L250-M254 PolarHBondContact O-N 3.28Å; L250-I257 HydrophobicContact CB-CD1 3.96Å; L250-I257 HydrophobicContact CD2-CD1 4.02Å; L250-I257 HydrophobicContact CG-CD1 4.39Å
251	L	94.4	Very high	95.6	Very high	77 Å²	77	46.7 Å²	46.7	40%	0.403	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-47.5	-44.7	-177.7	-79.3	172.3	0	0	0	114.9	L247 H253 M254 V288	L247-L251 HydrophobicContact CD1-CD2 4.04Å; L247-L251 HydrophobicContact CD1-CG 4.04Å; L247-L251 HydrophobicContact CG-CD1 4.28Å; L247-L251 HydrophobicContact CG-CD2 4.37Å; L247-L251 HydrophobicContact CG-CG 4.04Å; L247-L251 WeakPolarHBondContact O-CG 3.31Å; L247-L251 PolarHBondContact O-N 3.01Å; L251-H253 PolarHBondContact O-N 3.36Å; L251-H253 VanDerWaalsContact O-N 3.13Å; L251-M254 HydrophobicContact CD2-CE 4.48Å; L251-M254 WeakPolarHBondContact O-CB 3.35Å; L251-M254 PolarHBondContact O-N 3.29Å; L251-V288 HydrophobicContact CD2-CG2 4.34Å
252	P	95.3	Very high	95.7	Very high	101 Å²	101	46 Å²	46	66%	0.656	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-62	-21.4	178.3	-23	34.8	0	0	0	114.6	R249 L250	R249-P252 WeakPolarHBondContact O-CD 3.4Å; L250-P252 VanDerWaalsContact C-CD 3.41Å
253	H	95.3	Very high	95.6	Very high	81 Å²	81	50.7 Å²	50.7	38%	0.375	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-112.9	4.6	-176.6	-57.4	-68.7	0	0	0	112.6	F221 L250 L251 H255 N256 I257	F221-H253 HydrophobicContact CE2-CB 4.05Å; F221-H253 AromaticContact CE2-CD2 3.77Å; F221-H253 AromaticContact CE2-CG 3.72Å; F221-H253 HydrophobicContact CZ-CB 3.82Å; L250-H253 CarbonylContact O-C 3.6Å; L250-H253 WeakPolarHBondContact O-CA 3.31Å; L250-H253 PolarHBondContact O-N 2.95Å; L251-H253 PolarHBondContact O-N 3.36Å; L251-H253 VanDerWaalsContact O-N 3.13Å; H253-H255 VanDerWaalsContact C-N 3.31Å; H253-H255 PolarHBondContact O-N 2.76Å; H253-N256 PolarHBondContact O-N 2.92Å; H253-I257 HydrophobicContact CB-CD1 4.1Å; H253-I257 HydrophobicContact CB-CG1 4.4Å; H253-I257 WeakPolarHBondContact O-CG1 3.34Å; H253-I257 PolarHBondContact O-N 3.4Å; H253-I257 VanDerWaalsContact O-N 3.08Å
254	M	94.7	Very high	95.7	Very high	8 Å²	8	52.6 Å²	52.6	4%	0.039	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-39	-165.5	-170.9	58.7	77	0	0	113.4	L243 L247 L250 L251 N256 I257 V258 F279 V292	L243-M254 HydrophobicContact CD1-CE 3.7Å; L247-M254 HydrophobicContact CD1-CE 3.58Å; L250-M254 HydrophobicContact CB-CE 4.08Å; L250-M254 PolarHBondContact O-N 3.28Å; L251-M254 HydrophobicContact CD2-CE 4.48Å; L251-M254 WeakPolarHBondContact O-CB 3.35Å; L251-M254 PolarHBondContact O-N 3.29Å; M254-N256 PolarHBondContact O-N 2.92Å; M254-I257 PolarHBondContact O-N 3.02Å; M254-V258 HydrophobicContact CG-CG2 4.27Å; M254-V258 WeakPolarHBondContact O-CG2 3.38Å; M254-V258 PolarHBondContact O-N 3.34Å; M254-V258 HydrophobicContact SD-CG2 4.28Å; M254-F279 HydrophobicContact SD-CZ 4.03Å; M254-V292 HydrophobicContact CG-CB 4.24Å; M254-V292 HydrophobicContact CG-CG1 3.34Å; M254-V292 HydrophobicContact CG-CG2 3.81Å; M254-V292 HydrophobicContact SD-CG1 4.14Å
255	H	94.6	Very high	95.9	Very high	100 Å²	100	49 Å²	49	46%	0.463	24%	0.242	S	C	.	.	H	α-helix	trans	-57.4	-47.1	176.7	175.9	46	0	0	0	112.4	H253 I257 V258 E259 H296	H253-H255 VanDerWaalsContact C-N 3.31Å; H253-H255 PolarHBondContact O-N 2.76Å; H255-I257 VanDerWaalsContact C-N 3.33Å; H255-I257 PolarHBondContact O-N 3.03Å; H255-V258 PolarHBondContact O-N 3.49Å; H255-E259 IonicContact CE1-OE1 3.17Å; H255-E259 PolarHBondContact CE1-OE1 3.37Å; H255-E259 IonicContact NE2-OE1 3.46Å; H255-E259 PolarHBondContact NE2-OE1 3.18Å; H255-E259 WeakPolarHBondContact O-CG 3.48Å; H255-E259 PolarHBondContact O-N 2.97Å; H255-H296 AromaticContact CE1-NE2 3.55Å; H255-H296 AromaticContact ND1-CE1 3.45Å; H255-H296 PolarHBondContact ND1-CE1 3.46Å; H255-H296 AromaticContact ND1-NE2 3.27Å; H255-H296 PolarHBondContact ND1-NE2 3.35Å
256	N	95	Very high	96	Very high	101 Å²	101	53.7 Å²	53.7	54%	0.54	26%	0.263	S	S	.	.	H	α-helix	trans	-69	-34.3	178.8	-61.8	-15	0	0	0	111.7	H253 M254 Y260	H253-N256 PolarHBondContact O-N 2.92Å; M254-N256 PolarHBondContact O-N 2.92Å; N256-Y260 VanDerWaalsContact O-CB 3.31Å; N256-Y260 WeakPolarHBondContact O-CB 3.47Å; N256-Y260 PolarHBondContact O-N 3.34Å
257	I	97.1	Very high	96.1	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-45.9	176.2	-64.4	169	0	0	0	109.7	F221 L250 H253 M254 H255 E259 Y260 M261 F279	F221-I257 HydrophobicContact CE1-CD1 4.13Å; F221-I257 HydrophobicContact CE1-CG1 3.98Å; F221-I257 HydrophobicContact CZ-CD1 4.05Å; F221-I257 HydrophobicContact CZ-CG1 4.25Å; L250-I257 HydrophobicContact CB-CD1 3.96Å; L250-I257 HydrophobicContact CD2-CD1 4.02Å; L250-I257 HydrophobicContact CG-CD1 4.39Å; H253-I257 HydrophobicContact CB-CD1 4.1Å; H253-I257 HydrophobicContact CB-CG1 4.4Å; H253-I257 WeakPolarHBondContact O-CG1 3.34Å; H253-I257 PolarHBondContact O-N 3.4Å; H253-I257 VanDerWaalsContact O-N 3.08Å; M254-I257 PolarHBondContact O-N 3.02Å; H255-I257 VanDerWaalsContact C-N 3.33Å; H255-I257 PolarHBondContact O-N 3.03Å; I257-E259 PolarHBondContact O-N 2.67Å; I257-Y260 WeakPolarHBondContact O-CB 3.31Å; I257-Y260 PolarHBondContact O-N 3.05Å; I257-M261 HydrophobicContact CG2-CG 4.19Å; I257-M261 WeakPolarHBondContact O-CB 3.36Å; I257-M261 VanDerWaalsContact O-CG 3.32Å; I257-M261 WeakPolarHBondContact O-CG 3.18Å; I257-M261 PolarHBondContact O-N 3.49Å; I257-F279 HydrophobicContact CG2-CE2 3.66Å; I257-F279 HydrophobicContact CG2-CZ 3.69Å
258	V	97.4	Very high	96.1	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-60.3	-45.5	176.4	169.3	0	0	0	0	111	M254 H255 Y260 M261 L262 F279 W280 V292 L293 H296	M254-V258 HydrophobicContact CG-CG2 4.27Å; M254-V258 WeakPolarHBondContact O-CG2 3.38Å; M254-V258 PolarHBondContact O-N 3.34Å; M254-V258 HydrophobicContact SD-CG2 4.28Å; H255-V258 PolarHBondContact O-N 3.49Å; V258-Y260 VanDerWaalsContact C-N 3.32Å; V258-Y260 PolarHBondContact O-N 2.76Å; V258-M261 PolarHBondContact O-N 3.21Å; V258-L262 VanDerWaalsContact O-CB 3.25Å; V258-L262 WeakPolarHBondContact O-CB 3.41Å; V258-L262 PolarHBondContact O-N 3.26Å; V258-F279 HydrophobicContact CG2-CE1 4.19Å; V258-F279 HydrophobicContact CG2-CZ 4.47Å; V258-W280 HydrophobicContact CG1-CH2 4.07Å; V258-W280 HydrophobicContact CG1-CZ3 4.1Å; V258-V292 HydrophobicContact CG2-CG1 3.67Å; V258-L293 HydrophobicContact CG1-CD2 4.2Å; V258-L293 HydrophobicContact CG2-CD2 4.36Å; V258-H296 HydrophobicContact CG1-CB 4.07Å
259	E	96.3	Very high	96.1	Very high	101 Å²	101	55.4 Å²	55.4	47%	0.472	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-41.7	175.8	-72.6	-173	160.8	0	0	112.3	H255 I257 L263	H255-E259 IonicContact CE1-OE1 3.17Å; H255-E259 PolarHBondContact CE1-OE1 3.37Å; H255-E259 IonicContact NE2-OE1 3.46Å; H255-E259 PolarHBondContact NE2-OE1 3.18Å; H255-E259 WeakPolarHBondContact O-CG 3.48Å; H255-E259 PolarHBondContact O-N 2.97Å; I257-E259 PolarHBondContact O-N 2.67Å; E259-L263 PolarHBondContact O-N 3.48Å
260	Y	97.1	Very high	96	Very high	32 Å²	32	56.1 Å²	56.1	13%	0.125	29%	0.29	C	S	.	.	H	α-helix	trans	-62.9	-51.4	176.1	173.2	-104.4	0	0	0	111.5	A224 V235 L239 N256 I257 V258 L262 L263 R264	A224-Y260 HydrophobicContact CB-CD2 4.08Å; A224-Y260 HydrophobicContact CB-CE2 3.81Å; A224-Y260 WeakPolarHBondContact O-CE2 3.25Å; V235-Y260 HydrophobicContact CG1-CE1 4.35Å; L239-Y260 HydrophobicContact CD1-CD1 4.09Å; L239-Y260 HydrophobicContact CD1-CE1 4.05Å; N256-Y260 VanDerWaalsContact O-CB 3.31Å; N256-Y260 WeakPolarHBondContact O-CB 3.47Å; N256-Y260 PolarHBondContact O-N 3.34Å; I257-Y260 WeakPolarHBondContact O-CB 3.31Å; I257-Y260 PolarHBondContact O-N 3.05Å; V258-Y260 VanDerWaalsContact C-N 3.32Å; V258-Y260 PolarHBondContact O-N 2.76Å; Y260-L262 VanDerWaalsContact C-N 3.33Å; Y260-L262 PolarHBondContact O-N 2.91Å; Y260-L263 WeakPolarHBondContact O-CB 3.49Å; Y260-L263 PolarHBondContact O-N 3.26Å; Y260-L263 VanDerWaalsContact O-N 3.16Å; Y260-R264 HydrophobicContact CD1-CG 4.18Å; Y260-R264 HydrophobicContact CD2-CG 4.05Å; Y260-R264 HydrophobicContact CE1-CG 3.72Å; Y260-R264 HydrophobicContact CE2-CG 3.54Å; Y260-R264 HydrophobicContact CG-CG 4.34Å; Y260-R264 WeakPolarHBondContact O-CG 3.37Å; Y260-R264 PolarHBondContact O-N 2.85Å
261	M	98.1	Very high	95.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-40.7	-179.9	-67.5	-53.5	-157.1	0	0	111.4	C236 L239 I257 V258 L263 R264 T265 A276 F279 W280	C236-M261 HydrophobicContact CB-SD 4.49Å; L239-M261 HydrophobicContact CB-CE 3.33Å; L239-M261 HydrophobicContact CD1-CE 3.62Å; L239-M261 HydrophobicContact CG-CE 4.12Å; I257-M261 HydrophobicContact CG2-CG 4.19Å; I257-M261 WeakPolarHBondContact O-CB 3.36Å; I257-M261 VanDerWaalsContact O-CG 3.32Å; I257-M261 WeakPolarHBondContact O-CG 3.18Å; I257-M261 PolarHBondContact O-N 3.49Å; V258-M261 PolarHBondContact O-N 3.21Å; M261-L263 PolarHBondContact O-N 3Å; M261-R264 CarbonylContact O-C 3.49Å; M261-R264 PolarHBondContact O-N 3.06Å; M261-T265 PolarHBondContact O-N 3.17Å; M261-T265 PolarHBondContact O-OG1 3.31Å; M261-A276 HydrophobicContact SD-CB 4.39Å; M261-F279 HydrophobicContact CB-CB 4.43Å; M261-F279 HydrophobicContact CB-CD1 3.85Å; M261-F279 HydrophobicContact CB-CE1 4.33Å; M261-F279 HydrophobicContact CB-CG 4.14Å; M261-F279 HydrophobicContact CE-CB 4.11Å; M261-F279 HydrophobicContact CE-CD2 3.65Å; M261-F279 HydrophobicContact CE-CE2 4.33Å; M261-F279 HydrophobicContact CE-CG 4.02Å; M261-F279 HydrophobicContact CG-CB 4.06Å; M261-F279 HydrophobicContact CG-CD1 3.74Å; M261-F279 HydrophobicContact CG-CD2 3.9Å; M261-F279 HydrophobicContact CG-CE1 4.13Å; M261-F279 HydrophobicContact CG-CE2 4.27Å; M261-F279 HydrophobicContact CG-CG 3.62Å; M261-F279 HydrophobicContact CG-CZ 4.38Å; M261-F279 HydrophobicContact SD-CB 4.38Å; M261-F279 HydrophobicContact SD-CG 4.44Å; M261-W280 HydrophobicContact CB-CH2 3.81Å; M261-W280 HydrophobicContact CB-CZ2 3.7Å
262	L	97.9	Very high	96	Very high	12 Å²	12	56.8 Å²	56.8	6%	0.063	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-37.1	177.2	-176.8	64.8	0	0	0	112	V258 Y260 Q266 W280 Q299 L300 V303	V258-L262 VanDerWaalsContact O-CB 3.25Å; V258-L262 WeakPolarHBondContact O-CB 3.41Å; V258-L262 PolarHBondContact O-N 3.26Å; Y260-L262 VanDerWaalsContact C-N 3.33Å; Y260-L262 PolarHBondContact O-N 2.91Å; L262-Q266 PolarHBondContact O-NE2 3.27Å; L262-W280 HydrophobicContact CB-CH2 4.16Å; L262-W280 HydrophobicContact CB-CZ2 4.07Å; L262-W280 HydrophobicContact CD1-CZ2 4.46Å; L262-Q299 HydrophobicContact CD2-CB 3.85Å; L262-L300 HydrophobicContact CD1-CB 4.2Å; L262-L300 HydrophobicContact CD1-CD1 3.95Å; L262-V303 HydrophobicContact CD1-CB 4.36Å; L262-V303 HydrophobicContact CD1-CG2 4.07Å
263	L	96.9	Very high	96.1	Very high	99 Å²	99	52 Å²	52	52%	0.518	26%	0.263	S	S	.	.	H	α-helix	trans	-71.5	-38.3	173.7	-179.9	66.5	0	0	0	112.1	E259 Y260 M261 Q266	E259-L263 PolarHBondContact O-N 3.48Å; Y260-L263 WeakPolarHBondContact O-CB 3.49Å; Y260-L263 PolarHBondContact O-N 3.26Å; Y260-L263 VanDerWaalsContact O-N 3.16Å; M261-L263 PolarHBondContact O-N 3Å; L263-Q266 PolarHBondContact O-N 2.76Å
264	R	97.6	Very high	96.2	Very high	39 Å²	39	49.3 Å²	49.3	15%	0.147	25%	0.251	C	S	.	.	H	α-helix	trans	-76.1	-29.6	179.8	-64.2	-58.6	80.5	157.5	-13.4	113.3	Y260 M261 Q266 D267 A273 A276	Y260-R264 HydrophobicContact CD1-CG 4.18Å; Y260-R264 HydrophobicContact CD2-CG 4.05Å; Y260-R264 HydrophobicContact CE1-CG 3.72Å; Y260-R264 HydrophobicContact CE2-CG 3.54Å; Y260-R264 HydrophobicContact CG-CG 4.34Å; Y260-R264 WeakPolarHBondContact O-CG 3.37Å; Y260-R264 PolarHBondContact O-N 2.85Å; M261-R264 CarbonylContact O-C 3.49Å; M261-R264 PolarHBondContact O-N 3.06Å; R264-Q266 PolarHBondContact O-N 3Å; R264-Q266 VanDerWaalsContact O-N 3.11Å; R264-D267 IonicContact CZ-OD2 2.86Å; R264-D267 VanDerWaalsContact CZ-OD2 3.3Å; R264-D267 IonicContact NE-OD2 3.55Å; R264-D267 PolarHBondContact NE-OD2 3.08Å; R264-D267 IonicContact NH1-OD2 2.68Å; R264-D267 IonicContact NH2-OD2 2.75Å; R264-D267 VanDerWaalsContact O-CB 3.27Å; R264-D267 WeakPolarHBondContact O-CB 3.24Å; R264-D267 PolarHBondContact O-N 3.42Å; R264-A273 WeakPolarHBondContact O-CA 3.39Å; R264-A276 VanDerWaalsContact C-CB 3.48Å; R264-A276 HydrophobicContact CB-CB 3.47Å; R264-A276 VanDerWaalsContact CB-CB 3.47Å
265	T	98.1	Very high	96.3	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.049	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.2	170.7	-52.6	0	0	0	0	111.9	M261 A273 A276 C277 W280 V303	M261-T265 PolarHBondContact O-N 3.17Å; M261-T265 PolarHBondContact O-OG1 3.31Å; T265-A273 WeakPolarHBondContact O-CB 3.48Å; T265-A276 PolarHBondContact OG1-O 2.98Å; T265-C277 HydrophobicContact CG2-CB 3.98Å; T265-W280 PolarHBondContact OG1-NE1 3.01Å; T265-V303 HydrophobicContact CG2-CG1 3.82Å
266	Q	97.2	Very high	96.4	Very high	114 Å²	114	45.7 Å²	45.7	53%	0.533	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	18.2	175.4	-62.6	172.5	86	0	0	112.7	L262 L263 R264 V303	L262-Q266 PolarHBondContact O-NE2 3.27Å; L263-Q266 PolarHBondContact O-N 2.76Å; R264-Q266 PolarHBondContact O-N 3Å; R264-Q266 VanDerWaalsContact O-N 3.11Å; Q266-V303 VanDerWaalsContact CD-CG2 3.43Å; Q266-V303 HydrophobicContact CG-CB 4.39Å; Q266-V303 HydrophobicContact CG-CG1 3.57Å; Q266-V303 HydrophobicContact CG-CG2 3.89Å
267	D	96.8	Very high	96.6	Very high	13 Å²	13	40.9 Å²	40.9	7%	0.07	21%	0.209	C	C	.	.			trans	-63.8	144	178.4	-140	-83.8	0	0	0	111.1	R232 R264 D269 V272 A273	R232-D267 IonicContact CZ-OD1 2.82Å; R232-D267 IonicContact CZ-OD2 3.96Å; R232-D267 IonicContact NH1-OD1 3.34Å; R232-D267 PolarHBondContact NH1-OD1 2.92Å; R232-D267 IonicContact NH1-OD2 3.79Å; R232-D267 PolarHBondContact NH1-OD2 3.4Å; R232-D267 IonicContact NH2-OD1 2.64Å; R264-D267 IonicContact CZ-OD2 2.86Å; R264-D267 VanDerWaalsContact CZ-OD2 3.3Å; R264-D267 IonicContact NE-OD2 3.55Å; R264-D267 PolarHBondContact NE-OD2 3.08Å; R264-D267 IonicContact NH1-OD2 2.68Å; R264-D267 IonicContact NH2-OD2 2.75Å; R264-D267 VanDerWaalsContact O-CB 3.27Å; R264-D267 WeakPolarHBondContact O-CB 3.24Å; R264-D267 PolarHBondContact O-N 3.42Å; D267-D269 PolarHBondContact O-N 2.86Å; D267-D269 PolarHBondContact OD1-N 3.32Å; D267-V272 HydrophobicContact CB-CB 3.97Å; D267-V272 HydrophobicContact CB-CG1 3.85Å; D267-A273 HydrophobicContact CB-CB 4.47Å
268	P	94.3	Very high	96.6	Very high	127 Å²	127	43 Å²	43	83%	0.825	22%	0.219	S	C	*	.	S	Bend	trans	-66.1	-20.8	171.7	26.8	-37.8	0	0	0	113.9
269	D	94.9	Very high	96.6	Very high	48 Å²	48	43 Å²	43	26%	0.257	22%	0.218	S	C	.	.	S	Bend	trans	-85.9	113.4	171	-170.8	-65.6	0	0	0	109.5	P229 D267 N271 V272 A273	P229-D269 HydrophobicContact CB-CB 4.33Å; D267-D269 PolarHBondContact O-N 2.86Å; D267-D269 PolarHBondContact OD1-N 3.32Å; D269-N271 PolarHBondContact O-N 3.47Å; D269-N271 WeakPolarHBondContact OD1-CB 3.37Å; D269-N271 PolarHBondContact OD1-N 2.85Å; D269-N271 PolarHBondContact OD1-ND2 3.08Å; D269-V272 HydrophobicContact CB-CB 4.21Å; D269-V272 HydrophobicContact CB-CG2 3.91Å; D269-V272 PolarHBondContact O-N 2.92Å; D269-V272 VanDerWaalsContact O-N 3.1Å; D269-V272 PolarHBondContact OD1-N 3.4Å; D269-A273 PolarHBondContact O-N 3.44Å
270	E	91.9	Very high	96.7	Very high	111 Å²	111	38.2 Å²	38.2	52%	0.519	20%	0.196	S	C	.	.	H	α-helix	trans	-60.4	-30.7	-175.7	-70.1	-177	169.8	0	0	113	A273 L274	E270-A273 PolarHBondContact O-N 3.33Å; E270-L274 WeakPolarHBondContact O-CB 3.32Å; E270-L274 PolarHBondContact O-N 2.89Å
271	N	93.2	Very high	96.6	Very high	91 Å²	91	38.4 Å²	38.4	49%	0.487	20%	0.199	S	C	.	.	H	α-helix	trans	-71	-37.5	177.9	-53	-72.5	0	0	0	111.1	K233 D269 E275	K233-N271 HydrophobicContact CD-CB 4Å; D269-N271 PolarHBondContact O-N 3.47Å; D269-N271 WeakPolarHBondContact OD1-CB 3.37Å; D269-N271 PolarHBondContact OD1-N 2.85Å; D269-N271 PolarHBondContact OD1-ND2 3.08Å; N271-E275 WeakPolarHBondContact O-CB 3.18Å; N271-E275 WeakPolarHBondContact O-CG 3.24Å; N271-E275 PolarHBondContact O-N 3.41Å; N271-E275 VanDerWaalsContact O-N 3.16Å
272	V	96.9	Very high	96.5	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.1	-41.4	174.1	179.5	0	0	0	0	110.3	P229 R232 K233 D267 D269 A276	P229-V272 HydrophobicContact CB-CG2 4.02Å; P229-V272 WeakPolarHBondContact O-CG2 3.44Å; R232-V272 HydrophobicContact CB-CG1 3.99Å; R232-V272 HydrophobicContact CB-CG2 4.32Å; K233-V272 HydrophobicContact CB-CG2 4.19Å; D267-V272 HydrophobicContact CB-CB 3.97Å; D267-V272 HydrophobicContact CB-CG1 3.85Å; D269-V272 HydrophobicContact CB-CB 4.21Å; D269-V272 HydrophobicContact CB-CG2 3.91Å; D269-V272 PolarHBondContact O-N 2.92Å; D269-V272 VanDerWaalsContact O-N 3.1Å; D269-V272 PolarHBondContact OD1-N 3.4Å; V272-A276 VanDerWaalsContact O-CB 3.29Å; V272-A276 WeakPolarHBondContact O-CB 3.23Å; V272-A276 PolarHBondContact O-N 3.27Å
273	A	97.6	Very high	96.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-43.1	177.8	0	0	0	0	0	112.3	R264 T265 D267 D269 E270 A276 C277 L378	R264-A273 WeakPolarHBondContact O-CA 3.39Å; T265-A273 WeakPolarHBondContact O-CB 3.48Å; D267-A273 HydrophobicContact CB-CB 4.47Å; D269-A273 PolarHBondContact O-N 3.44Å; E270-A273 PolarHBondContact O-N 3.33Å; A273-A276 PolarHBondContact O-N 3.03Å; A273-C277 VanDerWaalsContact O-CB 3.32Å; A273-C277 WeakPolarHBondContact O-CB 3.35Å; A273-C277 PolarHBondContact O-N 3.36Å; A273-L378 HydrophobicContact CB-CD1 4.25Å; A273-L378 HydrophobicContact CB-CD2 3.87Å
274	L	96.1	Very high	96.3	Very high	25 Å²	25	33.9 Å²	33.9	13%	0.131	18%	0.177	C	C	.	.	H	α-helix	trans	-59.1	-54.6	175.9	174.7	55.6	0	0	0	111.5	E270 A276 C277 E278 C381	E270-L274 WeakPolarHBondContact O-CB 3.32Å; E270-L274 PolarHBondContact O-N 2.89Å; L274-A276 PolarHBondContact O-N 2.99Å; L274-C277 WeakPolarHBondContact O-CA 3.43Å; L274-C277 WeakPolarHBondContact O-CB 3.44Å; L274-C277 PolarHBondContact O-N 3.42Å; L274-E278 PolarHBondContact O-N 2.91Å; L274-E278 VanDerWaalsContact O-N 3.09Å; L274-C381 HydrophobicContact CD1-CB 3.64Å
275	E	96.8	Very high	96	Very high	32 Å²	32	37.9 Å²	37.9	15%	0.15	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-25.2	-177.7	-65.3	-99.3	-158.7	0	0	112.3	K233 C236 R237 N271	K233-E275 HydrophobicContact CD-CG 4.37Å; K233-E275 HydrophobicContact CG-CB 4.22Å; K233-E275 HydrophobicContact CG-CG 3.68Å; C236-E275 HydrophobicContact CB-CB 4.11Å; R237-E275 VanDerWaalsContact CB-OE2 3.23Å; R237-E275 WeakPolarHBondContact CB-OE2 3.39Å; R237-E275 WeakPolarHBondContact CD-OE2 3.26Å; R237-E275 VanDerWaalsContact CG-OE2 3.28Å; R237-E275 WeakPolarHBondContact CG-OE2 3.21Å; N271-E275 WeakPolarHBondContact O-CB 3.18Å; N271-E275 WeakPolarHBondContact O-CG 3.24Å; N271-E275 PolarHBondContact O-N 3.41Å; N271-E275 VanDerWaalsContact O-N 3.16Å
276	A	98.1	Very high	95.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-78.4	-30.6	169.4	0	0	0	0	0	112.9	C236 M261 R264 T265 V272 A273 L274 F279	C236-A276 HydrophobicContact CB-CB 4.44Å; M261-A276 HydrophobicContact SD-CB 4.39Å; R264-A276 VanDerWaalsContact C-CB 3.48Å; R264-A276 HydrophobicContact CB-CB 3.47Å; R264-A276 VanDerWaalsContact CB-CB 3.47Å; T265-A276 PolarHBondContact OG1-O 2.98Å; V272-A276 VanDerWaalsContact O-CB 3.29Å; V272-A276 WeakPolarHBondContact O-CB 3.23Å; V272-A276 PolarHBondContact O-N 3.27Å; A273-A276 PolarHBondContact O-N 3.03Å; L274-A276 PolarHBondContact O-N 2.99Å; A276-F279 VanDerWaalsContact O-CB 3.26Å; A276-F279 WeakPolarHBondContact O-CB 3.42Å; A276-F279 PolarHBondContact O-N 3.03Å
277	C	98.3	Very high	95.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70.1	-35.5	179.3	-160.2	0	0	0	0	111.6	T265 A273 L274 F279 W280 L378 C381	T265-C277 HydrophobicContact CG2-CB 3.98Å; A273-C277 VanDerWaalsContact O-CB 3.32Å; A273-C277 WeakPolarHBondContact O-CB 3.35Å; A273-C277 PolarHBondContact O-N 3.36Å; L274-C277 WeakPolarHBondContact O-CA 3.43Å; L274-C277 WeakPolarHBondContact O-CB 3.44Å; L274-C277 PolarHBondContact O-N 3.42Å; C277-F279 PolarHBondContact O-N 3.5Å; C277-F279 VanDerWaalsContact O-N 3.08Å; C277-W280 WeakPolarHBondContact O-CB 3.49Å; C277-W280 PolarHBondContact O-N 3.38Å; C277-L378 HydrophobicContact CB-CD1 3.69Å; C277-C381 VanDerWaalsContact C-SG 3.57Å; C277-C381 HydrophobicContact CB-CB 4.44Å
278	E	97.1	Very high	95.4	Very high	50 Å²	50	40.4 Å²	40.4	23%	0.234	22%	0.22	C	C	.	.	H	α-helix	trans	-56	-27.9	175.6	-70.4	-173.5	-176	0	0	112.7	V240 L274 W280 L281 T282 W376 C381	V240-E278 HydrophobicContact CG1-CB 4.25Å; V240-E278 HydrophobicContact CG2-CB 4.29Å; L274-E278 PolarHBondContact O-N 2.91Å; L274-E278 VanDerWaalsContact O-N 3.09Å; E278-W280 PolarHBondContact O-N 3.46Å; E278-L281 PolarHBondContact O-N 3.03Å; E278-T282 PolarHBondContact O-N 2.75Å; E278-T282 PolarHBondContact O-OG1 3.07Å; E278-W376 PolarHBondContact OE1-NE1 3.11Å; E278-W376 VanDerWaalsContact OE1-NE1 3.1Å; E278-C381 PolarHBondContact N-SG 2.87Å; E278-C381 VanDerWaalsContact N-SG 3.44Å
279	F	98.3	Very high	95.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-55.2	-36.3	173.4	-178.4	-95.9	0	0	0	113.1	V240 L243 M254 I257 V258 M261 A276 C277 L283	V240-F279 HydrophobicContact CG2-CB 3.91Å; L243-F279 HydrophobicContact CD1-CE2 4.34Å; L243-F279 HydrophobicContact CD2-CD2 3.96Å; L243-F279 HydrophobicContact CD2-CE2 3.77Å; L243-F279 HydrophobicContact CD2-CZ 4.27Å; M254-F279 HydrophobicContact SD-CZ 4.03Å; I257-F279 HydrophobicContact CG2-CE2 3.66Å; I257-F279 HydrophobicContact CG2-CZ 3.69Å; V258-F279 HydrophobicContact CG2-CE1 4.19Å; V258-F279 HydrophobicContact CG2-CZ 4.47Å; M261-F279 HydrophobicContact CB-CB 4.43Å; M261-F279 HydrophobicContact CB-CD1 3.85Å; M261-F279 HydrophobicContact CB-CE1 4.33Å; M261-F279 HydrophobicContact CB-CG 4.14Å; M261-F279 HydrophobicContact CE-CB 4.11Å; M261-F279 HydrophobicContact CE-CD2 3.65Å; M261-F279 HydrophobicContact CE-CE2 4.33Å; M261-F279 HydrophobicContact CE-CG 4.02Å; M261-F279 HydrophobicContact CG-CB 4.06Å; M261-F279 HydrophobicContact CG-CD1 3.74Å; M261-F279 HydrophobicContact CG-CD2 3.9Å; M261-F279 HydrophobicContact CG-CE1 4.13Å; M261-F279 HydrophobicContact CG-CE2 4.27Å; M261-F279 HydrophobicContact CG-CG 3.62Å; M261-F279 HydrophobicContact CG-CZ 4.38Å; M261-F279 HydrophobicContact SD-CB 4.38Å; M261-F279 HydrophobicContact SD-CG 4.44Å; A276-F279 VanDerWaalsContact O-CB 3.26Å; A276-F279 WeakPolarHBondContact O-CB 3.42Å; A276-F279 PolarHBondContact O-N 3.03Å; C277-F279 PolarHBondContact O-N 3.5Å; C277-F279 VanDerWaalsContact O-N 3.08Å; F279-L283 HydrophobicContact CD1-CD2 4.5Å; F279-L283 HydrophobicContact CE1-CB 4.47Å; F279-L283 HydrophobicContact CE1-CD2 3.73Å; F279-L283 HydrophobicContact CZ-CD2 4.2Å; F279-L283 WeakPolarHBondContact O-CB 3.28Å; F279-L283 PolarHBondContact O-N 2.85Å
280	W	98.2	Very high	95.4	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-72.4	-38.5	-179.1	-51.2	119.4	0	0	0	112	V258 M261 L262 T265 C277 E278 A284 L293 L300 L304 A385	V258-W280 HydrophobicContact CG1-CH2 4.07Å; V258-W280 HydrophobicContact CG1-CZ3 4.1Å; M261-W280 HydrophobicContact CB-CH2 3.81Å; M261-W280 HydrophobicContact CB-CZ2 3.7Å; L262-W280 HydrophobicContact CB-CH2 4.16Å; L262-W280 HydrophobicContact CB-CZ2 4.07Å; L262-W280 HydrophobicContact CD1-CZ2 4.46Å; T265-W280 PolarHBondContact OG1-NE1 3.01Å; C277-W280 WeakPolarHBondContact O-CB 3.49Å; C277-W280 PolarHBondContact O-N 3.38Å; E278-W280 PolarHBondContact O-N 3.46Å; W280-A284 WeakPolarHBondContact O-CB 3.4Å; W280-A284 PolarHBondContact O-N 3.45Å; W280-L293 HydrophobicContact CE3-CD2 4.12Å; W280-L293 HydrophobicContact CZ3-CD2 3.78Å; W280-L300 HydrophobicContact CD2-CD1 3.61Å; W280-L300 HydrophobicContact CD2-CD2 3.96Å; W280-L300 HydrophobicContact CD2-CG 4.46Å; W280-L300 VanDerWaalsContact CE2-CD1 3.44Å; W280-L300 HydrophobicContact CE3-CD1 4.12Å; W280-L300 HydrophobicContact CE3-CD2 3.74Å; W280-L300 HydrophobicContact CG-CD1 3.99Å; W280-L300 HydrophobicContact CG-CD2 4.44Å; W280-L300 HydrophobicContact CH2-CD1 4.32Å; W280-L300 HydrophobicContact CZ2-CD1 3.83Å; W280-L300 HydrophobicContact CZ3-CD1 4.45Å; W280-L300 HydrophobicContact CZ3-CD2 4.17Å; W280-L304 HydrophobicContact CG-CD2 4.36Å; W280-A385 HydrophobicContact CB-CB 3.9Å
281	L	94.2	Very high	95.5	Very high	36 Å²	36	39.6 Å²	39.6	19%	0.188	20%	0.203	C	C	.	.	H	α-helix	trans	-61.9	-56.6	176	-171.6	68.4	0	0	0	109.7	E278 L283 A284 E285 W376 A384 A385 V388	E278-L281 PolarHBondContact O-N 3.03Å; L281-L283 VanDerWaalsContact C-N 3.3Å; L281-L283 PolarHBondContact O-N 3.26Å; L281-A284 WeakPolarHBondContact O-CB 3.47Å; L281-A284 PolarHBondContact O-N 2.88Å; L281-E285 PolarHBondContact O-N 3.47Å; L281-W376 HydrophobicContact CD2-CZ2 4.36Å; L281-A384 HydrophobicContact CD1-CB 3.95Å; L281-A385 HydrophobicContact CB-CB 4.4Å; L281-V388 HydrophobicContact CD1-CB 4.48Å; L281-V388 HydrophobicContact CD1-CG2 3.72Å
282	T	95.4	Very high	95.6	Very high	11 Å²	11	36.5 Å²	36.5	7%	0.067	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-36.7	178.5	-52.8	0	0	0	0	112.8	V240 L243 E244 E278 A284 Q286	V240-T282 HydrophobicContact CG1-CG2 4.48Å; V240-T282 WeakPolarHBondContact CG1-OG1 3.12Å; L243-T282 HydrophobicContact CB-CG2 4.17Å; L243-T282 HydrophobicContact CD2-CG2 3.89Å; L243-T282 HydrophobicContact CG-CG2 4.2Å; E244-T282 HydrophobicContact CG-CG2 3.3Å; E278-T282 PolarHBondContact O-N 2.75Å; E278-T282 PolarHBondContact O-OG1 3.07Å; T282-A284 VanDerWaalsContact C-N 3.34Å; T282-Q286 WeakPolarHBondContact O-CG 3.35Å
283	L	96.9	Very high	95.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68.8	-34.2	177.2	-176.9	58.8	0	0	0	111.9	L243 F279 L281 E285 Q286 C289 V292 L293	L243-L283 HydrophobicContact CD1-CD1 4.17Å; L243-L283 HydrophobicContact CD2-CB 3.7Å; L243-L283 HydrophobicContact CD2-CD1 4.14Å; L243-L283 HydrophobicContact CD2-CG 4.49Å; F279-L283 HydrophobicContact CD1-CD2 4.5Å; F279-L283 HydrophobicContact CE1-CB 4.47Å; F279-L283 HydrophobicContact CE1-CD2 3.73Å; F279-L283 HydrophobicContact CZ-CD2 4.2Å; F279-L283 WeakPolarHBondContact O-CB 3.28Å; F279-L283 PolarHBondContact O-N 2.85Å; L281-L283 VanDerWaalsContact C-N 3.3Å; L281-L283 PolarHBondContact O-N 3.26Å; L283-E285 VanDerWaalsContact C-N 3.27Å; L283-E285 PolarHBondContact O-N 3.24Å; L283-Q286 HydrophobicContact CD1-CB 4.48Å; L283-Q286 WeakPolarHBondContact O-CB 3.49Å; L283-Q286 PolarHBondContact O-N 3.09Å; L283-C289 VanDerWaalsContact O-CB 3.3Å; L283-C289 WeakPolarHBondContact O-CB 3.39Å; L283-V292 HydrophobicContact CD2-CG1 4.03Å; L283-L293 HydrophobicContact CD2-CD1 3.9Å; L283-L293 HydrophobicContact CD2-CD2 3.72Å; L283-L293 HydrophobicContact CD2-CG 3.7Å; L283-L293 HydrophobicContact CG-CD1 4.42Å
284	A	95.1	Very high	95	Very high	5 Å²	5	40.9 Å²	40.9	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-65.4	-32.9	-177.5	0	0	0	0	0	112.3	W280 L281 T282 Q286 V388 L389 V392	W280-A284 WeakPolarHBondContact O-CB 3.4Å; W280-A284 PolarHBondContact O-N 3.45Å; L281-A284 WeakPolarHBondContact O-CB 3.47Å; L281-A284 PolarHBondContact O-N 2.88Å; T282-A284 VanDerWaalsContact C-N 3.34Å; A284-Q286 PolarHBondContact O-N 3.2Å; A284-V388 HydrophobicContact CB-CB 3.93Å; A284-V388 HydrophobicContact CB-CG1 3.46Å; A284-V388 VanDerWaalsContact CB-CG1 3.46Å; A284-L389 HydrophobicContact CB-CD2 4.06Å; A284-L389 HydrophobicContact CB-CG 4.26Å; A284-V392 HydrophobicContact CB-CG2 4.42Å; A284-V392 VanDerWaalsContact O-CG2 3.28Å; A284-V392 WeakPolarHBondContact O-CG2 3.35Å
285	E	91.4	Very high	94.8	Very high	123 Å²	123	42.6 Å²	42.6	58%	0.575	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.5	173.1	-64.6	167.6	-167.4	0	0	113.4	L281 L283	L281-E285 PolarHBondContact O-N 3.47Å; L283-E285 VanDerWaalsContact C-N 3.27Å; L283-E285 PolarHBondContact O-N 3.24Å
286	Q	93.3	Very high	94.7	Very high	36 Å²	36	42.2 Å²	42.2	17%	0.168	24%	0.238	C	C	.	.	S	Bend	trans	-79.1	139.1	-179.2	-57.8	-56.2	-48.3	0	0	111.5	L243 L247 T282 L283 A284 V288 C289	L243-Q286 HydrophobicContact CG-CG 4.4Å; L247-Q286 HydrophobicContact CD2-CB 4.4Å; L247-Q286 HydrophobicContact CD2-CG 4.43Å; T282-Q286 WeakPolarHBondContact O-CG 3.35Å; L283-Q286 HydrophobicContact CD1-CB 4.48Å; L283-Q286 WeakPolarHBondContact O-CB 3.49Å; L283-Q286 PolarHBondContact O-N 3.09Å; A284-Q286 PolarHBondContact O-N 3.2Å; Q286-V288 HydrophobicContact CB-CG2 4.09Å; Q286-V288 PolarHBondContact O-N 3.35Å; Q286-C289 WeakPolarHBondContact O-CB 3.25Å; Q286-C289 PolarHBondContact O-N 3.12Å
287	P	91.3	Very high	94.5	Very high	123 Å²	123	42.6 Å²	42.6	80%	0.799	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.3	-179.4	25.3	-34.8	0	0	0	113.5	C289	P287-C289 VanDerWaalsContact C-N 3.33Å
288	V	94.4	Very high	94.3	Very high	28 Å²	28	45.8 Å²	45.8	17%	0.17	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4	178.1	-59.4	0	0	0	0	113.6	L247 L251 Q286 K290 E291 V292	L247-V288 HydrophobicContact CD1-CG2 4.19Å; L247-V288 HydrophobicContact CD2-CG1 4.48Å; L247-V288 HydrophobicContact CD2-CG2 3.79Å; L251-V288 HydrophobicContact CD2-CG2 4.34Å; Q286-V288 HydrophobicContact CB-CG2 4.09Å; Q286-V288 PolarHBondContact O-N 3.35Å; V288-K290 VanDerWaalsContact C-N 3.33Å; V288-K290 PolarHBondContact O-N 2.98Å; V288-E291 PolarHBondContact O-N 3.33Å; V288-E291 VanDerWaalsContact O-N 3.07Å; V288-V292 HydrophobicContact CB-CG2 4.31Å; V288-V292 HydrophobicContact CG2-CG2 4.14Å; V288-V292 WeakPolarHBondContact O-CG2 3.22Å; V288-V292 PolarHBondContact O-N 3.32Å; V288-V292 VanDerWaalsContact O-N 3.08Å
289	C	95.4	Very high	94.3	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.014	28%	0.277	C	S	.	.	H	α-helix	trans	-46.8	-53.2	-174.1	175.9	0	0	0	0	112.6	L283 Q286 P287 E291 V292 L293 V392	L283-C289 VanDerWaalsContact O-CB 3.3Å; L283-C289 WeakPolarHBondContact O-CB 3.39Å; Q286-C289 WeakPolarHBondContact O-CB 3.25Å; Q286-C289 PolarHBondContact O-N 3.12Å; P287-C289 VanDerWaalsContact C-N 3.33Å; C289-E291 VanDerWaalsContact C-N 3.34Å; C289-E291 PolarHBondContact O-N 2.86Å; C289-V292 PolarHBondContact O-N 3.07Å; C289-L293 WeakPolarHBondContact O-CB 3.33Å; C289-L293 PolarHBondContact O-N 2.95Å; C289-V392 HydrophobicContact CB-CG1 4.31Å
290	K	93.7	Very high	94.3	Very high	99 Å²	99	48.9 Å²	48.9	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-57.1	-45.9	-178.9	-72.6	-168.3	176.3	-175.3	0	112.7	V288 V292 C294 V392 F393	V288-K290 VanDerWaalsContact C-N 3.33Å; V288-K290 PolarHBondContact O-N 2.98Å; K290-V292 VanDerWaalsContact C-N 3.32Å; K290-V292 PolarHBondContact O-N 3.11Å; K290-C294 WeakPolarHBondContact O-CB 3.41Å; K290-C294 PolarHBondContact O-N 3.29Å; K290-C294 VanDerWaalsContact O-N 3.11Å; K290-V392 HydrophobicContact CD-CG1 4.32Å; K290-V392 WeakPolarHBondContact CE-O 3.34Å; K290-V392 HydrophobicContact CG-CG1 3.61Å; K290-V392 PolarHBondContact NZ-O 3.06Å; K290-F393 HydrophobicContact CB-CE1 4.19Å; K290-F393 HydrophobicContact CB-CZ 4.4Å; K290-F393 HydrophobicContact CG-CD1 4.26Å; K290-F393 HydrophobicContact CG-CE1 3.84Å; K290-F393 HydrophobicContact CG-CZ 4.09Å
291	E	93.4	Very high	94.2	Very high	169 Å²	169	48.8 Å²	48.8	79%	0.79	28%	0.277	S	S	*	.	H	α-helix	trans	-65.9	-39	-177.7	-60.6	-174.8	171.9	0	0	111.5	V288 C289	V288-E291 PolarHBondContact O-N 3.33Å; V288-E291 VanDerWaalsContact O-N 3.07Å; C289-E291 VanDerWaalsContact C-N 3.34Å; C289-E291 PolarHBondContact O-N 2.86Å
292	V	95.2	Very high	94.4	Very high	26 Å²	26	49.7 Å²	49.7	16%	0.158	29%	0.285	C	S	.	.	H	α-helix	trans	-74.5	-44.5	-178.3	172	0	0	0	0	112	M254 V258 L283 V288 C289 K290 H296	M254-V292 HydrophobicContact CG-CB 4.24Å; M254-V292 HydrophobicContact CG-CG1 3.34Å; M254-V292 HydrophobicContact CG-CG2 3.81Å; M254-V292 HydrophobicContact SD-CG1 4.14Å; V258-V292 HydrophobicContact CG2-CG1 3.67Å; L283-V292 HydrophobicContact CD2-CG1 4.03Å; V288-V292 HydrophobicContact CB-CG2 4.31Å; V288-V292 HydrophobicContact CG2-CG2 4.14Å; V288-V292 WeakPolarHBondContact O-CG2 3.22Å; V288-V292 PolarHBondContact O-N 3.32Å; V288-V292 VanDerWaalsContact O-N 3.08Å; C289-V292 PolarHBondContact O-N 3.07Å; K290-V292 VanDerWaalsContact C-N 3.32Å; K290-V292 PolarHBondContact O-N 3.11Å; V292-H296 PolarHBondContact O-ND1 3.43Å
293	L	95.1	Very high	94.6	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-92	-17.6	-170.2	-71.1	-175.9	0	0	0	115	V258 W280 L283 C289 G295 H296 L297 L300 L389 F393	V258-L293 HydrophobicContact CG1-CD2 4.2Å; V258-L293 HydrophobicContact CG2-CD2 4.36Å; W280-L293 HydrophobicContact CE3-CD2 4.12Å; W280-L293 HydrophobicContact CZ3-CD2 3.78Å; L283-L293 HydrophobicContact CD2-CD1 3.9Å; L283-L293 HydrophobicContact CD2-CD2 3.72Å; L283-L293 HydrophobicContact CD2-CG 3.7Å; L283-L293 HydrophobicContact CG-CD1 4.42Å; C289-L293 WeakPolarHBondContact O-CB 3.33Å; C289-L293 PolarHBondContact O-N 2.95Å; L293-G295 PolarHBondContact O-N 3.08Å; L293-H296 PolarHBondContact O-N 3.06Å; L293-L297 HydrophobicContact CB-CD2 4.4Å; L293-L297 PolarHBondContact O-N 2.7Å; L293-L297 VanDerWaalsContact O-N 3.08Å; L293-L300 HydrophobicContact CD1-CD2 4.18Å; L293-L300 HydrophobicContact CD2-CD2 4.26Å; L293-L389 HydrophobicContact CD1-CD2 3.71Å; L293-F393 HydrophobicContact CB-CE2 4.48Å; L293-F393 HydrophobicContact CB-CZ 4.03Å
294	C	88.1	Confident	94.6	Very high	92 Å²	92	50 Å²	50	62%	0.622	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-37	-174.9	-177.6	0	0	0	0	113.6	K290 H296	K290-C294 WeakPolarHBondContact O-CB 3.41Å; K290-C294 PolarHBondContact O-N 3.29Å; K290-C294 VanDerWaalsContact O-N 3.11Å; C294-H296 VanDerWaalsContact C-N 3.34Å; C294-H296 PolarHBondContact O-N 3.01Å
295	G	91.1	Very high	94.8	Very high	61 Å²	61	50.1 Å²	50.1	63%	0.629	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-11.3	177.2	0	0	0	0	0	116	L293	L293-G295 PolarHBondContact O-N 3.08Å
296	H	94.8	Very high	95.1	Very high	24 Å²	24	48.8 Å²	48.8	11%	0.111	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-11.5	-171.4	-57.3	91.3	0	0	0	113.5	H255 V258 V292 L293 C294 S298 Q299 L300	H255-H296 AromaticContact CE1-NE2 3.55Å; H255-H296 AromaticContact ND1-CE1 3.45Å; H255-H296 PolarHBondContact ND1-CE1 3.46Å; H255-H296 AromaticContact ND1-NE2 3.27Å; H255-H296 PolarHBondContact ND1-NE2 3.35Å; V258-H296 HydrophobicContact CG1-CB 4.07Å; V292-H296 PolarHBondContact O-ND1 3.43Å; L293-H296 PolarHBondContact O-N 3.06Å; C294-H296 VanDerWaalsContact C-N 3.34Å; C294-H296 PolarHBondContact O-N 3.01Å; H296-S298 VanDerWaalsContact C-N 3.29Å; H296-S298 PolarHBondContact O-N 3.24Å; H296-Q299 PolarHBondContact O-N 3.01Å; H296-L300 PolarHBondContact O-N 3.14Å
297	L	93.8	Very high	95.2	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.042	28%	0.281	C	S	.	.	H	α-helix	trans	-51.2	-43.3	-177.9	-75	179.2	0	0	0	113.7	L293 Q299 L300 I301 F393 L397	L293-L297 HydrophobicContact CB-CD2 4.4Å; L293-L297 PolarHBondContact O-N 2.7Å; L293-L297 VanDerWaalsContact O-N 3.08Å; L297-Q299 PolarHBondContact O-N 3.28Å; L297-L300 PolarHBondContact O-N 2.65Å; L297-I301 HydrophobicContact CD2-CD1 4.4Å; L297-I301 HydrophobicContact CD2-CG1 4.43Å; L297-I301 WeakPolarHBondContact O-CB 3.32Å; L297-I301 VanDerWaalsContact O-CG1 3.28Å; L297-I301 WeakPolarHBondContact O-CG1 3.36Å; L297-I301 PolarHBondContact O-N 3.42Å; L297-F393 HydrophobicContact CD1-CD1 3.75Å; L297-F393 HydrophobicContact CD1-CE1 3.61Å; L297-F393 HydrophobicContact CD1-CE2 4.4Å; L297-F393 HydrophobicContact CD1-CG 4.21Å; L297-F393 HydrophobicContact CD1-CZ 3.95Å; L297-F393 HydrophobicContact CD2-CD2 4.28Å; L297-F393 HydrophobicContact CD2-CE2 3.92Å; L297-F393 HydrophobicContact CD2-CZ 4.04Å; L297-F393 HydrophobicContact CG-CE1 4.41Å; L297-F393 HydrophobicContact CG-CZ 4.29Å; L297-L397 HydrophobicContact CD2-CD1 4.48Å
298	S	94.7	Very high	95.5	Very high	68 Å²	68	41.8 Å²	41.8	48%	0.476	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-20.5	-179.4	60.7	0	0	0	0	114	H296 P302	H296-S298 VanDerWaalsContact C-N 3.29Å; H296-S298 PolarHBondContact O-N 3.24Å; S298-P302 WeakPolarHBondContact O-CD 3.26Å
299	Q	96.5	Very high	95.5	Very high	113 Å²	113	43.6 Å²	43.6	53%	0.528	25%	0.249	S	C	.	.	H	α-helix	trans	-99.8	-39.9	176.8	-57.9	179.5	17.1	0	0	111.6	L262 H296 L297 P302 V303	L262-Q299 HydrophobicContact CD2-CB 3.85Å; H296-Q299 PolarHBondContact O-N 3.01Å; L297-Q299 PolarHBondContact O-N 3.28Å; Q299-P302 WeakPolarHBondContact O-CD 3.44Å; Q299-V303 WeakPolarHBondContact O-CG2 3.28Å
300	L	97.7	Very high	95.3	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-45.7	-178.9	176.8	59.5	0	0	0	112.4	L262 W280 L293 H296 L297 V303 L304 L389	L262-L300 HydrophobicContact CD1-CB 4.2Å; L262-L300 HydrophobicContact CD1-CD1 3.95Å; W280-L300 HydrophobicContact CD2-CD1 3.61Å; W280-L300 HydrophobicContact CD2-CD2 3.96Å; W280-L300 HydrophobicContact CD2-CG 4.46Å; W280-L300 VanDerWaalsContact CE2-CD1 3.44Å; W280-L300 HydrophobicContact CE3-CD1 4.12Å; W280-L300 HydrophobicContact CE3-CD2 3.74Å; W280-L300 HydrophobicContact CG-CD1 3.99Å; W280-L300 HydrophobicContact CG-CD2 4.44Å; W280-L300 HydrophobicContact CH2-CD1 4.32Å; W280-L300 HydrophobicContact CZ2-CD1 3.83Å; W280-L300 HydrophobicContact CZ3-CD1 4.45Å; W280-L300 HydrophobicContact CZ3-CD2 4.17Å; L293-L300 HydrophobicContact CD1-CD2 4.18Å; L293-L300 HydrophobicContact CD2-CD2 4.26Å; H296-L300 PolarHBondContact O-N 3.14Å; L297-L300 PolarHBondContact O-N 2.65Å; L300-V303 WeakPolarHBondContact O-CA 3.47Å; L300-V303 WeakPolarHBondContact O-CB 3.24Å; L300-V303 PolarHBondContact O-N 3.4Å; L300-L304 HydrophobicContact CD1-CD1 4.13Å; L300-L304 HydrophobicContact CD1-CD2 4.15Å; L300-L304 HydrophobicContact CD1-CG 3.87Å; L300-L304 HydrophobicContact CD2-CD1 4.47Å; L300-L304 HydrophobicContact CG-CD1 4.01Å; L300-L304 HydrophobicContact CG-CG 4.17Å; L300-L304 PolarHBondContact O-N 3.04Å; L300-L389 HydrophobicContact CD2-CD1 4.15Å
301	I	97.8	Very high	95.1	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-47.1	-173.2	-63.4	-55.1	0	0	0	112.9	L297 V303 L304 V305 L386 L389 L397 H400 I401 L404	L297-I301 HydrophobicContact CD2-CD1 4.4Å; L297-I301 HydrophobicContact CD2-CG1 4.43Å; L297-I301 WeakPolarHBondContact O-CB 3.32Å; L297-I301 VanDerWaalsContact O-CG1 3.28Å; L297-I301 WeakPolarHBondContact O-CG1 3.36Å; L297-I301 PolarHBondContact O-N 3.42Å; I301-V303 PolarHBondContact O-N 2.79Å; I301-L304 PolarHBondContact O-N 3.28Å; I301-V305 HydrophobicContact CG2-CG2 4.3Å; I301-V305 WeakPolarHBondContact O-CB 3.45Å; I301-V305 VanDerWaalsContact O-CG2 3.26Å; I301-V305 WeakPolarHBondContact O-CG2 3.39Å; I301-V305 PolarHBondContact O-N 2.84Å; I301-L386 HydrophobicContact CD1-CD1 3.87Å; I301-L389 HydrophobicContact CD1-CD1 4.47Å; I301-L397 HydrophobicContact CD1-CD1 3.6Å; I301-L397 HydrophobicContact CG1-CD1 3.92Å; I301-H400 HydrophobicContact CB-CB 4.3Å; I301-H400 HydrophobicContact CG1-CB 4.33Å; I301-H400 HydrophobicContact CG2-CB 4.24Å; I301-I401 HydrophobicContact CG2-CD1 3.25Å; I301-I401 HydrophobicContact CG2-CG1 3.87Å; I301-L404 HydrophobicContact CG2-CD1 4.17Å
302	P	98	Very high	94.8	Very high	55 Å²	55	41.7 Å²	41.7	36%	0.357	24%	0.242	S	C	.	.	H	α-helix	trans	-58.6	-31.7	172.2	-25.5	33.9	0	0	0	114.5	S298 Q299 N306 L404	S298-P302 WeakPolarHBondContact O-CD 3.26Å; Q299-P302 WeakPolarHBondContact O-CD 3.44Å; P302-N306 WeakPolarHBondContact O-CB 3.18Å; P302-N306 PolarHBondContact O-N 3.1Å; P302-L404 HydrophobicContact CB-CD1 4.46Å; P302-L404 HydrophobicContact CG-CD1 4.27Å
303	V	98.3	Very high	94.3	Very high	18 Å²	18	45.3 Å²	45.3	11%	0.109	26%	0.259	C	S	.	.	H	α-helix	trans	-69.6	-49.4	178.7	170.8	0	0	0	0	110.6	L262 T265 Q266 Q299 L300 I301 N306 G307	L262-V303 HydrophobicContact CD1-CB 4.36Å; L262-V303 HydrophobicContact CD1-CG2 4.07Å; T265-V303 HydrophobicContact CG2-CG1 3.82Å; Q266-V303 VanDerWaalsContact CD-CG2 3.43Å; Q266-V303 HydrophobicContact CG-CB 4.39Å; Q266-V303 HydrophobicContact CG-CG1 3.57Å; Q266-V303 HydrophobicContact CG-CG2 3.89Å; Q299-V303 WeakPolarHBondContact O-CG2 3.28Å; L300-V303 WeakPolarHBondContact O-CA 3.47Å; L300-V303 WeakPolarHBondContact O-CB 3.24Å; L300-V303 PolarHBondContact O-N 3.4Å; I301-V303 PolarHBondContact O-N 2.79Å; V303-N306 PolarHBondContact O-N 3.43Å; V303-G307 PolarHBondContact O-N 3.06Å
304	L	98.3	Very high	93.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-49	176.3	-63.8	-179.5	0	0	0	111	W280 L300 I301 N306 G307 M308 S382 A385 L389	W280-L304 HydrophobicContact CG-CD2 4.36Å; L300-L304 HydrophobicContact CD1-CD1 4.13Å; L300-L304 HydrophobicContact CD1-CD2 4.15Å; L300-L304 HydrophobicContact CD1-CG 3.87Å; L300-L304 HydrophobicContact CD2-CD1 4.47Å; L300-L304 HydrophobicContact CG-CD1 4.01Å; L300-L304 HydrophobicContact CG-CG 4.17Å; L300-L304 PolarHBondContact O-N 3.04Å; I301-L304 PolarHBondContact O-N 3.28Å; L304-N306 PolarHBondContact O-N 2.8Å; L304-G307 WeakPolarHBondContact O-CA 3.39Å; L304-G307 PolarHBondContact O-N 3.02Å; L304-M308 VanDerWaalsContact O-CG 3.3Å; L304-M308 WeakPolarHBondContact O-CG 3.42Å; L304-M308 PolarHBondContact O-N 3.14Å; L304-S382 WeakPolarHBondContact O-CB 3.42Å; L304-A385 HydrophobicContact CD1-CB 4.38Å; L304-A385 HydrophobicContact CD2-CB 4.4Å; L304-L389 HydrophobicContact CD1-CD1 3.66Å
305	V	98.1	Very high	93.6	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-57.9	-34.4	177.6	168.6	0	0	0	0	112.1	I301 L386 I401 L404 L408 V423	I301-V305 HydrophobicContact CG2-CG2 4.3Å; I301-V305 WeakPolarHBondContact O-CB 3.45Å; I301-V305 VanDerWaalsContact O-CG2 3.26Å; I301-V305 WeakPolarHBondContact O-CG2 3.39Å; I301-V305 PolarHBondContact O-N 2.84Å; V305-L386 HydrophobicContact CG2-CD2 4.25Å; V305-I401 HydrophobicContact CG2-CD1 4.02Å; V305-L404 HydrophobicContact CB-CD1 4.28Å; V305-L404 HydrophobicContact CG1-CD1 4.33Å; V305-L404 HydrophobicContact CG2-CD1 4.04Å; V305-L408 HydrophobicContact CG1-CD1 3.56Å; V305-V423 HydrophobicContact CB-CG2 4.4Å; V305-V423 HydrophobicContact CG1-CG2 4.06Å; V305-V423 HydrophobicContact CG2-CG1 4.37Å; V305-V423 HydrophobicContact CG2-CG2 3.95Å
306	N	97.3	Very high	93.1	Very high	94 Å²	94	47 Å²	47	50%	0.503	25%	0.246	S	C	.	.	H	α-helix	trans	-73.4	-38.2	174.3	-176	74.1	0	0	0	112.7	P302 V303 L304 M308 K309	P302-N306 WeakPolarHBondContact O-CB 3.18Å; P302-N306 PolarHBondContact O-N 3.1Å; V303-N306 PolarHBondContact O-N 3.43Å; L304-N306 PolarHBondContact O-N 2.8Å; N306-M308 PolarHBondContact O-N 3.45Å; N306-K309 PolarHBondContact O-N 3.23Å; N306-K309 PolarHBondContact OD1-NZ 2.84Å
307	G	96.6	Very high	92.3	Very high	12 Å²	12	49.8 Å²	49.8	12%	0.124	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-23.6	175.5	0	0	0	0	0	113.5	V303 L304 K309 R379	V303-G307 PolarHBondContact O-N 3.06Å; L304-G307 WeakPolarHBondContact O-CA 3.39Å; L304-G307 PolarHBondContact O-N 3.02Å; G307-K309 PolarHBondContact O-N 2.82Å; G307-R379 WeakPolarHBondContact O-CA 3.45Å
308	M	96.7	Very high	91.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-3.1	177.9	-68.6	168.1	75	0	0	114.8	L304 N306 R379 A383 L386 L422 V423 A426	L304-M308 VanDerWaalsContact O-CG 3.3Å; L304-M308 WeakPolarHBondContact O-CG 3.42Å; L304-M308 PolarHBondContact O-N 3.14Å; N306-M308 PolarHBondContact O-N 3.45Å; M308-R379 WeakPolarHBondContact O-CD 3.42Å; M308-R379 WeakPolarHBondContact O-CG 3.37Å; M308-R379 PolarHBondContact O-NH1 3Å; M308-A383 HydrophobicContact CE-CB 3.78Å; M308-A383 HydrophobicContact CG-CB 4.21Å; M308-A383 HydrophobicContact SD-CB 4.49Å; M308-L386 HydrophobicContact CE-CD2 4.15Å; M308-L386 HydrophobicContact SD-CB 4.41Å; M308-L386 HydrophobicContact SD-CD2 3.68Å; M308-L422 HydrophobicContact CB-CD2 4.11Å; M308-L422 HydrophobicContact CE-CB 4.34Å; M308-L422 HydrophobicContact CE-CD2 3.79Å; M308-L422 HydrophobicContact CE-CG 3.54Å; M308-V423 HydrophobicContact CE-CB 4.24Å; M308-V423 HydrophobicContact CE-CG2 3.5Å; M308-V423 HydrophobicContact SD-CG2 3.61Å; M308-A426 HydrophobicContact CE-CB 4.22Å
309	K	95.8	Very high	90.2	Very high	67 Å²	67	53.1 Å²	53.1	29%	0.291	27%	0.268	S	S	.	.	S	Bend	trans	-77.3	145.2	174.7	-67.5	169	-169.7	162.7	0	110.5	N306 G307 S311 V415	N306-K309 PolarHBondContact O-N 3.23Å; N306-K309 PolarHBondContact OD1-NZ 2.84Å; G307-K309 PolarHBondContact O-N 2.82Å; K309-S311 PolarHBondContact O-N 3.1Å; K309-V415 HydrophobicContact CB-CG1 4.26Å
310	Y	91.4	Very high	88.6	Confident	45 Å²	45	48.1 Å²	48.1	18%	0.176	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-59.6	137.1	169.7	-77.4	-64.9	0	0	0	111.2	D314 L318 R379 W414 E418 L456	Y310-D314 HydrophobicContact CD1-CB 3.81Å; Y310-L318 HydrophobicContact CD1-CD1 3.92Å; Y310-L318 HydrophobicContact CE1-CD1 3.38Å; Y310-R379 VanDerWaalsContact CD2-NH1 3.31Å; Y310-R379 VanDerWaalsContact CZ-NH2 3.29Å; Y310-R379 PolarHBondContact OH-NH2 3.28Å; Y310-W414 HydrophobicContact CD2-CZ3 4.43Å; Y310-E418 HydrophobicContact CE2-CG 4.27Å; Y310-L456 HydrophobicContact CE2-CD1 4.35Å
311	S	89.6	Confident	87.1	Confident	21 Å²	21	54.3 Å²	54.3	15%	0.147	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-71.1	160.8	168.9	75	0	0	0	0	110.4	K309 I313 D314 I315	K309-S311 PolarHBondContact O-N 3.1Å; S311-I313 PolarHBondContact O-N 3.28Å; S311-I313 PolarHBondContact OG-N 2.97Å; S311-D314 WeakPolarHBondContact CB-OD2 3.44Å; S311-D314 PolarHBondContact N-OD2 3.28Å; S311-D314 PolarHBondContact O-N 2.86Å; S311-D314 PolarHBondContact OG-N 2.97Å; S311-D314 PolarHBondContact OG-OD1 3.11Å; S311-D314 PolarHBondContact OG-OD2 2.91Å; S311-I315 VanDerWaalsContact O-CG1 3.32Å; S311-I315 WeakPolarHBondContact O-CG1 3.48Å; S311-I315 PolarHBondContact O-N 2.78Å
312	E	86.8	Confident	86.2	Confident	164 Å²	164	57.1 Å²	57.1	77%	0.766	29%	0.294	S	S	*	.	H	α-helix	trans	-60.3	-33.1	174.3	-66.9	-174	173.3	0	0	111.7	I316	E312-I316 WeakPolarHBondContact O-CD1 3.41Å; E312-I316 VanDerWaalsContact O-CG1 3.25Å; E312-I316 WeakPolarHBondContact O-CG1 3.22Å; E312-I316 PolarHBondContact O-N 3.31Å
313	I	84.4	Confident	85.7	Confident	101 Å²	101	56.8 Å²	56.8	52%	0.518	29%	0.288	S	S	.	.	H	α-helix	trans	-67.3	-46.1	178	-63.5	168.2	0	0	0	109.7	S311 I315 I316 L317	S311-I313 PolarHBondContact O-N 3.28Å; S311-I313 PolarHBondContact OG-N 2.97Å; I313-I315 VanDerWaalsContact C-N 3.34Å; I313-I315 PolarHBondContact O-N 3.49Å; I313-I316 WeakPolarHBondContact O-CB 3.46Å; I313-I316 PolarHBondContact O-N 2.91Å; I313-I316 VanDerWaalsContact O-N 3.14Å; I313-L317 HydrophobicContact CG2-CD1 3.68Å; I313-L317 HydrophobicContact CG2-CG 4.07Å; I313-L317 WeakPolarHBondContact O-CB 3.33Å; I313-L317 VanDerWaalsContact O-CG 3.31Å; I313-L317 WeakPolarHBondContact O-CG 3.42Å; I313-L317 PolarHBondContact O-N 3.16Å
314	D	82.9	Confident	85.1	Confident	25 Å²	25	63.1 Å²	63.1	13%	0.134	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-42.3	177.4	-59.2	-35.9	0	0	0	111.4	Y310 S311 I316 L317 L318	Y310-D314 HydrophobicContact CD1-CB 3.81Å; S311-D314 WeakPolarHBondContact CB-OD2 3.44Å; S311-D314 PolarHBondContact N-OD2 3.28Å; S311-D314 PolarHBondContact O-N 2.86Å; S311-D314 PolarHBondContact OG-N 2.97Å; S311-D314 PolarHBondContact OG-OD1 3.11Å; S311-D314 PolarHBondContact OG-OD2 2.91Å; D314-I316 PolarHBondContact O-N 3.32Å; D314-L317 PolarHBondContact O-N 3.3Å; D314-L318 HydrophobicContact CB-CD1 4.41Å; D314-L318 VanDerWaalsContact O-CB 3.25Å; D314-L318 WeakPolarHBondContact O-CB 3.46Å; D314-L318 WeakPolarHBondContact O-CG 3.44Å; D314-L318 PolarHBondContact O-N 2.8Å
315	I	85	Confident	84.7	Confident	36 Å²	36	64.6 Å²	64.6	19%	0.185	32%	0.324	C	S	.	.	H	α-helix	trans	-59	-39.2	177.6	-65.5	169.6	0	0	0	110.7	S311 I313 G320 W414 V415	S311-I315 VanDerWaalsContact O-CG1 3.32Å; S311-I315 WeakPolarHBondContact O-CG1 3.48Å; S311-I315 PolarHBondContact O-N 2.78Å; I313-I315 VanDerWaalsContact C-N 3.34Å; I313-I315 PolarHBondContact O-N 3.49Å; I315-G320 PolarHBondContact O-N 3.49Å; I315-W414 HydrophobicContact CD1-CH2 4.18Å; I315-W414 HydrophobicContact CD1-CZ2 4.06Å; I315-W414 HydrophobicContact CG1-CH2 4.02Å; I315-W414 HydrophobicContact CG1-CZ2 4.24Å; I315-W414 HydrophobicContact CG2-CH2 4.4Å; I315-W414 HydrophobicContact CG2-CZ2 4.1Å; I315-V415 HydrophobicContact CD1-CG2 3.86Å
316	I	81.8	Confident	84.3	Confident	128 Å²	128	67.5 Å²	67.5	66%	0.656	34%	0.337	S	S	*	.	H	α-helix	trans	-71	-47.2	177.4	-66.6	164.6	0	0	0	110.8	E312 I313 D314 K319	E312-I316 WeakPolarHBondContact O-CD1 3.41Å; E312-I316 VanDerWaalsContact O-CG1 3.25Å; E312-I316 WeakPolarHBondContact O-CG1 3.22Å; E312-I316 PolarHBondContact O-N 3.31Å; I313-I316 WeakPolarHBondContact O-CB 3.46Å; I313-I316 PolarHBondContact O-N 2.91Å; I313-I316 VanDerWaalsContact O-N 3.14Å; D314-I316 PolarHBondContact O-N 3.32Å; I316-K319 WeakPolarHBondContact O-CA 3.31Å; I316-K319 PolarHBondContact O-N 2.91Å
317	L	77.3	Confident	83.9	Confident	83 Å²	83	66.9 Å²	66.9	44%	0.435	35%	0.345	S	S	.	.	H	α-helix	trans	-64.1	-45.6	-176.7	-79.7	-177.4	0	0	0	112.1	I313 D314 K319 I373	I313-L317 HydrophobicContact CG2-CD1 3.68Å; I313-L317 HydrophobicContact CG2-CG 4.07Å; I313-L317 WeakPolarHBondContact O-CB 3.33Å; I313-L317 VanDerWaalsContact O-CG 3.31Å; I313-L317 WeakPolarHBondContact O-CG 3.42Å; I313-L317 PolarHBondContact O-N 3.16Å; D314-L317 PolarHBondContact O-N 3.3Å; L317-K319 PolarHBondContact O-N 3.15Å; L317-I373 VanDerWaalsContact C-CG2 3.42Å; L317-I373 HydrophobicContact CB-CG2 3.62Å; L317-I373 VanDerWaalsContact O-CG2 3.3Å; L317-I373 WeakPolarHBondContact O-CG2 3.44Å
318	L	73.8	Confident	83.6	Confident	22 Å²	22	70.8 Å²	70.8	12%	0.115	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	2.2	174.6	-59.3	173.6	0	0	0	112.8	Y310 D314 G320 I373 L456 R498	Y310-L318 HydrophobicContact CD1-CD1 3.92Å; Y310-L318 HydrophobicContact CE1-CD1 3.38Å; D314-L318 HydrophobicContact CB-CD1 4.41Å; D314-L318 VanDerWaalsContact O-CB 3.25Å; D314-L318 WeakPolarHBondContact O-CB 3.46Å; D314-L318 WeakPolarHBondContact O-CG 3.44Å; D314-L318 PolarHBondContact O-N 2.8Å; L318-G320 PolarHBondContact O-N 2.9Å; L318-I373 HydrophobicContact CD2-CG2 4.1Å; L318-L456 HydrophobicContact CD1-CD2 4.45Å; L318-R498 VanDerWaalsContact CD2-NH2 3.33Å
319	K	71	Confident	83.2	Confident	124 Å²	124	75 Å²	75	54%	0.539	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	47.7	-176	-54.6	173.4	-172.6	163.8	0	110.4	I316 L317 D321 I322	I316-K319 WeakPolarHBondContact O-CA 3.31Å; I316-K319 PolarHBondContact O-N 2.91Å; L317-K319 PolarHBondContact O-N 3.15Å; K319-D321 PolarHBondContact O-N 3.36Å; K319-I322 HydrophobicContact CB-CB 4.22Å; K319-I322 HydrophobicContact CB-CD1 3.5Å; K319-I322 HydrophobicContact CB-CG1 3.77Å; K319-I322 HydrophobicContact CD-CD1 3.44Å; K319-I322 VanDerWaalsContact CD-CD1 3.44Å; K319-I322 HydrophobicContact CG-CD1 3.96Å; K319-I322 WeakPolarHBondContact O-CB 3.01Å; K319-I322 PolarHBondContact O-N 3.34Å
320	G	61.3	Low	82.7	Confident	7 Å²	7	73 Å²	73	7%	0.072	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	0.9	-171.1	0	0	0	0	0	116.8	I315 L318 K454	I315-G320 PolarHBondContact O-N 3.49Å; L318-G320 PolarHBondContact O-N 2.9Å; G320-K454 PolarHBondContact O-NZ 3.23Å
321	D	66.3	Low	82.2	Confident	131 Å²	131	75.5 Å²	75.5	70%	0.701	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-4.1	169.1	-74.4	-33.4	0	0	0	113.9	K319 E323 K454	K319-D321 PolarHBondContact O-N 3.36Å; D321-E323 PolarHBondContact O-N 3.07Å; D321-K454 IonicContact OD1-NZ 2.61Å; D321-K454 PolarHBondContact OD1-NZ 2.86Å
322	I	80.1	Confident	81.4	Confident	60 Å²	60	83.1 Å²	83.1	31%	0.308	43%	0.431	S	S	.	.			trans	-84.3	105.9	174.1	-62.6	-173.3	0	0	0	109.1	K319 D325 N496	K319-I322 HydrophobicContact CB-CB 4.22Å; K319-I322 HydrophobicContact CB-CD1 3.5Å; K319-I322 HydrophobicContact CB-CG1 3.77Å; K319-I322 HydrophobicContact CD-CD1 3.44Å; K319-I322 VanDerWaalsContact CD-CD1 3.44Å; K319-I322 HydrophobicContact CG-CD1 3.96Å; K319-I322 WeakPolarHBondContact O-CB 3.01Å; K319-I322 PolarHBondContact O-N 3.34Å; I322-D325 HydrophobicContact CG2-CB 3.84Å; I322-N496 PolarHBondContact O-ND2 3.03Å
323	E	86.1	Confident	80.6	Confident	47 Å²	47	83.5 Å²	83.5	22%	0.22	43%	0.433	C	S	.	.			trans	-92.6	-12.6	174	-66.2	-62.8	146.6	0	0	113	D321 K453 K454 A455 R458 S495	D321-E323 PolarHBondContact O-N 3.07Å; E323-K453 VanDerWaalsContact OE2-O 3.04Å; E323-K454 WeakPolarHBondContact OE1-CA 3.23Å; E323-A455 PolarHBondContact OE1-N 2.85Å; E323-A455 WeakPolarHBondContact OE2-CB 3.25Å; E323-A455 PolarHBondContact OE2-N 2.96Å; E323-R458 IonicContact OE2-CZ 3.33Å; E323-R458 IonicContact OE2-NH1 2.61Å; E323-R458 PolarHBondContact OE2-NH1 3.38Å; E323-R458 IonicContact OE2-NH2 2.99Å; E323-R458 PolarHBondContact OE2-NH2 3.14Å; E323-S495 PolarHBondContact O-OG 3.14Å
324	E	87.3	Confident	79.9	Confident	152 Å²	152	80.7 Å²	80.7	71%	0.71	42%	0.419	S	S	*	.			trans	-139.7	108.6	-175.4	-59.8	-176.3	-173.5	0	0	110.9	S495	E324-S495 WeakPolarHBondContact CA-O 3.38Å
325	D	90.1	Very high	79.3	Confident	31 Å²	31	81.6 Å²	81.6	17%	0.166	42%	0.424	C	S	.	.			trans	-142.7	10	174.9	68.8	-22.4	0	0	0	114.1	I322 A327 I328 S495 N496 K497	I322-D325 HydrophobicContact CG2-CB 3.84Å; D325-A327 PolarHBondContact O-N 2.71Å; D325-I328 HydrophobicContact CB-CD1 3.86Å; D325-I328 HydrophobicContact CB-CG1 4.26Å; D325-I328 WeakPolarHBondContact O-CB 3.44Å; D325-I328 PolarHBondContact O-N 3.28Å; D325-S495 PolarHBondContact N-O 3.37Å; D325-N496 VanDerWaalsContact OD1-CA 3.25Å; D325-N496 WeakPolarHBondContact OD1-CA 3.38Å; D325-K497 PolarHBondContact OD1-N 3.01Å; D325-K497 WeakPolarHBondContact OD2-CE 3.48Å
326	E	88.6	Confident	78.3	Confident	68 Å²	68	82.7 Å²	82.7	32%	0.318	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-30.5	178.1	61.8	176.3	-146.5	0	0	114.8	S495 K535 Q537	E326-S495 WeakPolarHBondContact CB-O 3.32Å; E326-S495 PolarHBondContact N-O 2.89Å; E326-S495 VanDerWaalsContact OE2-CA 3.27Å; E326-S495 WeakPolarHBondContact OE2-CA 3.09Å; E326-K535 WeakPolarHBondContact OE2-CE 3.45Å; E326-K535 IonicContact OE2-NZ 3.12Å; E326-K535 PolarHBondContact OE2-NZ 3.01Å; E326-Q537 WeakPolarHBondContact O-CG 3.3Å; E326-Q537 PolarHBondContact O-NE2 3.12Å
327	A	89.9	Confident	77.3	Confident	80 Å²	80	81 Å²	81	66%	0.661	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-2.4	-177.5	0	0	0	0	0	113.2	D325 P329	D325-A327 PolarHBondContact O-N 2.71Å; A327-P329 WeakPolarHBondContact O-CD 3.44Å
328	I	88.9	Confident	76.8	Confident	95 Å²	95	79.7 Å²	79.7	49%	0.487	41%	0.412	S	S	.	.	S	Bend	trans	-91.2	115	-178.9	-55	-176.8	0	0	0	108.2	D325 K497	D325-I328 HydrophobicContact CB-CD1 3.86Å; D325-I328 HydrophobicContact CB-CG1 4.26Å; D325-I328 WeakPolarHBondContact O-CB 3.44Å; D325-I328 PolarHBondContact O-N 3.28Å; I328-K497 PolarHBondContact O-NZ 2.91Å
329	P	88.4	Confident	76.7	Confident	87 Å²	87	85.3 Å²	85.3	57%	0.565	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-55.3	145.3	176.8	-24	34.2	0	0	0	111.8	A327	A327-P329 WeakPolarHBondContact O-CD 3.44Å
330	D	85.4	Confident	76.8	Confident	27 Å²	27	80 Å²	80	14%	0.144	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-68.7	145.4	174.2	-57.5	-47	0	0	0	110.5	I335 K497 Q537 H538 K539	D330-I335 HydrophobicContact CB-CD1 4.37Å; D330-I335 HydrophobicContact CB-CG1 4.43Å; D330-K497 IonicContact OD1-NZ 2.66Å; D330-K497 PolarHBondContact OD1-NZ 3Å; D330-Q537 WeakPolarHBondContact OD2-CB 3.4Å; D330-H538 PolarHBondContact OD2-N 2.82Å; D330-K539 PolarHBondContact OD2-N 3.12Å
331	N	81.1	Confident	77.1	Confident	97 Å²	97	84.9 Å²	84.9	52%	0.519	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-78.7	143.5	171.1	-54.2	-62.6	0	0	0	109	Q333 D334	N331-Q333 PolarHBondContact O-N 3.02Å; N331-D334 WeakPolarHBondContact CB-OD2 3.36Å; N331-D334 PolarHBondContact ND2-OD2 3.11Å; N331-D334 WeakPolarHBondContact O-CB 3.33Å; N331-D334 PolarHBondContact O-N 3.13Å
332	E	73.7	Confident	76.9	Confident	180 Å²	180	79.4 Å²	79.4	84%	0.841	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.8	176.2	-67.4	177.5	179.7	0	0	113.3
333	Q	69.6	Low	76.8	Confident	173 Å²	173	80.3 Å²	80.3	81%	0.808	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-17	177.1	-63.5	177.7	0.1	0	0	113.4	N331	N331-Q333 PolarHBondContact O-N 3.02Å
334	D	68.8	Low	76.3	Confident	42 Å²	42	80.7 Å²	80.7	23%	0.225	41%	0.406	C	S	.	.	S	Bend	trans	-91.6	-5.4	178.7	-55.6	-26.1	0	0	0	111.3	N331	N331-D334 WeakPolarHBondContact CB-OD2 3.36Å; N331-D334 PolarHBondContact ND2-OD2 3.11Å; N331-D334 WeakPolarHBondContact O-CB 3.33Å; N331-D334 PolarHBondContact O-N 3.13Å
335	I	70.1	Confident	75.8	Confident	43 Å²	43	74.2 Å²	74.2	22%	0.221	38%	0.377	C	S	.	.	S	Bend	trans	-96.7	114.1	179.9	-61.8	162.1	0	0	0	108	D330 H538	D330-I335 HydrophobicContact CB-CD1 4.37Å; D330-I335 HydrophobicContact CB-CG1 4.43Å; I335-H538 HydrophobicContact CD1-CB 4.3Å; I335-H538 WeakPolarHBondContact CD1-CD2 3.33Å; I335-H538 WeakPolarHBondContact CD1-NE2 3.29Å; I335-H538 WeakPolarHBondContact CG2-NE2 3.28Å
336	R	65.1	Low	75.3	Confident	59 Å²	59	75.6 Å²	75.6	22%	0.223	39%	0.393	C	S	.	.			trans	-78	148.8	-176.2	-62.2	-161.5	-157.1	149.5	24.4	112.6	R338 D367 D368 D370	R336-R338 PolarHBondContact O-N 3.49Å; R336-R338 VanDerWaalsContact O-N 3.07Å; R336-D367 PolarHBondContact NH1-O 3.38Å; R336-D368 VanDerWaalsContact CZ-O 3.29Å; R336-D368 VanDerWaalsContact NH1-CA 3.26Å; R336-D368 PolarHBondContact NH1-O 3.39Å; R336-D368 VanDerWaalsContact NH1-O 3.08Å; R336-D368 PolarHBondContact NH2-O 3.02Å; R336-D370 VanDerWaalsContact CZ-CA 3.44Å; R336-D370 VanDerWaalsContact CZ-O 3.25Å; R336-D370 PolarHBondContact NE-O 3.2Å
337	P	60.3	Low	74.9	Confident	94 Å²	94	73 Å²	73	61%	0.61	38%	0.381	S	S	*	.			trans	-61.8	111.3	166.1	-16	29.9	0	0	0	109.4	F339	P337-F339 HydrophobicContact CB-CE2 4.19Å; P337-F339 HydrophobicContact CB-CZ 4.27Å
338	R	66	Low	73.9	Confident	55 Å²	55	75.2 Å²	75.2	21%	0.208	38%	0.378	C	S	.	.			trans	-89	145	167.3	-76.8	-172.4	164.8	-164.7	-7.3	110.2	R336 D546 F587	R336-R338 PolarHBondContact O-N 3.49Å; R336-R338 VanDerWaalsContact O-N 3.07Å; R338-D546 IonicContact CZ-OD2 3.52Å; R338-D546 IonicContact NH1-OD1 2.67Å; R338-D546 IonicContact NH1-OD2 3.59Å; R338-D546 PolarHBondContact NH1-OD2 3.19Å; R338-D546 IonicContact NH2-OD2 3.43Å; R338-F587 WeakPolarHBondContact O-CD2 3.24Å; R338-F587 WeakPolarHBondContact O-CE2 3.44Å
339	F	73.3	Confident	72.6	Confident	140 Å²	140	72.7 Å²	72.7	61%	0.614	36%	0.364	S	S	*	.			trans	-120.9	144.9	174.3	-59	-85.3	0	0	0	108.1	P337 D642	P337-F339 HydrophobicContact CB-CE2 4.19Å; P337-F339 HydrophobicContact CB-CZ 4.27Å; F339-D642 WeakPolarHBondContact CA-OD2 3.41Å; F339-D642 WeakPolarHBondContact CB-OD2 3.44Å; F339-D642 VanDerWaalsContact CD1-OD2 3.32Å; F339-D642 WeakPolarHBondContact CD1-OD2 3.26Å
340	H	73	Confident	70.5	Confident	13 Å²	13	73.8 Å²	73.8	6%	0.06	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-86.5	134.1	-178.3	170.8	62.1	0	0	0	110.8	F587 E591 D642 I645 V646 D649	H340-F587 HydrophobicContact CB-CB 4.33Å; H340-F587 HydrophobicContact CB-CD2 4.48Å; H340-F587 HydrophobicContact CB-CG 4.26Å; H340-E591 IonicContact CE1-OE1 2.82Å; H340-E591 PolarHBondContact CE1-OE1 2.99Å; H340-E591 IonicContact CG-OE1 2.65Å; H340-E591 VanDerWaalsContact ND1-CD 3.33Å; H340-E591 WeakPolarHBondContact ND1-CG 3.45Å; H340-E591 IonicContact ND1-OE1 3.87Å; H340-E591 PolarHBondContact ND1-OE1 3.18Å; H340-D642 HydrophobicContact CB-CB 4.16Å; H340-D642 PolarHBondContact N-OD2 2.86Å; H340-I645 WeakPolarHBondContact CD2-CG2 3.36Å; H340-I645 WeakPolarHBondContact NE2-CG2 3.25Å; H340-V646 HydrophobicContact CB-CB 4.3Å; H340-V646 VanDerWaalsContact CD2-CA 3.48Å; H340-V646 WeakPolarHBondContact CD2-CA 3.47Å; H340-V646 PolarHBondContact CD2-N 3.31Å; H340-V646 VanDerWaalsContact NE2-CA 3.32Å; H340-V646 WeakPolarHBondContact NE2-CA 3.41Å; H340-V646 PolarHBondContact NE2-N 2.96Å; H340-D649 IonicContact CE1-OD2 2.92Å; H340-D649 IonicContact NE2-OD2 2.82Å; H340-D649 PolarHBondContact NE2-OD2 2.99Å
341	R	67.3	Low	68.4	Low	108 Å²	108	76.1 Å²	76.1	41%	0.408	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-95.4	128	174.2	-65.1	-172.7	-175.9	179	7.1	110.7	D361 M364 D365	R341-D361 PolarHBondContact NH1-O 3.19Å; R341-M364 VanDerWaalsContact NH2-C 3.28Å; R341-M364 PolarHBondContact NH2-O 3.28Å; R341-M364 VanDerWaalsContact NH2-O 3.17Å; R341-D365 IonicContact CZ-OD1 2.79Å; R341-D365 IonicContact NH1-OD1 2.74Å; R341-D365 IonicContact NH2-OD1 3.09Å; R341-D365 PolarHBondContact NH2-OD1 3.17Å
342	S	61.2	Low	66.3	Low	17 Å²	17	77.4 Å²	77.4	12%	0.119	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-63.5	138.6	179.7	-79.6	0	0	0	0	113.3	T344 I645 E685 Q688 S689	S342-T344 PolarHBondContact O-N 3.08Å; S342-I645 WeakPolarHBondContact OG-CG2 3.26Å; S342-E685 VanDerWaalsContact OG-C 3.31Å; S342-E685 WeakPolarHBondContact OG-CA 3.31Å; S342-E685 VanDerWaalsContact OG-CB 3.27Å; S342-E685 WeakPolarHBondContact OG-CB 3.48Å; S342-E685 PolarHBondContact OG-O 2.72Å; S342-Q688 PolarHBondContact O-NE2 2.95Å; S342-S689 PolarHBondContact OG-OG 3.33Å; S342-S689 VanDerWaalsContact OG-OG 3.1Å
343	R	78.3	Confident	64.5	Low	79 Å²	79	70.2 Å²	70.2	30%	0.298	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-61.9	126.4	176.5	-172.2	179.5	-177.4	-166.7	0.3	113.3	D649 E656 Q688 D696 N730	R343-D649 HydrophobicContact CB-CB 4.47Å; R343-D649 WeakPolarHBondContact CB-OD2 3.4Å; R343-D649 PolarHBondContact N-OD2 3.36Å; R343-E656 IonicContact CZ-OE2 2.76Å; R343-E656 VanDerWaalsContact CZ-OE2 3.26Å; R343-E656 IonicContact NH1-OE2 3.5Å; R343-E656 PolarHBondContact NH1-OE2 3.12Å; R343-E656 IonicContact NH2-OE1 3.73Å; R343-E656 IonicContact NH2-OE2 2.81Å; R343-E656 PolarHBondContact NH2-OE2 3.31Å; R343-Q688 VanDerWaalsContact C-NE2 3.26Å; R343-Q688 PolarHBondContact O-NE2 3.12Å; R343-D696 IonicContact NH1-OD2 3.68Å; R343-N730 PolarHBondContact O-ND2 2.87Å
344	T	76.9	Confident	62.9	Low	54 Å²	54	67.1 Å²	67.1	33%	0.331	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-99.7	128.9	168.9	-59.2	0	0	0	0	110.2	S342 A346 Q688	S342-T344 PolarHBondContact O-N 3.08Å; T344-A346 PolarHBondContact O-N 3.08Å; T344-Q688 PolarHBondContact OG1-NE2 3.26Å; T344-Q688 VanDerWaalsContact OG1-NE2 3.1Å
345	V	75.6	Confident	61.1	Low	16 Å²	16	73.1 Å²	73.1	10%	0.097	39%	0.387	C	S	.	.			trans	-80.2	113.7	178.4	-179.2	0	0	0	0	110.4	A692 N729 N730 W733 T769 N773	V345-A692 HydrophobicContact CG2-CB 4.25Å; V345-N729 PolarHBondContact O-ND2 2.94Å; V345-N730 PolarHBondContact N-OD1 3.24Å; V345-W733 HydrophobicContact CB-CD2 4.38Å; V345-W733 HydrophobicContact CB-CG 4.41Å; V345-W733 HydrophobicContact CG1-CD2 3.82Å; V345-W733 HydrophobicContact CG1-CE3 4.39Å; V345-W733 HydrophobicContact CG1-CG 3.86Å; V345-W733 HydrophobicContact CG1-CZ2 4.42Å; V345-W733 HydrophobicContact CG2-CD2 4.28Å; V345-W733 HydrophobicContact CG2-CE3 4.01Å; V345-W733 HydrophobicContact CG2-CZ3 4.23Å; V345-T769 WeakPolarHBondContact O-CG2 3.46Å; V345-N773 PolarHBondContact O-ND2 2.78Å
346	A	80.3	Confident	59.3	Low	60 Å²	60	78.8 Å²	78.8	50%	0.496	41%	0.413	S	S	.	.			trans	-120	163.3	-178	0	0	0	0	0	114	T344 T769	T344-A346 PolarHBondContact O-N 3.08Å; A346-T769 HydrophobicContact CB-CG2 3.68Å
347	Q	79.4	Confident	57.8	Low	14 Å²	14	79.9 Å²	79.9	7%	0.065	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-99	154.1	176.1	-65.3	-66.2	-52.7	0	0	111	E772 I776 I807 N810 E812	Q347-E772 WeakPolarHBondContact CB-OE2 3.46Å; Q347-E772 HydrophobicContact CG-CB 4.28Å; Q347-I776 HydrophobicContact CG-CD1 3.91Å; Q347-I807 HydrophobicContact CB-CG2 4.04Å; Q347-I807 HydrophobicContact CG-CG2 4.41Å; Q347-N810 PolarHBondContact OE1-ND2 3.48Å; Q347-E812 VanDerWaalsContact CD-OE2 3.31Å; Q347-E812 VanDerWaalsContact NE2-CD 3.3Å; Q347-E812 PolarHBondContact NE2-OE2 2.89Å; Q347-E812 PolarHBondContact OE1-OE2 3.31Å
348	Q	69.5	Low	56.7	Low	127 Å²	127	79 Å²	79	59%	0.593	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-91	139.6	176.6	-65	-176.7	-4.5	0	0	112.1	R808	Q348-R808 HydrophobicContact CB-CG 4.43Å; Q348-R808 WeakPolarHBondContact O-CG 3.46Å; Q348-R808 PolarHBondContact O-N 3.09Å; Q348-R808 VanDerWaalsContact OE1-NH1 3.16Å
349	H	61.2	Low	55.2	Low	42 Å²	42	80.7 Å²	80.7	19%	0.194	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-103.3	147.2	179	-65.2	-57.2	0	0	0	114.1	K768 E772 N806 R808	H349-K768 PolarHBondContact CD2-NZ 2.98Å; H349-K768 WeakPolarHBondContact CE1-CE 3.5Å; H349-K768 PolarHBondContact CE1-NZ 3.43Å; H349-K768 PolarHBondContact ND1-NZ 2.71Å; H349-K768 VanDerWaalsContact NE2-CE 3.34Å; H349-K768 WeakPolarHBondContact NE2-CE 3.48Å; H349-K768 PolarHBondContact NE2-NZ 3.14Å; H349-E772 IonicContact CE1-OE1 3.26Å; H349-E772 PolarHBondContact CE1-OE1 2.66Å; H349-E772 IonicContact CE1-OE2 3.34Å; H349-E772 PolarHBondContact CE1-OE2 2.93Å; H349-E772 IonicContact NE2-OE1 2.85Å; H349-E772 IonicContact NE2-OE2 2.74Å; H349-N806 PolarHBondContact ND1-O 3.4Å; H349-R808 PolarHBondContact O-NE 3.36Å; H349-R808 PolarHBondContact O-NH2 3.02Å
350	E	43.9	Very low	53.2	Low	110 Å²	110	80.1 Å²	80.1	51%	0.514	43%	0.43	S	S	.	.	S	Bend	trans	-95.5	105.7	-177.9	-138.7	176.2	-118.4	0	0	109.9	R808	E350-R808 HydrophobicContact CB-CG 3.86Å; E350-R808 HydrophobicContact CG-CG 3.98Å
351	G	42.4	Very low	51.5	Low	75 Å²	75	84.1 Å²	84.1	77%	0.773	45%	0.452	S	S	*	.	S	Bend	trans	89.3	7.3	165.5	0	0	0	0	0	118.4
352	D	36.4	Very low	50.1	Low	124 Å²	124	83.5 Å²	83.5	66%	0.663	46%	0.457	S	S	*	.			trans	-100.6	121.1	165.1	-71.8	-27.7	0	0	0	108
353	G	35.9	Very low	48.6	Very low	30 Å²	30	89.7 Å²	89.7	31%	0.309	48%	0.484	S	S	.	.			trans	-56.4	139.4	148.5	0	0	0	0	0	106.5	E355	G353-E355 PolarHBondContact O-N 2.99Å
354	I	35.2	Very low	46.2	Very low	108 Å²	108	92.4 Å²	92.4	55%	0.554	50%	0.501	S	S	*	.	S	Bend	trans	-53.8	104.5	-170.4	-60.4	159.2	0	0	0	108.6	D358	I354-D358 HydrophobicContact CG2-CB 4.28Å; I354-D358 WeakPolarHBondContact CG2-OD2 3.36Å
355	E	32.3	Very low	44.1	Very low	168 Å²	168	93.8 Å²	93.8	79%	0.785	51%	0.507	S	S	*	.			trans	-125.3	124.2	169.5	-84.4	-170.1	-178	0	0	107.6	G353	G353-E355 PolarHBondContact O-N 2.99Å
356	E	31.6	Very low	42.2	Very low	161 Å²	161	99.8 Å²	99.8	75%	0.752	54%	0.538	S	S	*	.	S	Bend	trans	91.2	16.4	157.7	-57	-172.2	171.1	0	0	121.2
357	D	34	Very low	40.1	Very low	82 Å²	82	103.4 Å²	103.4	44%	0.439	55%	0.549	S	S	.	.	S	Bend	trans	-140.1	-3.2	168.4	-99.7	-15.4	0	0	0	115.3	K768	D357-K768 VanDerWaalsContact OD2-CB 3.26Å; D357-K768 WeakPolarHBondContact OD2-CB 3.48Å; D357-K768 PolarHBondContact OD2-N 3.18Å
358	D	36.4	Very low	38.3	Very low	75 Å²	75	106.6 Å²	106.6	40%	0.401	57%	0.567	S	S	.	*	S	Bend	trans	-88.9	-8.5	173.2	-78.1	-13.3	0	0	0	112.8	I354 D360 D361 D362	I354-D358 HydrophobicContact CG2-CB 4.28Å; I354-D358 WeakPolarHBondContact CG2-OD2 3.36Å; D358-D360 PolarHBondContact O-N 2.96Å; D358-D361 PolarHBondContact O-N 2.9Å; D358-D362 PolarHBondContact O-N 2.95Å
359	D	34	Very low	37	Very low	92 Å²	92	104.8 Å²	104.8	49%	0.492	56%	0.561	S	S	.	*	H	α-helix	trans	-62.3	-28	178.8	-67.1	-24.7	0	0	0	112.6	E363	D359-E363 WeakPolarHBondContact O-CB 3.37Å; D359-E363 VanDerWaalsContact O-CG 3.31Å; D359-E363 WeakPolarHBondContact O-CG 3.34Å; D359-E363 PolarHBondContact O-N 3.2Å; D359-E363 VanDerWaalsContact O-N 3.16Å
360	D	33.2	Very low	36.2	Very low	127 Å²	127	107.4 Å²	107.4	68%	0.679	58%	0.576	S	S	*	*	H	α-helix	trans	-76	-21.5	176.2	-87.7	-12.3	0	0	0	112.8	D358	D358-D360 PolarHBondContact O-N 2.96Å
361	D	37.3	Very low	36.3	Very low	97 Å²	97	103.4 Å²	103.4	52%	0.519	56%	0.559	S	S	.	*	H	α-helix	trans	-95.1	-28.8	176.8	-84.2	-27.7	0	0	0	111.5	R341 D358	R341-D361 PolarHBondContact NH1-O 3.19Å; D358-D361 PolarHBondContact O-N 2.9Å
362	D	36.1	Very low	36.2	Very low	96 Å²	96	104.5 Å²	104.5	51%	0.513	55%	0.55	S	S	.	*	H	α-helix	trans	-81.9	-22.8	176.9	-74.2	-17.6	0	0	0	113.4	D358 M364 D365	D358-D362 PolarHBondContact O-N 2.95Å; D362-M364 PolarHBondContact O-N 3.43Å; D362-D365 PolarHBondContact O-N 3.08Å
363	E	29.8	Very low	36.6	Very low	147 Å²	147	101.1 Å²	101.1	69%	0.687	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-15.1	175.9	-90.6	-172.3	-168.4	0	0	113.6	D359	D359-E363 WeakPolarHBondContact O-CB 3.37Å; D359-E363 VanDerWaalsContact O-CG 3.31Å; D359-E363 WeakPolarHBondContact O-CG 3.34Å; D359-E363 PolarHBondContact O-N 3.2Å; D359-E363 VanDerWaalsContact O-N 3.16Å
364	M	28.6	Very low	37.5	Very low	136 Å²	136	100.5 Å²	100.5	67%	0.67	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	2.9	174.1	-79.5	-159.7	-108.9	0	0	114.8	R341 D362	R341-M364 VanDerWaalsContact NH2-C 3.28Å; R341-M364 PolarHBondContact NH2-O 3.28Å; R341-M364 VanDerWaalsContact NH2-O 3.17Å; D362-M364 PolarHBondContact O-N 3.43Å
365	D	33.8	Very low	39.1	Very low	83 Å²	83	100.5 Å²	100.5	44%	0.444	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-4	169.6	-88.1	4.4	0	0	0	112.9	R341 D362 D367 D368	R341-D365 IonicContact CZ-OD1 2.79Å; R341-D365 IonicContact NH1-OD1 2.74Å; R341-D365 IonicContact NH2-OD1 3.09Å; R341-D365 PolarHBondContact NH2-OD1 3.17Å; D362-D365 PolarHBondContact O-N 3.08Å; D365-D367 PolarHBondContact O-N 3.22Å; D365-D368 VanDerWaalsContact O-CB 3.23Å; D365-D368 WeakPolarHBondContact O-CB 3.41Å; D365-D368 PolarHBondContact O-N 3.41Å
366	D	35.9	Very low	41.6	Very low	142 Å²	142	98.2 Å²	98.2	76%	0.759	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-69.6	-11.5	166.7	-92.2	-16.4	0	0	0	113.1	D368	D366-D368 PolarHBondContact O-N 3.46Å
367	D	34.7	Very low	44.3	Very low	136 Å²	136	92 Å²	92	73%	0.727	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-77.8	-3	168.4	-87.9	-19.7	0	0	0	112.7	R336 D365 D369	R336-D367 PolarHBondContact NH1-O 3.38Å; D365-D367 PolarHBondContact O-N 3.22Å; D367-D369 PolarHBondContact O-N 2.76Å; D367-D369 VanDerWaalsContact O-N 3.11Å
368	D	41.1	Very low	47.2	Very low	80 Å²	80	89.8 Å²	89.8	43%	0.428	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-78.6	13.1	179	-127.6	14	0	0	0	113.1	R336 D365 D366	R336-D368 VanDerWaalsContact CZ-O 3.29Å; R336-D368 VanDerWaalsContact NH1-CA 3.26Å; R336-D368 PolarHBondContact NH1-O 3.39Å; R336-D368 VanDerWaalsContact NH1-O 3.08Å; R336-D368 PolarHBondContact NH2-O 3.02Å; D365-D368 VanDerWaalsContact O-CB 3.23Å; D365-D368 WeakPolarHBondContact O-CB 3.41Å; D365-D368 PolarHBondContact O-N 3.41Å; D366-D368 PolarHBondContact O-N 3.46Å
369	D	42.8	Very low	50	Low	89 Å²	89	87.1 Å²	87.1	48%	0.476	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-118.8	9.9	-173.9	-136.5	27.9	0	0	0	117.2	D367 D371 S374 K380	D367-D369 PolarHBondContact O-N 2.76Å; D367-D369 VanDerWaalsContact O-N 3.11Å; D369-D371 PolarHBondContact O-N 2.79Å; D369-S374 WeakPolarHBondContact O-CB 3.45Å; D369-S374 PolarHBondContact O-OG 2.9Å; D369-K380 PolarHBondContact O-NZ 2.65Å; D369-K380 WeakPolarHBondContact OD2-CE 3.36Å; D369-K380 IonicContact OD2-NZ 3.89Å; D369-K380 PolarHBondContact OD2-NZ 3.35Å
370	D	45	Very low	52.7	Low	97 Å²	97	84.5 Å²	84.5	52%	0.519	44%	0.437	S	S	.	.			trans	-86.9	57.4	170.7	-148.4	20.1	0	0	0	114.9	R336 T372	R336-D370 VanDerWaalsContact CZ-CA 3.44Å; R336-D370 VanDerWaalsContact CZ-O 3.25Å; R336-D370 PolarHBondContact NE-O 3.2Å; D370-T372 PolarHBondContact O-N 3.04Å
371	D	46.8	Very low	55.6	Low	27 Å²	27	78.5 Å²	78.5	14%	0.144	40%	0.404	C	S	.	.			trans	-52.3	140.1	153.5	-100.9	-9.1	0	0	0	104.5	D369 I373 S374 R498 K539	D369-D371 PolarHBondContact O-N 2.79Å; D371-I373 HydrophobicContact CB-CB 4.45Å; D371-I373 PolarHBondContact O-N 3.45Å; D371-S374 PolarHBondContact O-N 3.45Å; D371-R498 IonicContact OD2-NH2 2.91Å; D371-R498 PolarHBondContact OD2-NH2 2.6Å; D371-K539 IonicContact OD1-NZ 3.79Å; D371-K539 PolarHBondContact OD1-NZ 3.47Å; D371-K539 VanDerWaalsContact OD1-NZ 3.1Å
372	T	39.6	Very low	58.5	Low	97 Å²	97	73.9 Å²	73.9	60%	0.595	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	9.5	174.3	54.7	0	0	0	0	114.8	D370	D370-T372 PolarHBondContact O-N 3.04Å
373	I	43.8	Very low	61.4	Low	54 Å²	54	70 Å²	70	28%	0.277	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-3	-175.7	-52.4	-176.8	0	0	0	110.1	L317 L318 D371	L317-I373 VanDerWaalsContact C-CG2 3.42Å; L317-I373 HydrophobicContact CB-CG2 3.62Å; L317-I373 VanDerWaalsContact O-CG2 3.3Å; L317-I373 WeakPolarHBondContact O-CG2 3.44Å; L318-I373 HydrophobicContact CD2-CG2 4.1Å; D371-I373 HydrophobicContact CB-CB 4.45Å; D371-I373 PolarHBondContact O-N 3.45Å
374	S	54.8	Low	64.4	Low	16 Å²	16	64.5 Å²	64.5	11%	0.112	34%	0.341	C	S	.	.			trans	-130.1	42.6	-171.4	-162.2	0	0	0	0	112.5	D369 D371 K380	D369-S374 WeakPolarHBondContact O-CB 3.45Å; D369-S374 PolarHBondContact O-OG 2.9Å; D371-S374 PolarHBondContact O-N 3.45Å; S374-K380 PolarHBondContact O-NZ 3.08Å; S374-K380 VanDerWaalsContact OG-CE 3.24Å; S374-K380 WeakPolarHBondContact OG-CE 3.49Å; S374-K380 PolarHBondContact OG-NZ 3.28Å
375	D	68.7	Low	67.7	Low	109 Å²	109	58 Å²	58	58%	0.583	31%	0.309	S	S	*	.			trans	-50.4	150.3	172.7	-68.6	-32.4	0	0	0	111.5	N377	D375-N377 WeakPolarHBondContact O-CB 3.21Å; D375-N377 PolarHBondContact O-N 3.01Å; D375-N377 VanDerWaalsContact O-N 3.11Å; D375-N377 PolarHBondContact O-ND2 2.77Å
376	W	85.3	Confident	70.7	Confident	119 Å²	119	54 Å²	54	45%	0.451	29%	0.287	S	S	.	.	S	Bend	trans	-51.5	118.9	170.6	-177.2	-110.6	0	0	0	110.4	E278 L281 K380 C381 A384	E278-W376 PolarHBondContact OE1-NE1 3.11Å; E278-W376 VanDerWaalsContact OE1-NE1 3.1Å; L281-W376 HydrophobicContact CD2-CZ2 4.36Å; W376-K380 HydrophobicContact CE3-CB 3.87Å; W376-K380 HydrophobicContact CE3-CD 4.27Å; W376-K380 HydrophobicContact CZ3-CB 3.89Å; W376-C381 HydrophobicContact CH2-CB 4.34Å; W376-C381 HydrophobicContact CZ2-CB 3.63Å; W376-A384 HydrophobicContact CH2-CB 3.99Å
377	N	89.5	Confident	73.6	Confident	30 Å²	30	48.8 Å²	48.8	16%	0.16	26%	0.259	C	S	.	.			trans	-138.7	173.3	-170.1	65.7	36	0	0	0	111.6	D375 R379 K380 C381	D375-N377 WeakPolarHBondContact O-CB 3.21Å; D375-N377 PolarHBondContact O-N 3.01Å; D375-N377 VanDerWaalsContact O-N 3.11Å; D375-N377 PolarHBondContact O-ND2 2.77Å; N377-R379 PolarHBondContact O-N 3.02Å; N377-R379 WeakPolarHBondContact OD1-CB 3.26Å; N377-R379 PolarHBondContact OD1-N 2.83Å; N377-R379 VanDerWaalsContact OD1-N 3.1Å; N377-K380 PolarHBondContact O-N 3.07Å; N377-K380 PolarHBondContact OD1-N 2.77Å; N377-C381 WeakPolarHBondContact O-CB 3.49Å; N377-C381 PolarHBondContact O-N 3.32Å
378	L	94.2	Very high	76.5	Confident	37 Å²	37	44.3 Å²	44.3	19%	0.194	24%	0.237	C	C	.	.	H	α-helix	trans	-58.2	-34.2	-176.1	-179.6	61.5	0	0	0	112.6	A273 C277 S382	A273-L378 HydrophobicContact CB-CD1 4.25Å; A273-L378 HydrophobicContact CB-CD2 3.87Å; C277-L378 HydrophobicContact CB-CD1 3.69Å; L378-S382 VanDerWaalsContact O-CB 3.23Å; L378-S382 WeakPolarHBondContact O-CB 3.44Å; L378-S382 PolarHBondContact O-N 3.43Å; L378-S382 PolarHBondContact O-OG 3.46Å
379	R	94.3	Very high	79.1	Confident	18 Å²	18	40.5 Å²	40.5	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-65.6	-50.7	178.5	163.6	177.8	172.9	115	-6.3	111.8	G307 M308 Y310 N377 S382 A383 E418 L422	G307-R379 WeakPolarHBondContact O-CA 3.45Å; M308-R379 WeakPolarHBondContact O-CD 3.42Å; M308-R379 WeakPolarHBondContact O-CG 3.37Å; M308-R379 PolarHBondContact O-NH1 3Å; Y310-R379 VanDerWaalsContact CD2-NH1 3.31Å; Y310-R379 VanDerWaalsContact CZ-NH2 3.29Å; Y310-R379 PolarHBondContact OH-NH2 3.28Å; N377-R379 PolarHBondContact O-N 3.02Å; N377-R379 WeakPolarHBondContact OD1-CB 3.26Å; N377-R379 PolarHBondContact OD1-N 2.83Å; N377-R379 VanDerWaalsContact OD1-N 3.1Å; R379-S382 PolarHBondContact O-N 2.85Å; R379-A383 WeakPolarHBondContact O-CB 3.45Å; R379-A383 PolarHBondContact O-N 3.48Å; R379-E418 IonicContact CZ-OE1 3.51Å; R379-E418 IonicContact CZ-OE2 3.38Å; R379-E418 IonicContact NH1-OE1 3.87Å; R379-E418 IonicContact NH1-OE2 3.58Å; R379-E418 PolarHBondContact NH1-OE2 3.21Å; R379-E418 IonicContact NH2-OE1 2.77Å; R379-E418 PolarHBondContact NH2-OE1 3.1Å; R379-E418 IonicContact NH2-OE2 2.77Å; R379-E418 PolarHBondContact NH2-OE2 3.16Å; R379-E418 VanDerWaalsContact NH2-OE2 3.14Å; R379-L422 HydrophobicContact CG-CD2 4.49Å
380	K	91.1	Very high	81.7	Confident	38 Å²	38	36.3 Å²	36.3	17%	0.165	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-49.5	177.3	-70.5	-177.3	169	-168	0	110.9	D369 S374 W376 N377 S382 A383 A384	D369-K380 PolarHBondContact O-NZ 2.65Å; D369-K380 WeakPolarHBondContact OD2-CE 3.36Å; D369-K380 IonicContact OD2-NZ 3.89Å; D369-K380 PolarHBondContact OD2-NZ 3.35Å; S374-K380 PolarHBondContact O-NZ 3.08Å; S374-K380 VanDerWaalsContact OG-CE 3.24Å; S374-K380 WeakPolarHBondContact OG-CE 3.49Å; S374-K380 PolarHBondContact OG-NZ 3.28Å; W376-K380 HydrophobicContact CE3-CB 3.87Å; W376-K380 HydrophobicContact CE3-CD 4.27Å; W376-K380 HydrophobicContact CZ3-CB 3.89Å; N377-K380 PolarHBondContact O-N 3.07Å; N377-K380 PolarHBondContact OD1-N 2.77Å; K380-S382 VanDerWaalsContact C-N 3.32Å; K380-S382 PolarHBondContact O-N 2.88Å; K380-A383 PolarHBondContact O-N 3.5Å; K380-A383 VanDerWaalsContact O-N 3.11Å; K380-A384 WeakPolarHBondContact O-CB 3.44Å; K380-A384 PolarHBondContact O-N 3.03Å
381	C	95.3	Very high	84	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.1	-41.6	178.4	-175.3	0	0	0	0	112.4	L274 C277 E278 W376 N377 A385	L274-C381 HydrophobicContact CD1-CB 3.64Å; C277-C381 VanDerWaalsContact C-SG 3.57Å; C277-C381 HydrophobicContact CB-CB 4.44Å; E278-C381 PolarHBondContact N-SG 2.87Å; E278-C381 VanDerWaalsContact N-SG 3.44Å; W376-C381 HydrophobicContact CH2-CB 4.34Å; W376-C381 HydrophobicContact CZ2-CB 3.63Å; N377-C381 WeakPolarHBondContact O-CB 3.49Å; N377-C381 PolarHBondContact O-N 3.32Å; C381-A385 VanDerWaalsContact O-CB 3.23Å; C381-A385 WeakPolarHBondContact O-CB 3.24Å; C381-A385 PolarHBondContact O-N 2.89Å
382	S	97.6	Very high	86.4	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-66.7	-36.7	176.9	-58.2	0	0	0	0	112.8	L304 L378 R379 K380 L386	L304-S382 WeakPolarHBondContact O-CB 3.42Å; L378-S382 VanDerWaalsContact O-CB 3.23Å; L378-S382 WeakPolarHBondContact O-CB 3.44Å; L378-S382 PolarHBondContact O-N 3.43Å; L378-S382 PolarHBondContact O-OG 3.46Å; R379-S382 PolarHBondContact O-N 2.85Å; K380-S382 VanDerWaalsContact C-N 3.32Å; K380-S382 PolarHBondContact O-N 2.88Å; S382-L386 WeakPolarHBondContact O-CB 3.14Å; S382-L386 PolarHBondContact O-N 2.94Å; S382-L386 VanDerWaalsContact O-N 3.08Å
383	A	95.9	Very high	89	Confident	15 Å²	15	30.6 Å²	30.6	12%	0.124	16%	0.16	C	C	.	.	H	α-helix	trans	-68.9	-48.8	176.8	0	0	0	0	0	111.3	M308 R379 K380 A385 L386 D387 L422	M308-A383 HydrophobicContact CE-CB 3.78Å; M308-A383 HydrophobicContact CG-CB 4.21Å; M308-A383 HydrophobicContact SD-CB 4.49Å; R379-A383 WeakPolarHBondContact O-CB 3.45Å; R379-A383 PolarHBondContact O-N 3.48Å; K380-A383 PolarHBondContact O-N 3.5Å; K380-A383 VanDerWaalsContact O-N 3.11Å; A383-A385 PolarHBondContact O-N 3.25Å; A383-L386 WeakPolarHBondContact O-CB 3.49Å; A383-L386 PolarHBondContact O-N 3.13Å; A383-L386 VanDerWaalsContact O-N 3.1Å; A383-D387 PolarHBondContact O-N 3.43Å; A383-L422 HydrophobicContact CB-CD1 4.45Å; A383-L422 HydrophobicContact CB-CD2 4.24Å
384	A	94.3	Very high	91.5	Very high	30 Å²	30	35.8 Å²	35.8	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-59.1	-46.6	176.2	0	0	0	0	0	111.4	L281 W376 K380 L386 D387 V388	L281-A384 HydrophobicContact CD1-CB 3.95Å; W376-A384 HydrophobicContact CH2-CB 3.99Å; K380-A384 WeakPolarHBondContact O-CB 3.44Å; K380-A384 PolarHBondContact O-N 3.03Å; A384-L386 VanDerWaalsContact C-N 3.27Å; A384-L386 PolarHBondContact O-N 2.92Å; A384-D387 PolarHBondContact O-N 3.21Å; A384-D387 VanDerWaalsContact O-N 3.17Å; A384-V388 WeakPolarHBondContact O-CG2 3.38Å; A384-V388 PolarHBondContact O-N 2.91Å
385	A	96.4	Very high	93.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-38.3	175.6	0	0	0	0	0	112	W280 L281 L304 C381 A383 L389	W280-A385 HydrophobicContact CB-CB 3.9Å; L281-A385 HydrophobicContact CB-CB 4.4Å; L304-A385 HydrophobicContact CD1-CB 4.38Å; L304-A385 HydrophobicContact CD2-CB 4.4Å; C381-A385 VanDerWaalsContact O-CB 3.23Å; C381-A385 WeakPolarHBondContact O-CB 3.24Å; C381-A385 PolarHBondContact O-N 2.89Å; A383-A385 PolarHBondContact O-N 3.25Å; A385-L389 VanDerWaalsContact O-CB 3.28Å; A385-L389 WeakPolarHBondContact O-CB 3.42Å; A385-L389 WeakPolarHBondContact O-CD1 3.47Å; A385-L389 WeakPolarHBondContact O-CG 3.46Å; A385-L389 PolarHBondContact O-N 2.63Å; A385-L389 VanDerWaalsContact O-N 3.07Å
386	L	98	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.2	-36.9	177.3	-176.2	62.2	0	0	0	112.4	I301 V305 M308 S382 A383 A384 L389 A390 L397 I401 V423 I427	I301-L386 HydrophobicContact CD1-CD1 3.87Å; V305-L386 HydrophobicContact CG2-CD2 4.25Å; M308-L386 HydrophobicContact CE-CD2 4.15Å; M308-L386 HydrophobicContact SD-CB 4.41Å; M308-L386 HydrophobicContact SD-CD2 3.68Å; S382-L386 WeakPolarHBondContact O-CB 3.14Å; S382-L386 PolarHBondContact O-N 2.94Å; S382-L386 VanDerWaalsContact O-N 3.08Å; A383-L386 WeakPolarHBondContact O-CB 3.49Å; A383-L386 PolarHBondContact O-N 3.13Å; A383-L386 VanDerWaalsContact O-N 3.1Å; A384-L386 VanDerWaalsContact C-N 3.27Å; A384-L386 PolarHBondContact O-N 2.92Å; L386-L389 PolarHBondContact O-N 3.06Å; L386-A390 WeakPolarHBondContact O-CB 3.15Å; L386-A390 PolarHBondContact O-N 3.47Å; L386-L397 HydrophobicContact CD1-CD2 4.09Å; L386-I401 HydrophobicContact CD1-CD1 4.04Å; L386-I401 HydrophobicContact CD2-CD1 4.21Å; L386-V423 HydrophobicContact CD2-CG1 4.04Å; L386-V423 HydrophobicContact CD2-CG2 4.27Å; L386-I427 HydrophobicContact CD2-CG2 4.18Å; L386-I427 HydrophobicContact CG-CG2 4.16Å
387	D	95.6	Very high	95.1	Very high	32 Å²	32	32.6 Å²	32.6	17%	0.171	17%	0.167	C	C	.	.	H	α-helix	trans	-63.4	-53.3	177.7	-161.1	-14.5	0	0	0	111.2	A383 A384 L389 A390 N391 A426 R467	A383-D387 PolarHBondContact O-N 3.43Å; A384-D387 PolarHBondContact O-N 3.21Å; A384-D387 VanDerWaalsContact O-N 3.17Å; D387-L389 VanDerWaalsContact C-N 3.27Å; D387-L389 PolarHBondContact O-N 3.26Å; D387-A390 WeakPolarHBondContact O-CA 3.47Å; D387-A390 VanDerWaalsContact O-CB 3.28Å; D387-A390 WeakPolarHBondContact O-CB 3.36Å; D387-A390 PolarHBondContact O-N 3.16Å; D387-N391 PolarHBondContact O-N 3.12Å; D387-A426 VanDerWaalsContact CA-O 3.28Å; D387-A426 WeakPolarHBondContact CA-O 3.24Å; D387-A426 WeakPolarHBondContact CB-O 3.49Å; D387-R467 IonicContact OD2-NH2 3.03Å; D387-R467 PolarHBondContact OD2-NH2 3.17Å
388	V	95.4	Very high	95.4	Very high	42 Å²	42	31.8 Å²	31.8	26%	0.255	16%	0.162	S	C	.	.	H	α-helix	trans	-61.2	-38.4	176.7	-171.5	0	0	0	0	111.1	L281 A284 A384 A390 N391 V392	L281-V388 HydrophobicContact CD1-CB 4.48Å; L281-V388 HydrophobicContact CD1-CG2 3.72Å; A284-V388 HydrophobicContact CB-CB 3.93Å; A284-V388 HydrophobicContact CB-CG1 3.46Å; A284-V388 VanDerWaalsContact CB-CG1 3.46Å; A384-V388 WeakPolarHBondContact O-CG2 3.38Å; A384-V388 PolarHBondContact O-N 2.91Å; V388-A390 VanDerWaalsContact C-N 3.33Å; V388-A390 PolarHBondContact O-N 3.11Å; V388-N391 PolarHBondContact O-N 3.21Å; V388-V392 VanDerWaalsContact O-CG2 3.32Å; V388-V392 WeakPolarHBondContact O-CG2 3.42Å; V388-V392 PolarHBondContact O-N 3.32Å
389	L	97	Very high	95.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-34.3	173.5	-74.2	170.9	0	0	0	112.8	A284 L293 L300 I301 L304 A385 L386 D387 V392 F393	A284-L389 HydrophobicContact CB-CD2 4.06Å; A284-L389 HydrophobicContact CB-CG 4.26Å; L293-L389 HydrophobicContact CD1-CD2 3.71Å; L300-L389 HydrophobicContact CD2-CD1 4.15Å; I301-L389 HydrophobicContact CD1-CD1 4.47Å; L304-L389 HydrophobicContact CD1-CD1 3.66Å; A385-L389 VanDerWaalsContact O-CB 3.28Å; A385-L389 WeakPolarHBondContact O-CB 3.42Å; A385-L389 WeakPolarHBondContact O-CD1 3.47Å; A385-L389 WeakPolarHBondContact O-CG 3.46Å; A385-L389 PolarHBondContact O-N 2.63Å; A385-L389 VanDerWaalsContact O-N 3.07Å; L386-L389 PolarHBondContact O-N 3.06Å; D387-L389 VanDerWaalsContact C-N 3.27Å; D387-L389 PolarHBondContact O-N 3.26Å; L389-V392 PolarHBondContact O-N 2.89Å; L389-F393 HydrophobicContact CD2-CD2 4.04Å; L389-F393 HydrophobicContact CD2-CE2 3.7Å; L389-F393 WeakPolarHBondContact O-CB 3.36Å; L389-F393 WeakPolarHBondContact O-CD2 3.27Å; L389-F393 PolarHBondContact O-N 3.29Å
390	A	96.8	Very high	95.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-41.8	172.9	0	0	0	0	0	110.7	L386 D387 V388 R394 L397 I427 G430	L386-A390 WeakPolarHBondContact O-CB 3.15Å; L386-A390 PolarHBondContact O-N 3.47Å; D387-A390 WeakPolarHBondContact O-CA 3.47Å; D387-A390 VanDerWaalsContact O-CB 3.28Å; D387-A390 WeakPolarHBondContact O-CB 3.36Å; D387-A390 PolarHBondContact O-N 3.16Å; V388-A390 VanDerWaalsContact C-N 3.33Å; V388-A390 PolarHBondContact O-N 3.11Å; A390-R394 WeakPolarHBondContact O-CA 3.18Å; A390-R394 PolarHBondContact O-N 3.1Å; A390-L397 HydrophobicContact CB-CD2 3.91Å; A390-I427 HydrophobicContact CB-CB 4.14Å; A390-I427 HydrophobicContact CB-CG2 4.24Å; A390-G430 WeakPolarHBondContact O-CA 3.04Å
391	N	94.4	Very high	95.7	Very high	58 Å²	58	36.9 Å²	36.9	31%	0.31	19%	0.19	S	C	.	.	H	α-helix	trans	-65.6	-38	175.2	-86.2	-37.3	0	0	0	113	D387 V388 R394 E429 G430	D387-N391 PolarHBondContact O-N 3.12Å; V388-N391 PolarHBondContact O-N 3.21Å; N391-R394 WeakPolarHBondContact O-CG 3.36Å; N391-E429 PolarHBondContact ND2-OE1 3.34Å; N391-G430 WeakPolarHBondContact OD1-CA 3.24Å; N391-G430 PolarHBondContact OD1-N 3.09Å
392	V	95.5	Very high	95.7	Very high	31 Å²	31	39.1 Å²	39.1	19%	0.188	20%	0.202	C	C	.	.	H	α-helix	trans	-67.2	-60	174.9	173.3	0	0	0	0	110.8	A284 C289 K290 V388 L389	A284-V392 HydrophobicContact CB-CG2 4.42Å; A284-V392 VanDerWaalsContact O-CG2 3.28Å; A284-V392 WeakPolarHBondContact O-CG2 3.35Å; C289-V392 HydrophobicContact CB-CG1 4.31Å; K290-V392 HydrophobicContact CD-CG1 4.32Å; K290-V392 WeakPolarHBondContact CE-O 3.34Å; K290-V392 HydrophobicContact CG-CG1 3.61Å; K290-V392 PolarHBondContact NZ-O 3.06Å; V388-V392 VanDerWaalsContact O-CG2 3.32Å; V388-V392 WeakPolarHBondContact O-CG2 3.42Å; V388-V392 PolarHBondContact O-N 3.32Å; L389-V392 PolarHBondContact O-N 2.89Å
393	F	95.9	Very high	95.5	Very high	12 Å²	12	42.8 Å²	42.8	5%	0.053	23%	0.226	C	C	.	.	H	α-helix	trans	-83.3	-20	-170.2	-72.9	-82.9	0	0	0	114	K290 L293 L297 L389 D396 L397	K290-F393 HydrophobicContact CB-CE1 4.19Å; K290-F393 HydrophobicContact CB-CZ 4.4Å; K290-F393 HydrophobicContact CG-CD1 4.26Å; K290-F393 HydrophobicContact CG-CE1 3.84Å; K290-F393 HydrophobicContact CG-CZ 4.09Å; L293-F393 HydrophobicContact CB-CE2 4.48Å; L293-F393 HydrophobicContact CB-CZ 4.03Å; L297-F393 HydrophobicContact CD1-CD1 3.75Å; L297-F393 HydrophobicContact CD1-CE1 3.61Å; L297-F393 HydrophobicContact CD1-CE2 4.4Å; L297-F393 HydrophobicContact CD1-CG 4.21Å; L297-F393 HydrophobicContact CD1-CZ 3.95Å; L297-F393 HydrophobicContact CD2-CD2 4.28Å; L297-F393 HydrophobicContact CD2-CE2 3.92Å; L297-F393 HydrophobicContact CD2-CZ 4.04Å; L297-F393 HydrophobicContact CG-CE1 4.41Å; L297-F393 HydrophobicContact CG-CZ 4.29Å; L389-F393 HydrophobicContact CD2-CD2 4.04Å; L389-F393 HydrophobicContact CD2-CE2 3.7Å; L389-F393 WeakPolarHBondContact O-CB 3.36Å; L389-F393 WeakPolarHBondContact O-CD2 3.27Å; L389-F393 PolarHBondContact O-N 3.29Å; F393-D396 WeakPolarHBondContact O-CB 3.38Å; F393-D396 PolarHBondContact O-N 3.31Å; F393-L397 HydrophobicContact CB-CB 4.16Å; F393-L397 HydrophobicContact CB-CD1 4.44Å
394	R	95.6	Very high	95.6	Very high	164 Å²	164	44 Å²	44	62%	0.619	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	49.9	-141.9	-175.5	-54.8	-170.3	176.8	-153.5	-3.2	111.1	A390 N391 D396 L397 G430 C431	A390-R394 WeakPolarHBondContact O-CA 3.18Å; A390-R394 PolarHBondContact O-N 3.1Å; N391-R394 WeakPolarHBondContact O-CG 3.36Å; R394-D396 PolarHBondContact O-N 3.01Å; R394-L397 VanDerWaalsContact O-CB 3.28Å; R394-L397 WeakPolarHBondContact O-CB 3.45Å; R394-L397 PolarHBondContact O-N 3.02Å; R394-G430 VanDerWaalsContact CA-O 3.27Å; R394-G430 WeakPolarHBondContact CA-O 3.3Å; R394-G430 WeakPolarHBondContact CB-O 3.35Å; R394-C431 PolarHBondContact O-SG 3.03Å
395	D	95.2	Very high	95.7	Very high	69 Å²	69	42.8 Å²	42.8	37%	0.369	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-55.7	-20.6	-175.9	-61.5	-19.5	0	0	0	114.9	L397 L398 G434	D395-L397 PolarHBondContact O-N 3.01Å; D395-L398 HydrophobicContact CB-CD1 4.33Å; D395-L398 WeakPolarHBondContact O-CB 3.42Å; D395-L398 PolarHBondContact O-N 2.92Å; D395-L398 VanDerWaalsContact O-N 3.16Å; D395-G434 WeakPolarHBondContact OD1-CA 3.33Å; D395-G434 PolarHBondContact OD1-N 3.1Å; D395-G434 PolarHBondContact OD2-N 3.33Å
396	D	94.3	Very high	95.5	Very high	108 Å²	108	50.7 Å²	50.7	58%	0.578	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-62.1	-27.4	175.2	-69.1	-27.9	0	0	0	111.9	F393 R394 L398	F393-D396 WeakPolarHBondContact O-CB 3.38Å; F393-D396 PolarHBondContact O-N 3.31Å; R394-D396 PolarHBondContact O-N 3.01Å; D396-L398 VanDerWaalsContact C-N 3.28Å; D396-L398 PolarHBondContact O-N 3.07Å
397	L	95.6	Very high	95.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-68.2	-27.8	178.4	-163.4	66.2	0	0	0	112.6	L297 I301 L386 A390 F393 R394 D395 L399 H400 I401	L297-L397 HydrophobicContact CD2-CD1 4.48Å; I301-L397 HydrophobicContact CD1-CD1 3.6Å; I301-L397 HydrophobicContact CG1-CD1 3.92Å; L386-L397 HydrophobicContact CD1-CD2 4.09Å; A390-L397 HydrophobicContact CB-CD2 3.91Å; F393-L397 HydrophobicContact CB-CB 4.16Å; F393-L397 HydrophobicContact CB-CD1 4.44Å; R394-L397 VanDerWaalsContact O-CB 3.28Å; R394-L397 WeakPolarHBondContact O-CB 3.45Å; R394-L397 PolarHBondContact O-N 3.02Å; D395-L397 PolarHBondContact O-N 3.01Å; L397-L399 PolarHBondContact O-N 2.94Å; L397-L399 VanDerWaalsContact O-N 3.17Å; L397-H400 PolarHBondContact O-N 3.13Å; L397-I401 HydrophobicContact CD2-CG1 4.37Å; L397-I401 HydrophobicContact CG-CG1 4.02Å; L397-I401 PolarHBondContact O-N 3.02Å
398	L	95.3	Very high	95.4	Very high	12 Å²	12	57 Å²	57	6%	0.063	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-27.7	-174.7	-64.7	179	0	0	0	113	D395 D396 H400 I401 L402 I427 C431 G434 M435	D395-L398 HydrophobicContact CB-CD1 4.33Å; D395-L398 WeakPolarHBondContact O-CB 3.42Å; D395-L398 PolarHBondContact O-N 2.92Å; D395-L398 VanDerWaalsContact O-N 3.16Å; D396-L398 VanDerWaalsContact C-N 3.28Å; D396-L398 PolarHBondContact O-N 3.07Å; L398-H400 PolarHBondContact O-N 2.88Å; L398-I401 PolarHBondContact O-N 3.23Å; L398-L402 HydrophobicContact CB-CD1 4.07Å; L398-L402 HydrophobicContact CB-CG 4.22Å; L398-L402 WeakPolarHBondContact O-CB 3.09Å; L398-L402 VanDerWaalsContact O-CG 3.28Å; L398-L402 WeakPolarHBondContact O-CG 3.32Å; L398-L402 PolarHBondContact O-N 2.76Å; L398-I427 HydrophobicContact CD2-CD1 4.26Å; L398-C431 HydrophobicContact CD1-CB 4.43Å; L398-C431 HydrophobicContact CD2-CB 3.8Å; L398-C431 HydrophobicContact CG-CB 4.16Å; L398-G434 VanDerWaalsContact CD1-C 3.46Å; L398-M435 HydrophobicContact CD1-CG 4.45Å; L398-M435 HydrophobicContact CD2-CG 3.93Å; L398-M435 HydrophobicContact CD2-SD 3.64Å
399	L	94.1	Very high	95.4	Very high	138 Å²	138	55.2 Å²	55.2	72%	0.723	27%	0.272	S	S	*	.	H	α-helix	trans	-58.8	-30.2	174.7	-67.5	174.3	0	0	0	112.6	L397	L397-L399 PolarHBondContact O-N 2.94Å; L397-L399 VanDerWaalsContact O-N 3.17Å
400	H	95.3	Very high	95.3	Very high	62 Å²	62	60.5 Å²	60.5	29%	0.287	30%	0.295	S	S	.	.	H	α-helix	trans	-95.6	-31.9	-179.1	-58.8	-62.9	0	0	0	112.4	I301 L397 L398	I301-H400 HydrophobicContact CB-CB 4.3Å; I301-H400 HydrophobicContact CG1-CB 4.33Å; I301-H400 HydrophobicContact CG2-CB 4.24Å; L397-H400 PolarHBondContact O-N 3.13Å; L398-H400 PolarHBondContact O-N 2.88Å
401	I	95.7	Very high	95.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-84.9	-43.1	-174.3	-70.6	-72.7	0	0	0	113.4	I301 V305 L386 L397 L398 P403 L404 L405 V423 I427	I301-I401 HydrophobicContact CG2-CD1 3.25Å; I301-I401 HydrophobicContact CG2-CG1 3.87Å; V305-I401 HydrophobicContact CG2-CD1 4.02Å; L386-I401 HydrophobicContact CD1-CD1 4.04Å; L386-I401 HydrophobicContact CD2-CD1 4.21Å; L397-I401 HydrophobicContact CD2-CG1 4.37Å; L397-I401 HydrophobicContact CG-CG1 4.02Å; L397-I401 PolarHBondContact O-N 3.02Å; L398-I401 PolarHBondContact O-N 3.23Å; I401-P403 VanDerWaalsContact C-CD 3.46Å; I401-L404 WeakPolarHBondContact O-CB 3.4Å; I401-L404 PolarHBondContact O-N 3.4Å; I401-L405 HydrophobicContact CG2-CD1 3.57Å; I401-L405 HydrophobicContact CG2-CG 3.77Å; I401-L405 PolarHBondContact O-N 2.71Å; I401-V423 HydrophobicContact CD1-CG1 4.2Å; I401-V423 HydrophobicContact CG2-CG1 4.15Å; I401-I427 HydrophobicContact CG2-CD1 3.73Å
402	L	94.8	Very high	95.3	Very high	47 Å²	47	66.9 Å²	66.9	25%	0.246	33%	0.333	C	S	.	.	H	α-helix	trans	-56.7	-40.1	-173.9	-71.4	172.3	0	0	0	114.2	L398 L404 K406 M435 Y438	L398-L402 HydrophobicContact CB-CD1 4.07Å; L398-L402 HydrophobicContact CB-CG 4.22Å; L398-L402 WeakPolarHBondContact O-CB 3.09Å; L398-L402 VanDerWaalsContact O-CG 3.28Å; L398-L402 WeakPolarHBondContact O-CG 3.32Å; L398-L402 PolarHBondContact O-N 2.76Å; L402-L404 VanDerWaalsContact C-N 3.3Å; L402-L404 PolarHBondContact O-N 2.81Å; L402-K406 PolarHBondContact O-N 3.26Å; L402-M435 HydrophobicContact CD2-SD 4.09Å; L402-Y438 HydrophobicContact CD1-CE2 3.95Å; L402-Y438 HydrophobicContact CD2-CD2 4.35Å; L402-Y438 HydrophobicContact CD2-CE2 4.15Å
403	P	95.3	Very high	95.4	Very high	79 Å²	79	69 Å²	69	51%	0.513	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-39.2	174.8	-23.1	34.8	0	0	0	112.8	I401	I401-P403 VanDerWaalsContact C-CD 3.46Å
404	L	96.9	Very high	95.4	Very high	39 Å²	39	70.4 Å²	70.4	20%	0.204	35%	0.348	C	S	.	.	H	α-helix	trans	-69.4	-49.8	179.5	-59.6	174.3	0	0	0	110.5	I301 P302 V305 I401 L402 K406 E407 L408	I301-L404 HydrophobicContact CG2-CD1 4.17Å; P302-L404 HydrophobicContact CB-CD1 4.46Å; P302-L404 HydrophobicContact CG-CD1 4.27Å; V305-L404 HydrophobicContact CB-CD1 4.28Å; V305-L404 HydrophobicContact CG1-CD1 4.33Å; V305-L404 HydrophobicContact CG2-CD1 4.04Å; I401-L404 WeakPolarHBondContact O-CB 3.4Å; I401-L404 PolarHBondContact O-N 3.4Å; L402-L404 VanDerWaalsContact C-N 3.3Å; L402-L404 PolarHBondContact O-N 2.81Å; L404-K406 PolarHBondContact O-N 3.3Å; L404-K406 VanDerWaalsContact O-N 3.15Å; L404-E407 PolarHBondContact O-N 3.13Å; L404-L408 HydrophobicContact CB-CD1 4.33Å; L404-L408 VanDerWaalsContact O-CG 3.26Å; L404-L408 WeakPolarHBondContact O-CG 3.3Å; L404-L408 PolarHBondContact O-N 3.16Å
405	L	95.7	Very high	95.4	Very high	6 Å²	6	63.6 Å²	63.6	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-53.8	-39.4	179.7	-80.6	178.4	0	0	0	112.8	I401 E407 L408 L409 G420 V423 L424 I427	I401-L405 HydrophobicContact CG2-CD1 3.57Å; I401-L405 HydrophobicContact CG2-CG 3.77Å; I401-L405 PolarHBondContact O-N 2.71Å; L405-E407 VanDerWaalsContact C-N 3.27Å; L405-E407 PolarHBondContact O-N 3.01Å; L405-L408 PolarHBondContact O-N 3.2Å; L405-L409 HydrophobicContact CB-CD1 4.21Å; L405-L409 HydrophobicContact CD2-CD1 4.29Å; L405-L409 HydrophobicContact CD2-CG 4.25Å; L405-L409 WeakPolarHBondContact O-CB 3.48Å; L405-L409 VanDerWaalsContact O-CG 3.32Å; L405-L409 WeakPolarHBondContact O-CG 3.48Å; L405-L409 PolarHBondContact O-N 3.02Å; L405-G420 VanDerWaalsContact CD2-O 3.26Å; L405-G420 WeakPolarHBondContact CD2-O 3.42Å; L405-V423 HydrophobicContact CD2-CB 3.98Å; L405-V423 HydrophobicContact CD2-CG1 3.69Å; L405-V423 HydrophobicContact CG-CG1 4.2Å; L405-L424 HydrophobicContact CD1-CD1 4.22Å; L405-L424 HydrophobicContact CD2-CB 4.14Å; L405-I427 HydrophobicContact CD1-CD1 4.03Å
406	K	92.1	Very high	95.5	Very high	165 Å²	165	61.4 Å²	61.4	72%	0.717	31%	0.314	S	S	*	.	H	α-helix	trans	-62	-33.9	178.7	-169.6	175.9	-178	175.6	0	113.1	L402 L404	L402-K406 PolarHBondContact O-N 3.26Å; L404-K406 PolarHBondContact O-N 3.3Å; L404-K406 VanDerWaalsContact O-N 3.15Å
407	E	94.6	Very high	95.7	Very high	146 Å²	146	58 Å²	58	68%	0.682	29%	0.294	S	S	*	.	H	α-helix	trans	-81.3	-34.4	177.2	-64.6	-175.1	175.2	0	0	111.8	L404 L405	L404-E407 PolarHBondContact O-N 3.13Å; L405-E407 VanDerWaalsContact C-N 3.27Å; L405-E407 PolarHBondContact O-N 3.01Å
408	L	97.4	Very high	95.8	Very high	19 Å²	19	58 Å²	58	10%	0.099	29%	0.294	C	S	.	.	H	α-helix	trans	-78.2	-53.7	-175.5	-60.4	170.2	0	0	0	112.7	V305 L404 L405 F410 H411 V416 K417	V305-L408 HydrophobicContact CG1-CD1 3.56Å; L404-L408 HydrophobicContact CB-CD1 4.33Å; L404-L408 VanDerWaalsContact O-CG 3.26Å; L404-L408 WeakPolarHBondContact O-CG 3.3Å; L404-L408 PolarHBondContact O-N 3.16Å; L405-L408 PolarHBondContact O-N 3.2Å; L408-F410 PolarHBondContact O-N 3.22Å; L408-H411 VanDerWaalsContact O-CB 3.28Å; L408-H411 WeakPolarHBondContact O-CB 3.37Å; L408-H411 PolarHBondContact O-N 3.38Å; L408-V416 HydrophobicContact CD2-CG1 3.46Å; L408-V416 VanDerWaalsContact CD2-CG1 3.46Å; L408-K417 WeakPolarHBondContact O-CA 3.27Å
409	L	96.5	Very high	95.9	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.026	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.8	-169	-71.2	172.4	0	0	0	114.2	L405 K417 G420 I421 L424 L442	L405-L409 HydrophobicContact CB-CD1 4.21Å; L405-L409 HydrophobicContact CD2-CD1 4.29Å; L405-L409 HydrophobicContact CD2-CG 4.25Å; L405-L409 WeakPolarHBondContact O-CB 3.48Å; L405-L409 VanDerWaalsContact O-CG 3.32Å; L405-L409 WeakPolarHBondContact O-CG 3.48Å; L405-L409 PolarHBondContact O-N 3.02Å; L409-K417 WeakPolarHBondContact O-CG 3.29Å; L409-G420 WeakPolarHBondContact CD2-O 3.32Å; L409-I421 HydrophobicContact CD2-CG1 3.91Å; L409-L424 HydrophobicContact CD1-CD2 4.33Å; L409-L424 HydrophobicContact CD2-CD2 4.28Å; L409-L442 HydrophobicContact CD1-CD2 3.81Å
410	F	93.8	Very high	96.1	Very high	110 Å²	110	50.9 Å²	50.9	48%	0.482	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	9.6	-178	-55.8	-78.9	0	0	0	113	L408 H445	L408-F410 PolarHBondContact O-N 3.22Å; F410-H445 AromaticContact CD1-CE1 3.78Å; F410-H445 AromaticContact CD1-NE2 3.75Å; F410-H445 AromaticContact CE1-CD2 3.69Å; F410-H445 AromaticContact CE1-CE1 3.52Å; F410-H445 AromaticContact CE1-CG 3.87Å; F410-H445 AromaticContact CE1-ND1 3.78Å; F410-H445 AromaticContact CE1-NE2 3.44Å; F410-H445 WeakPolarHBondContact CE1-NE2 3.49Å
411	H	96.9	Very high	96.3	Very high	71 Å²	71	47.9 Å²	47.9	33%	0.329	24%	0.243	S	C	.	.			trans	-66	140.1	-178.6	-163.2	-91.3	0	0	0	111.1	L408 D413 V416 K417	L408-H411 VanDerWaalsContact O-CB 3.28Å; L408-H411 WeakPolarHBondContact O-CB 3.37Å; L408-H411 PolarHBondContact O-N 3.38Å; H411-D413 VanDerWaalsContact C-N 3.33Å; H411-D413 VanDerWaalsContact CE1-CB 3.43Å; H411-D413 WeakPolarHBondContact CE1-CB 3.47Å; H411-D413 WeakPolarHBondContact ND1-CB 3.3Å; H411-D413 PolarHBondContact ND1-N 3.2Å; H411-D413 PolarHBondContact O-N 2.94Å; H411-V416 HydrophobicContact CB-CB 3.97Å; H411-V416 HydrophobicContact CB-CG1 3.69Å; H411-K417 VanDerWaalsContact O-CE 3.28Å; H411-K417 WeakPolarHBondContact O-CE 3.43Å
412	P	95.4	Very high	96.4	Very high	121 Å²	121	48.6 Å²	48.6	79%	0.786	25%	0.247	S	C	*	.	S	Bend	trans	-71.5	-26.8	-179.6	27.3	-36	0	0	0	113.6
413	D	96.8	Very high	96.6	Very high	75 Å²	75	46.3 Å²	46.3	40%	0.401	24%	0.235	S	C	.	.	S	Bend	trans	-75.6	125.7	171.2	-169.5	-7.2	0	0	0	110	H411 V415 V416 K417	H411-D413 VanDerWaalsContact C-N 3.33Å; H411-D413 VanDerWaalsContact CE1-CB 3.43Å; H411-D413 WeakPolarHBondContact CE1-CB 3.47Å; H411-D413 WeakPolarHBondContact ND1-CB 3.3Å; H411-D413 PolarHBondContact ND1-N 3.2Å; H411-D413 PolarHBondContact O-N 2.94Å; D413-V415 VanDerWaalsContact C-N 3.32Å; D413-V415 PolarHBondContact O-N 3.4Å; D413-V415 PolarHBondContact OD1-N 2.87Å; D413-V416 HydrophobicContact CB-CB 4.48Å; D413-V416 HydrophobicContact CB-CG2 4.16Å; D413-V416 PolarHBondContact O-N 2.84Å; D413-K417 PolarHBondContact O-N 3.18Å
414	W	95.6	Very high	96.7	Very high	42 Å²	42	42.7 Å²	42.7	16%	0.159	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-33.2	-175.4	74.9	-87	0	0	0	111.8	Y310 I315 V416 K417 E418 K454 L456 V457	Y310-W414 HydrophobicContact CD2-CZ3 4.43Å; I315-W414 HydrophobicContact CD1-CH2 4.18Å; I315-W414 HydrophobicContact CD1-CZ2 4.06Å; I315-W414 HydrophobicContact CG1-CH2 4.02Å; I315-W414 HydrophobicContact CG1-CZ2 4.24Å; I315-W414 HydrophobicContact CG2-CH2 4.4Å; I315-W414 HydrophobicContact CG2-CZ2 4.1Å; W414-V416 VanDerWaalsContact C-N 3.32Å; W414-V416 PolarHBondContact O-N 2.91Å; W414-K417 PolarHBondContact O-N 3.31Å; W414-E418 HydrophobicContact CE3-CB 4.27Å; W414-E418 HydrophobicContact CE3-CG 4.49Å; W414-E418 HydrophobicContact CZ3-CG 4.43Å; W414-E418 WeakPolarHBondContact O-CB 3.45Å; W414-E418 PolarHBondContact O-N 3.02Å; W414-K454 HydrophobicContact CB-CB 4.47Å; W414-K454 HydrophobicContact CB-CG 4.03Å; W414-K454 HydrophobicContact CD2-CG 4.19Å; W414-K454 HydrophobicContact CG-CG 3.86Å; W414-L456 HydrophobicContact CE3-CB 4.48Å; W414-L456 HydrophobicContact CH2-CB 4.45Å; W414-L456 HydrophobicContact CH2-CD1 3.52Å; W414-L456 HydrophobicContact CZ3-CB 3.79Å; W414-L456 HydrophobicContact CZ3-CD1 3.71Å; W414-L456 HydrophobicContact CZ3-CG 4.38Å; W414-V457 HydrophobicContact CB-CG2 3.98Å; W414-V457 HydrophobicContact CE3-CG2 4.11Å
415	V	96.3	Very high	96.7	Very high	22 Å²	22	40.8 Å²	40.8	13%	0.133	20%	0.201	C	C	.	.	H	α-helix	trans	-64.1	-41.8	179.7	-179.1	0	0	0	0	110.6	K309 I315 D413 S419	K309-V415 HydrophobicContact CB-CG1 4.26Å; I315-V415 HydrophobicContact CD1-CG2 3.86Å; D413-V415 VanDerWaalsContact C-N 3.32Å; D413-V415 PolarHBondContact O-N 3.4Å; D413-V415 PolarHBondContact OD1-N 2.87Å; V415-S419 PolarHBondContact O-N 3.38Å; V415-S419 VanDerWaalsContact O-N 3.12Å; V415-S419 PolarHBondContact O-OG 3.28Å
416	V	97.8	Very high	96.7	Very high	23 Å²	23	40.6 Å²	40.6	14%	0.139	20%	0.201	C	C	.	.	H	α-helix	trans	-69.7	-45	177.6	-178	0	0	0	0	110.6	L408 H411 D413 W414 E418 S419 G420	L408-V416 HydrophobicContact CD2-CG1 3.46Å; L408-V416 VanDerWaalsContact CD2-CG1 3.46Å; H411-V416 HydrophobicContact CB-CB 3.97Å; H411-V416 HydrophobicContact CB-CG1 3.69Å; D413-V416 HydrophobicContact CB-CB 4.48Å; D413-V416 HydrophobicContact CB-CG2 4.16Å; D413-V416 PolarHBondContact O-N 2.84Å; W414-V416 VanDerWaalsContact C-N 3.32Å; W414-V416 PolarHBondContact O-N 2.91Å; V416-E418 PolarHBondContact O-N 3.36Å; V416-S419 PolarHBondContact O-N 2.94Å; V416-S419 PolarHBondContact O-OG 3.02Å; V416-G420 PolarHBondContact O-N 3.06Å; V416-G420 VanDerWaalsContact O-N 3.11Å
417	K	98	Very high	96.9	Very high	36 Å²	36	32.8 Å²	32.8	16%	0.157	17%	0.166	C	C	.	.	H	α-helix	trans	-58.3	-49.4	176.7	-173.8	-167.8	-59.2	-179.4	0	112	L408 L409 H411 D413 W414 S419 G420 I421 D452 V457	L408-K417 WeakPolarHBondContact O-CA 3.27Å; L409-K417 WeakPolarHBondContact O-CG 3.29Å; H411-K417 VanDerWaalsContact O-CE 3.28Å; H411-K417 WeakPolarHBondContact O-CE 3.43Å; D413-K417 PolarHBondContact O-N 3.18Å; W414-K417 PolarHBondContact O-N 3.31Å; K417-S419 VanDerWaalsContact C-N 3.35Å; K417-S419 PolarHBondContact O-N 3.09Å; K417-G420 WeakPolarHBondContact O-CA 3.36Å; K417-G420 PolarHBondContact O-N 3.27Å; K417-I421 HydrophobicContact CD-CD1 4.41Å; K417-I421 HydrophobicContact CG-CD1 4.12Å; K417-I421 WeakPolarHBondContact O-CG1 3.15Å; K417-I421 PolarHBondContact O-N 3Å; K417-D452 IonicContact NZ-OD2 3.77Å; K417-D452 PolarHBondContact NZ-OD2 3.49Å; K417-V457 HydrophobicContact CD-CG1 4.34Å
418	E	97.8	Very high	97	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-56.7	-47.9	179.4	-170.4	-67.6	145.1	0	0	110.3	Y310 R379 W414 V416 G420 I421 L422 V457 I460	Y310-E418 HydrophobicContact CE2-CG 4.27Å; R379-E418 IonicContact CZ-OE1 3.51Å; R379-E418 IonicContact CZ-OE2 3.38Å; R379-E418 IonicContact NH1-OE1 3.87Å; R379-E418 IonicContact NH1-OE2 3.58Å; R379-E418 PolarHBondContact NH1-OE2 3.21Å; R379-E418 IonicContact NH2-OE1 2.77Å; R379-E418 PolarHBondContact NH2-OE1 3.1Å; R379-E418 IonicContact NH2-OE2 2.77Å; R379-E418 PolarHBondContact NH2-OE2 3.16Å; R379-E418 VanDerWaalsContact NH2-OE2 3.14Å; W414-E418 HydrophobicContact CE3-CB 4.27Å; W414-E418 HydrophobicContact CE3-CG 4.49Å; W414-E418 HydrophobicContact CZ3-CG 4.43Å; W414-E418 WeakPolarHBondContact O-CB 3.45Å; W414-E418 PolarHBondContact O-N 3.02Å; V416-E418 PolarHBondContact O-N 3.36Å; E418-G420 VanDerWaalsContact C-N 3.26Å; E418-G420 PolarHBondContact O-N 3.17Å; E418-I421 PolarHBondContact O-N 3.36Å; E418-L422 PolarHBondContact O-N 3.11Å; E418-V457 HydrophobicContact CB-CG2 4.17Å; E418-V457 HydrophobicContact CG-CG2 4.48Å; E418-I460 HydrophobicContact CG-CG2 3.76Å; E418-I460 WeakPolarHBondContact OE1-CB 3.34Å; E418-I460 WeakPolarHBondContact OE1-CG2 3.43Å
419	S	97.7	Very high	96.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61	-33.8	175.4	69	0	0	0	0	113.1	V415 V416 K417 L422 V423	V415-S419 PolarHBondContact O-N 3.38Å; V415-S419 VanDerWaalsContact O-N 3.12Å; V415-S419 PolarHBondContact O-OG 3.28Å; V416-S419 PolarHBondContact O-N 2.94Å; V416-S419 PolarHBondContact O-OG 3.02Å; K417-S419 VanDerWaalsContact C-N 3.35Å; K417-S419 PolarHBondContact O-N 3.09Å; S419-L422 PolarHBondContact O-N 2.78Å; S419-V423 VanDerWaalsContact O-CG2 3.22Å; S419-V423 WeakPolarHBondContact O-CG2 3.34Å; S419-V423 PolarHBondContact O-N 3.03Å
420	G	98.4	Very high	96.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.8	-36.7	174.5	0	0	0	0	0	113.3	L405 L409 V416 K417 E418 L424	L405-G420 VanDerWaalsContact CD2-O 3.26Å; L405-G420 WeakPolarHBondContact CD2-O 3.42Å; L409-G420 WeakPolarHBondContact CD2-O 3.32Å; V416-G420 PolarHBondContact O-N 3.06Å; V416-G420 VanDerWaalsContact O-N 3.11Å; K417-G420 WeakPolarHBondContact O-CA 3.36Å; K417-G420 PolarHBondContact O-N 3.27Å; E418-G420 VanDerWaalsContact C-N 3.26Å; E418-G420 PolarHBondContact O-N 3.17Å; G420-L424 PolarHBondContact O-N 3.08Å
421	I	98.6	Very high	96.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68.3	-44.8	175.8	-63.4	165.4	0	0	0	109.4	L409 K417 E418 V423 L424 G425 L446 V457 I460 T464	L409-I421 HydrophobicContact CD2-CG1 3.91Å; K417-I421 HydrophobicContact CD-CD1 4.41Å; K417-I421 HydrophobicContact CG-CD1 4.12Å; K417-I421 WeakPolarHBondContact O-CG1 3.15Å; K417-I421 PolarHBondContact O-N 3Å; E418-I421 PolarHBondContact O-N 3.36Å; I421-V423 PolarHBondContact O-N 2.74Å; I421-L424 WeakPolarHBondContact O-CB 3.48Å; I421-L424 PolarHBondContact O-N 2.92Å; I421-L424 VanDerWaalsContact O-N 3.11Å; I421-G425 PolarHBondContact O-N 3.33Å; I421-G425 VanDerWaalsContact O-N 3.09Å; I421-L446 HydrophobicContact CG1-CD2 4.14Å; I421-L446 HydrophobicContact CG2-CD2 4.01Å; I421-V457 HydrophobicContact CD1-CG1 3.94Å; I421-I460 HydrophobicContact CB-CG2 4.07Å; I421-I460 HydrophobicContact CG2-CG1 4.2Å; I421-I460 HydrophobicContact CG2-CG2 3.86Å; I421-T464 HydrophobicContact CG2-CG2 4.11Å; I421-T464 VanDerWaalsContact CG2-OG1 3.27Å; I421-T464 WeakPolarHBondContact CG2-OG1 3.46Å; I421-T464 PolarHBondContact O-OG1 3.05Å; I421-T464 VanDerWaalsContact O-OG1 3.08Å
422	L	97.9	Very high	96.3	Very high	14 Å²	14	22.7 Å²	22.7	7%	0.073	12%	0.123	C	C	.	.	H	α-helix	trans	-56.3	-47.8	173	176.3	63.1	0	0	0	112	M308 R379 A383 E418 S419 L424 G425 A426 I460 W463	M308-L422 HydrophobicContact CB-CD2 4.11Å; M308-L422 HydrophobicContact CE-CB 4.34Å; M308-L422 HydrophobicContact CE-CD2 3.79Å; M308-L422 HydrophobicContact CE-CG 3.54Å; R379-L422 HydrophobicContact CG-CD2 4.49Å; A383-L422 HydrophobicContact CB-CD1 4.45Å; A383-L422 HydrophobicContact CB-CD2 4.24Å; E418-L422 PolarHBondContact O-N 3.11Å; S419-L422 PolarHBondContact O-N 2.78Å; L422-L424 VanDerWaalsContact C-N 3.27Å; L422-L424 PolarHBondContact O-N 3.45Å; L422-G425 PolarHBondContact O-N 2.66Å; L422-A426 WeakPolarHBondContact O-CB 3.36Å; L422-A426 PolarHBondContact O-N 3.2Å; L422-I460 HydrophobicContact CB-CD1 4.03Å; L422-I460 HydrophobicContact CB-CG1 3.93Å; L422-I460 HydrophobicContact CD1-CD1 3.66Å; L422-I460 HydrophobicContact CG-CD1 4.4Å; L422-W463 HydrophobicContact CD1-CE3 4.44Å; L422-W463 HydrophobicContact CD1-CH2 4.24Å; L422-W463 HydrophobicContact CD1-CZ3 3.82Å
423	V	98.5	Very high	96.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-41	176	170.5	0	0	0	0	111.7	V305 M308 L386 I401 L405 S419 I421 G425 A426 I427	V305-V423 HydrophobicContact CB-CG2 4.4Å; V305-V423 HydrophobicContact CG1-CG2 4.06Å; V305-V423 HydrophobicContact CG2-CG1 4.37Å; V305-V423 HydrophobicContact CG2-CG2 3.95Å; M308-V423 HydrophobicContact CE-CB 4.24Å; M308-V423 HydrophobicContact CE-CG2 3.5Å; M308-V423 HydrophobicContact SD-CG2 3.61Å; L386-V423 HydrophobicContact CD2-CG1 4.04Å; L386-V423 HydrophobicContact CD2-CG2 4.27Å; I401-V423 HydrophobicContact CD1-CG1 4.2Å; I401-V423 HydrophobicContact CG2-CG1 4.15Å; L405-V423 HydrophobicContact CD2-CB 3.98Å; L405-V423 HydrophobicContact CD2-CG1 3.69Å; L405-V423 HydrophobicContact CG-CG1 4.2Å; S419-V423 VanDerWaalsContact O-CG2 3.22Å; S419-V423 WeakPolarHBondContact O-CG2 3.34Å; S419-V423 PolarHBondContact O-N 3.03Å; I421-V423 PolarHBondContact O-N 2.74Å; V423-G425 VanDerWaalsContact C-N 3.32Å; V423-G425 PolarHBondContact O-N 3.31Å; V423-A426 PolarHBondContact O-N 3.06Å; V423-I427 WeakPolarHBondContact O-CG1 3.23Å; V423-I427 WeakPolarHBondContact O-CG2 3.48Å; V423-I427 PolarHBondContact O-N 3.39Å
424	L	98.3	Very high	96.2	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-64.8	-36.8	179.8	178.2	61.4	0	0	0	112.3	L405 L409 G420 I421 L422 M435 L442 L446 T464 Y468	L405-L424 HydrophobicContact CD1-CD1 4.22Å; L405-L424 HydrophobicContact CD2-CB 4.14Å; L409-L424 HydrophobicContact CD1-CD2 4.33Å; L409-L424 HydrophobicContact CD2-CD2 4.28Å; G420-L424 PolarHBondContact O-N 3.08Å; I421-L424 WeakPolarHBondContact O-CB 3.48Å; I421-L424 PolarHBondContact O-N 2.92Å; I421-L424 VanDerWaalsContact O-N 3.11Å; L422-L424 VanDerWaalsContact C-N 3.27Å; L422-L424 PolarHBondContact O-N 3.45Å; L424-M435 HydrophobicContact CD1-CE 3.31Å; L424-L442 HydrophobicContact CD1-CD1 3.99Å; L424-L442 HydrophobicContact CD2-CD1 4.36Å; L424-L446 HydrophobicContact CD2-CD1 3.85Å; L424-L446 HydrophobicContact CD2-CD2 4.3Å; L424-L446 HydrophobicContact CD2-CG 4.35Å; L424-T464 HydrophobicContact CB-CG2 4.24Å; L424-T464 HydrophobicContact CD2-CG2 4.33Å; L424-T464 HydrophobicContact CG-CG2 4.13Å; L424-Y468 HydrophobicContact CD1-CE2 4.36Å; L424-Y468 HydrophobicContact CG-CE2 4.17Å; L424-Y468 WeakPolarHBondContact O-CE2 3.47Å; L424-Y468 PolarHBondContact O-OH 3.19Å
425	G	96.8	Very high	96.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-74.4	-42.1	174.7	0	0	0	0	0	113	I421 L422 V423 I427 A428	I421-G425 PolarHBondContact O-N 3.33Å; I421-G425 VanDerWaalsContact O-N 3.09Å; L422-G425 PolarHBondContact O-N 2.66Å; V423-G425 VanDerWaalsContact C-N 3.32Å; V423-G425 PolarHBondContact O-N 3.31Å; G425-I427 PolarHBondContact O-N 3.45Å; G425-A428 WeakPolarHBondContact O-CB 3.31Å; G425-A428 PolarHBondContact O-N 3.33Å; G425-A428 VanDerWaalsContact O-N 3.07Å
426	A	95.4	Very high	96.4	Very high	2 Å²	2	20.1 Å²	20.1	2%	0.017	10%	0.104	C	C	.	.	H	α-helix	trans	-63.6	-25.5	-178.7	0	0	0	0	0	113.7	M308 D387 L422 V423	M308-A426 HydrophobicContact CE-CB 4.22Å; D387-A426 VanDerWaalsContact CA-O 3.28Å; D387-A426 WeakPolarHBondContact CA-O 3.24Å; D387-A426 WeakPolarHBondContact CB-O 3.49Å; L422-A426 WeakPolarHBondContact O-CB 3.36Å; L422-A426 PolarHBondContact O-N 3.2Å; V423-A426 PolarHBondContact O-N 3.06Å
427	I	97.5	Very high	96.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-2.4	177.1	68.9	-178.4	0	0	0	113.4	L386 A390 L398 I401 L405 V423 G425 E429 C431 M435	L386-I427 HydrophobicContact CD2-CG2 4.18Å; L386-I427 HydrophobicContact CG-CG2 4.16Å; A390-I427 HydrophobicContact CB-CB 4.14Å; A390-I427 HydrophobicContact CB-CG2 4.24Å; L398-I427 HydrophobicContact CD2-CD1 4.26Å; I401-I427 HydrophobicContact CG2-CD1 3.73Å; L405-I427 HydrophobicContact CD1-CD1 4.03Å; V423-I427 WeakPolarHBondContact O-CG1 3.23Å; V423-I427 WeakPolarHBondContact O-CG2 3.48Å; V423-I427 PolarHBondContact O-N 3.39Å; G425-I427 PolarHBondContact O-N 3.45Å; I427-E429 PolarHBondContact O-N 3.37Å; I427-C431 HydrophobicContact CB-CB 4.43Å; I427-C431 VanDerWaalsContact O-CB 3.26Å; I427-C431 WeakPolarHBondContact O-CB 3.41Å; I427-C431 PolarHBondContact O-N 2.92Å; I427-M435 HydrophobicContact CD1-SD 4.26Å
428	A	95	Very high	96.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-47.8	-164.6	0	0	0	0	0	112.2	G425 M432 R467 Y468	G425-A428 WeakPolarHBondContact O-CB 3.31Å; G425-A428 PolarHBondContact O-N 3.33Å; G425-A428 VanDerWaalsContact O-N 3.07Å; A428-M432 VanDerWaalsContact O-CA 3.22Å; A428-M432 WeakPolarHBondContact O-CA 3.46Å; A428-M432 VanDerWaalsContact O-CB 3.24Å; A428-M432 WeakPolarHBondContact O-CB 3.42Å; A428-M432 PolarHBondContact O-N 3.21Å; A428-R467 HydrophobicContact CB-CB 3.84Å; A428-Y468 WeakPolarHBondContact CA-OH 3.26Å; A428-Y468 HydrophobicContact CB-CD1 4.39Å; A428-Y468 HydrophobicContact CB-CD2 4.25Å; A428-Y468 HydrophobicContact CB-CE1 3.8Å; A428-Y468 HydrophobicContact CB-CE2 3.63Å
429	E	88.8	Confident	96.4	Very high	89 Å²	89	26.9 Å²	26.9	42%	0.416	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-58.6	-176.4	-166.6	-173.7	122.7	0	0	111.3	N391 I427 C431 R467	N391-E429 PolarHBondContact ND2-OE1 3.34Å; I427-E429 PolarHBondContact O-N 3.37Å; E429-C431 PolarHBondContact O-N 3.12Å; E429-R467 IonicContact OE2-CZ 3.75Å; E429-R467 IonicContact OE2-NH1 3.65Å; E429-R467 IonicContact OE2-NH2 2.8Å; E429-R467 PolarHBondContact OE2-NH2 2.92Å
430	G	91.4	Very high	96.4	Very high	9 Å²	9	29.8 Å²	29.8	9%	0.093	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-28.9	-177.3	0	0	0	0	0	115.4	A390 N391 R394	A390-G430 WeakPolarHBondContact O-CA 3.04Å; N391-G430 WeakPolarHBondContact OD1-CA 3.24Å; N391-G430 PolarHBondContact OD1-N 3.09Å; R394-G430 VanDerWaalsContact CA-O 3.27Å; R394-G430 WeakPolarHBondContact CA-O 3.3Å; R394-G430 WeakPolarHBondContact CB-O 3.35Å
431	C	96.8	Very high	96.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	16.3	-175.2	-59	0	0	0	0	114.1	R394 L398 I427 E429 Q433 G434 M435	R394-C431 PolarHBondContact O-SG 3.03Å; L398-C431 HydrophobicContact CD1-CB 4.43Å; L398-C431 HydrophobicContact CD2-CB 3.8Å; L398-C431 HydrophobicContact CG-CB 4.16Å; I427-C431 HydrophobicContact CB-CB 4.43Å; I427-C431 VanDerWaalsContact O-CB 3.26Å; I427-C431 WeakPolarHBondContact O-CB 3.41Å; I427-C431 PolarHBondContact O-N 2.92Å; E429-C431 PolarHBondContact O-N 3.12Å; C431-Q433 VanDerWaalsContact C-N 3.34Å; C431-Q433 PolarHBondContact O-N 2.82Å; C431-G434 PolarHBondContact O-N 2.79Å; C431-M435 HydrophobicContact CB-CG 4.3Å; C431-M435 WeakPolarHBondContact O-CB 3.5Å; C431-M435 VanDerWaalsContact O-CG 3.32Å; C431-M435 WeakPolarHBondContact O-CG 3.27Å; C431-M435 PolarHBondContact O-N 3.22Å
432	M	94.4	Very high	96.3	Very high	41 Å²	41	37.9 Å²	37.9	20%	0.202	20%	0.196	C	C	.	.	H	α-helix	trans	-50.3	-51.1	-174.7	-178.7	57.3	69.8	0	0	112.4	A428 G434 M435 I436 L439 Y468	A428-M432 VanDerWaalsContact O-CA 3.22Å; A428-M432 WeakPolarHBondContact O-CA 3.46Å; A428-M432 VanDerWaalsContact O-CB 3.24Å; A428-M432 WeakPolarHBondContact O-CB 3.42Å; A428-M432 PolarHBondContact O-N 3.21Å; M432-G434 PolarHBondContact O-N 3.46Å; M432-M435 PolarHBondContact O-N 2.9Å; M432-I436 WeakPolarHBondContact O-CG1 3.23Å; M432-I436 PolarHBondContact O-N 3.4Å; M432-L439 HydrophobicContact SD-CD1 4.19Å; M432-Y468 HydrophobicContact CE-CD1 3.49Å; M432-Y468 VanDerWaalsContact CE-CD1 3.49Å; M432-Y468 HydrophobicContact CE-CE1 3.81Å; M432-Y468 HydrophobicContact CE-CG 4.42Å; M432-Y468 HydrophobicContact SD-CD1 3.77Å; M432-Y468 HydrophobicContact SD-CE1 3.96Å
433	Q	94.2	Very high	96.3	Very high	132 Å²	132	37.2 Å²	37.2	62%	0.617	19%	0.193	S	C	*	.	H	α-helix	trans	-61.6	-45.1	-173.6	-64	-58.9	-34	0	0	112.5	C431 M435	C431-Q433 VanDerWaalsContact C-N 3.34Å; C431-Q433 PolarHBondContact O-N 2.82Å; Q433-M435 VanDerWaalsContact C-N 3.29Å; Q433-M435 PolarHBondContact O-N 2.79Å
434	G	96.1	Very high	96.3	Very high	16 Å²	16	39.4 Å²	39.4	17%	0.165	21%	0.207	C	C	.	.	H	α-helix	trans	-72	-20.2	175.1	0	0	0	0	0	114	D395 L398 C431 M432 P437 Y438	D395-G434 WeakPolarHBondContact OD1-CA 3.33Å; D395-G434 PolarHBondContact OD1-N 3.1Å; D395-G434 PolarHBondContact OD2-N 3.33Å; L398-G434 VanDerWaalsContact CD1-C 3.46Å; C431-G434 PolarHBondContact O-N 2.79Å; M432-G434 PolarHBondContact O-N 3.46Å; G434-P437 WeakPolarHBondContact O-CD 3.48Å; G434-Y438 WeakPolarHBondContact O-CE2 3.15Å
435	M	97.6	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-84.2	-27.1	177.5	-75.6	-61.2	-64.5	0	0	114	L398 L402 L424 I427 C431 M432 Q433 P437 Y438 L439 L442 Y468	L398-M435 HydrophobicContact CD1-CG 4.45Å; L398-M435 HydrophobicContact CD2-CG 3.93Å; L398-M435 HydrophobicContact CD2-SD 3.64Å; L402-M435 HydrophobicContact CD2-SD 4.09Å; L424-M435 HydrophobicContact CD1-CE 3.31Å; I427-M435 HydrophobicContact CD1-SD 4.26Å; C431-M435 HydrophobicContact CB-CG 4.3Å; C431-M435 WeakPolarHBondContact O-CB 3.5Å; C431-M435 VanDerWaalsContact O-CG 3.32Å; C431-M435 WeakPolarHBondContact O-CG 3.27Å; C431-M435 PolarHBondContact O-N 3.22Å; M432-M435 PolarHBondContact O-N 2.9Å; Q433-M435 VanDerWaalsContact C-N 3.29Å; Q433-M435 PolarHBondContact O-N 2.79Å; M435-P437 VanDerWaalsContact C-N 3.3Å; M435-P437 VanDerWaalsContact O-N 3.1Å; M435-Y438 PolarHBondContact O-N 3.11Å; M435-Y438 HydrophobicContact SD-CD2 4.28Å; M435-L439 PolarHBondContact O-N 2.98Å; M435-L442 HydrophobicContact CE-CD1 3.61Å; M435-Y468 HydrophobicContact CB-CE1 4.48Å
436	I	97.3	Very high	96.4	Very high	58 Å²	58	41 Å²	41	30%	0.297	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44	-43.8	178.7	-73.6	168	0	0	0	114.1	M432 Y438 L439 P440	M432-I436 WeakPolarHBondContact O-CG1 3.23Å; M432-I436 PolarHBondContact O-N 3.4Å; I436-Y438 PolarHBondContact O-N 3.48Å; I436-Y438 VanDerWaalsContact O-N 3.12Å; I436-L439 HydrophobicContact CG1-CD1 4.33Å; I436-L439 PolarHBondContact O-N 3.21Å; I436-P440 VanDerWaalsContact O-CD 3.22Å; I436-P440 WeakPolarHBondContact O-CD 3.48Å
437	P	97.8	Very high	96.5	Very high	94 Å²	94	41.9 Å²	41.9	61%	0.61	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.5	178.8	-25.2	35.9	0	0	0	114.9	G434 M435	G434-P437 WeakPolarHBondContact O-CD 3.48Å; M435-P437 VanDerWaalsContact C-N 3.3Å; M435-P437 VanDerWaalsContact O-N 3.1Å
438	Y	97.4	Very high	96.5	Very high	106 Å²	106	48.3 Å²	48.3	42%	0.416	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-23.1	-176.9	-52.1	-77.9	0	0	0	112.9	L402 G434 M435 I436 P440 E441 L442	L402-Y438 HydrophobicContact CD1-CE2 3.95Å; L402-Y438 HydrophobicContact CD2-CD2 4.35Å; L402-Y438 HydrophobicContact CD2-CE2 4.15Å; G434-Y438 WeakPolarHBondContact O-CE2 3.15Å; M435-Y438 PolarHBondContact O-N 3.11Å; M435-Y438 HydrophobicContact SD-CD2 4.28Å; I436-Y438 PolarHBondContact O-N 3.48Å; I436-Y438 VanDerWaalsContact O-N 3.12Å; Y438-P440 VanDerWaalsContact C-CD 3.41Å; Y438-P440 VanDerWaalsContact C-N 3.34Å; Y438-E441 PolarHBondContact O-N 3.26Å; Y438-L442 WeakPolarHBondContact O-CG 3.25Å; Y438-L442 PolarHBondContact O-N 3.27Å
439	L	97.8	Very high	96.7	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-54.8	-36.4	-179.1	-60.9	-176.4	0	0	0	114.8	M432 M435 I436 E441 L442 I443 Y468 W471	M432-L439 HydrophobicContact SD-CD1 4.19Å; M435-L439 PolarHBondContact O-N 2.98Å; I436-L439 HydrophobicContact CG1-CD1 4.33Å; I436-L439 PolarHBondContact O-N 3.21Å; L439-E441 PolarHBondContact O-N 3.34Å; L439-E441 VanDerWaalsContact O-N 3.1Å; L439-L442 PolarHBondContact O-N 2.81Å; L439-I443 HydrophobicContact CB-CG1 4.15Å; L439-I443 HydrophobicContact CD2-CD1 4.46Å; L439-I443 HydrophobicContact CD2-CG1 4.42Å; L439-I443 WeakPolarHBondContact O-CB 3.11Å; L439-I443 WeakPolarHBondContact O-CG1 3.38Å; L439-I443 PolarHBondContact O-N 3.34Å; L439-Y468 HydrophobicContact CD1-CD1 3.8Å; L439-Y468 HydrophobicContact CD1-CE1 4.24Å; L439-Y468 HydrophobicContact CD2-CD1 3.64Å; L439-Y468 HydrophobicContact CD2-CE1 3.63Å; L439-Y468 HydrophobicContact CD2-CG 4.23Å; L439-Y468 HydrophobicContact CG-CD1 4.39Å; L439-W471 HydrophobicContact CB-CD2 3.96Å; L439-W471 HydrophobicContact CB-CE3 4Å; L439-W471 HydrophobicContact CB-CH2 3.78Å; L439-W471 HydrophobicContact CB-CZ2 3.73Å; L439-W471 HydrophobicContact CB-CZ3 3.92Å; L439-W471 HydrophobicContact CD1-CB 4.01Å; L439-W471 HydrophobicContact CD1-CD2 3.54Å; L439-W471 HydrophobicContact CD1-CE3 4.08Å; L439-W471 HydrophobicContact CD1-CG 3.48Å; L439-W471 VanDerWaalsContact CD1-CG 3.48Å; L439-W471 HydrophobicContact CG-CD2 4.4Å
440	P	98.3	Very high	97.1	Very high	61 Å²	61	44.3 Å²	44.3	40%	0.396	23%	0.231	S	C	.	.	H	α-helix	trans	-58.1	-24.9	175.8	-28.6	36.3	0	0	0	114.9	I436 Y438 P444 W471	I436-P440 VanDerWaalsContact O-CD 3.22Å; I436-P440 WeakPolarHBondContact O-CD 3.48Å; Y438-P440 VanDerWaalsContact C-CD 3.41Å; Y438-P440 VanDerWaalsContact C-N 3.34Å; P440-P444 WeakPolarHBondContact O-CD 3.36Å; P440-P444 WeakPolarHBondContact O-CG 3.36Å; P440-W471 HydrophobicContact CG-CH2 4.25Å; P440-W471 HydrophobicContact CG-CZ2 4.06Å
441	E	97	Very high	97.4	Very high	148 Å²	148	47.6 Å²	47.6	69%	0.692	25%	0.252	S	S	*	.	H	α-helix	trans	-97.1	-41.7	174.8	-174.9	175.8	-179.9	0	0	111.7	Y438 L439 H445	Y438-E441 PolarHBondContact O-N 3.26Å; L439-E441 PolarHBondContact O-N 3.34Å; L439-E441 VanDerWaalsContact O-N 3.1Å; E441-H445 PolarHBondContact O-N 3.14Å
442	L	97.8	Very high	97.4	Very high	22 Å²	22	48.9 Å²	48.9	12%	0.115	26%	0.259	C	S	.	.	H	α-helix	trans	-69.3	-43.8	-175.6	-66.2	174.6	0	0	0	113	L409 L424 M435 Y438 L439 H445 L446	L409-L442 HydrophobicContact CD1-CD2 3.81Å; L424-L442 HydrophobicContact CD1-CD1 3.99Å; L424-L442 HydrophobicContact CD2-CD1 4.36Å; M435-L442 HydrophobicContact CE-CD1 3.61Å; Y438-L442 WeakPolarHBondContact O-CG 3.25Å; Y438-L442 PolarHBondContact O-N 3.27Å; L439-L442 PolarHBondContact O-N 2.81Å; L442-H445 WeakPolarHBondContact O-CB 3.39Å; L442-H445 PolarHBondContact O-N 3.49Å; L442-H445 VanDerWaalsContact O-N 3.13Å; L442-L446 WeakPolarHBondContact O-CG 3.37Å; L442-L446 PolarHBondContact O-N 3.25Å
443	I	98.4	Very high	97.4	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-48.6	-177.2	-63.4	-62.4	0	0	0	111.7	L439 H445 L446 I447 L465 Y468 W471 V472 Y480	L439-I443 HydrophobicContact CB-CG1 4.15Å; L439-I443 HydrophobicContact CD2-CD1 4.46Å; L439-I443 HydrophobicContact CD2-CG1 4.42Å; L439-I443 WeakPolarHBondContact O-CB 3.11Å; L439-I443 WeakPolarHBondContact O-CG1 3.38Å; L439-I443 PolarHBondContact O-N 3.34Å; I443-H445 PolarHBondContact O-N 3.32Å; I443-L446 HydrophobicContact CD1-CD1 4.43Å; I443-L446 PolarHBondContact O-N 3.23Å; I443-I447 HydrophobicContact CG2-CD1 3.97Å; I443-I447 HydrophobicContact CG2-CG1 4.47Å; I443-I447 WeakPolarHBondContact O-CG1 3.25Å; I443-I447 PolarHBondContact O-N 2.67Å; I443-L465 HydrophobicContact CD1-CD2 4.09Å; I443-L465 HydrophobicContact CG2-CD2 4.27Å; I443-Y468 HydrophobicContact CD1-CG 4.3Å; I443-W471 HydrophobicContact CB-CZ3 4.15Å; I443-W471 HydrophobicContact CG1-CE3 3.97Å; I443-W471 HydrophobicContact CG1-CZ3 3.68Å; I443-V472 HydrophobicContact CD1-CG2 4.41Å; I443-V472 HydrophobicContact CG1-CG2 4.46Å; I443-V472 HydrophobicContact CG2-CG2 3.97Å; I443-Y480 HydrophobicContact CB-CD1 4.49Å; I443-Y480 HydrophobicContact CG2-CD1 4.09Å
444	P	98.3	Very high	97.5	Very high	47 Å²	47	50.4 Å²	50.4	31%	0.305	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-32.9	173.2	-27.2	36.8	0	0	0	113.9	P440 Q448 Y480	P440-P444 WeakPolarHBondContact O-CD 3.36Å; P440-P444 WeakPolarHBondContact O-CG 3.36Å; P444-Q448 WeakPolarHBondContact O-CG 3.34Å; P444-Q448 PolarHBondContact O-N 3.18Å; P444-Y480 HydrophobicContact CG-CD1 4.18Å; P444-Y480 HydrophobicContact CG-CE1 3.74Å
445	H	97.9	Very high	97.4	Very high	34 Å²	34	49.9 Å²	49.9	16%	0.157	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-46.6	175.5	178.3	56.4	0	0	0	111.7	F410 E441 L442 I443 I447 Q448 C449	F410-H445 AromaticContact CD1-CE1 3.78Å; F410-H445 AromaticContact CD1-NE2 3.75Å; F410-H445 AromaticContact CE1-CD2 3.69Å; F410-H445 AromaticContact CE1-CE1 3.52Å; F410-H445 AromaticContact CE1-CG 3.87Å; F410-H445 AromaticContact CE1-ND1 3.78Å; F410-H445 AromaticContact CE1-NE2 3.44Å; F410-H445 WeakPolarHBondContact CE1-NE2 3.49Å; E441-H445 PolarHBondContact O-N 3.14Å; L442-H445 WeakPolarHBondContact O-CB 3.39Å; L442-H445 PolarHBondContact O-N 3.49Å; L442-H445 VanDerWaalsContact O-N 3.13Å; I443-H445 PolarHBondContact O-N 3.32Å; H445-I447 VanDerWaalsContact C-N 3.33Å; H445-I447 PolarHBondContact O-N 3.47Å; H445-Q448 WeakPolarHBondContact O-CA 3.36Å; H445-Q448 VanDerWaalsContact O-CB 3.3Å; H445-Q448 WeakPolarHBondContact O-CB 3.47Å; H445-Q448 PolarHBondContact O-N 3.16Å; H445-C449 PolarHBondContact O-N 2.7Å; H445-C449 VanDerWaalsContact O-N 3.1Å
446	L	98.5	Very high	97.2	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-39.8	175.5	-69.4	177	0	0	0	111.9	I421 L424 L442 I443 Q448 C449 L450 T461 T464 L465	I421-L446 HydrophobicContact CG1-CD2 4.14Å; I421-L446 HydrophobicContact CG2-CD2 4.01Å; L424-L446 HydrophobicContact CD2-CD1 3.85Å; L424-L446 HydrophobicContact CD2-CD2 4.3Å; L424-L446 HydrophobicContact CD2-CG 4.35Å; L442-L446 WeakPolarHBondContact O-CG 3.37Å; L442-L446 PolarHBondContact O-N 3.25Å; I443-L446 HydrophobicContact CD1-CD1 4.43Å; I443-L446 PolarHBondContact O-N 3.23Å; L446-Q448 PolarHBondContact O-N 3.33Å; L446-C449 WeakPolarHBondContact O-CA 3.38Å; L446-C449 VanDerWaalsContact O-CB 3.32Å; L446-C449 WeakPolarHBondContact O-CB 3.43Å; L446-C449 PolarHBondContact O-N 3.04Å; L446-L450 PolarHBondContact O-N 3.14Å; L446-L450 VanDerWaalsContact O-N 3.17Å; L446-T461 HydrophobicContact CB-CG2 4.18Å; L446-T461 HydrophobicContact CD2-CG2 4.41Å; L446-T461 WeakPolarHBondContact O-CG2 3.35Å; L446-T464 HydrophobicContact CD1-CG2 3.86Å; L446-L465 HydrophobicContact CB-CD1 4.13Å; L446-L465 HydrophobicContact CB-CD2 3.64Å; L446-L465 HydrophobicContact CB-CG 3.87Å; L446-L465 HydrophobicContact CD1-CD2 4.02Å; L446-L465 HydrophobicContact CD1-CG 4.27Å
447	I	98.6	Very high	97.2	Very high	19 Å²	19	47.5 Å²	47.5	10%	0.097	25%	0.245	C	C	.	.	H	α-helix	trans	-57.6	-35	173.6	-67.5	167.9	0	0	0	111.2	I443 H445 L450 L465 P483 L484 E487	I443-I447 HydrophobicContact CG2-CD1 3.97Å; I443-I447 HydrophobicContact CG2-CG1 4.47Å; I443-I447 WeakPolarHBondContact O-CG1 3.25Å; I443-I447 PolarHBondContact O-N 2.67Å; H445-I447 VanDerWaalsContact C-N 3.33Å; H445-I447 PolarHBondContact O-N 3.47Å; I447-L450 WeakPolarHBondContact O-CB 3.36Å; I447-L465 HydrophobicContact CG1-CD2 4.34Å; I447-P483 HydrophobicContact CD1-CB 4.35Å; I447-L484 HydrophobicContact CD1-CB 4.02Å; I447-L484 HydrophobicContact CG1-CB 4.35Å; I447-L484 HydrophobicContact CG1-CD1 4.13Å; I447-E487 HydrophobicContact CG2-CB 4.32Å; I447-E487 HydrophobicContact CG2-CG 3.85Å
448	Q	97.9	Very high	97.2	Very high	135 Å²	135	43.6 Å²	43.6	63%	0.631	22%	0.218	S	C	*	.	H	α-helix	trans	-69.5	-36.2	172.8	-64.7	170.4	8.3	0	0	112.3	P444 H445 L446 L450 S451	P444-Q448 WeakPolarHBondContact O-CG 3.34Å; P444-Q448 PolarHBondContact O-N 3.18Å; H445-Q448 WeakPolarHBondContact O-CA 3.36Å; H445-Q448 VanDerWaalsContact O-CB 3.3Å; H445-Q448 WeakPolarHBondContact O-CB 3.47Å; H445-Q448 PolarHBondContact O-N 3.16Å; L446-Q448 PolarHBondContact O-N 3.33Å; Q448-L450 PolarHBondContact O-N 2.96Å; Q448-S451 PolarHBondContact O-N 3.43Å
449	C	98.3	Very high	97.1	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-22.6	177.3	-69.7	0	0	0	0	113.5	H445 L446 S451 D452 T461	H445-C449 PolarHBondContact O-N 2.7Å; H445-C449 VanDerWaalsContact O-N 3.1Å; L446-C449 WeakPolarHBondContact O-CA 3.38Å; L446-C449 VanDerWaalsContact O-CB 3.32Å; L446-C449 WeakPolarHBondContact O-CB 3.43Å; L446-C449 PolarHBondContact O-N 3.04Å; C449-S451 PolarHBondContact O-N 2.89Å; C449-S451 VanDerWaalsContact O-N 3.13Å; C449-D452 VanDerWaalsContact O-CB 3.27Å; C449-D452 WeakPolarHBondContact O-CB 3.47Å; C449-D452 PolarHBondContact O-N 2.98Å; C449-T461 HydrophobicContact CB-CG2 3.74Å
450	L	98.3	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.2	169.2	-66.6	175.4	0	0	0	112.1	L446 I447 Q448 R458 T461 C462 L465 L484 E487 L488 R491	L446-L450 PolarHBondContact O-N 3.14Å; L446-L450 VanDerWaalsContact O-N 3.17Å; I447-L450 WeakPolarHBondContact O-CB 3.36Å; Q448-L450 PolarHBondContact O-N 2.96Å; L450-R458 WeakPolarHBondContact O-CD 3.17Å; L450-R458 WeakPolarHBondContact O-CG 3.47Å; L450-T461 HydrophobicContact CD2-CG2 3.71Å; L450-T461 HydrophobicContact CG-CG2 3.9Å; L450-C462 HydrophobicContact CD2-CB 4.5Å; L450-C462 VanDerWaalsContact CD2-SG 3.56Å; L450-L465 HydrophobicContact CD1-CD1 3.71Å; L450-L465 HydrophobicContact CD2-CD1 3.97Å; L450-L465 HydrophobicContact CG-CD1 3.8Å; L450-L484 HydrophobicContact CD1-CD1 4.38Å; L450-E487 HydrophobicContact CB-CB 4.47Å; L450-E487 HydrophobicContact CD1-CB 3.7Å; L450-L488 HydrophobicContact CD1-CD2 4.21Å; L450-L488 HydrophobicContact CD1-CG 4.28Å; L450-L488 HydrophobicContact CD2-CD2 4.2Å; L450-R491 HydrophobicContact CB-CG 4.17Å; L450-R491 HydrophobicContact CD2-CG 4.21Å; L450-R491 VanDerWaalsContact O-CD 3.23Å; L450-R491 WeakPolarHBondContact O-CD 3.21Å
451	S	96.8	Very high	97.1	Very high	77 Å²	77	37.3 Å²	37.3	54%	0.538	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	14.9	175.2	-65.8	0	0	0	0	113.7	Q448 C449	Q448-S451 PolarHBondContact O-N 3.43Å; C449-S451 PolarHBondContact O-N 2.89Å; C449-S451 VanDerWaalsContact O-N 3.13Å
452	D	97.2	Very high	97.1	Very high	28 Å²	28	30.2 Å²	30.2	15%	0.15	16%	0.156	C	C	.	.			trans	-64.6	147.7	176.9	-162	-63.4	0	0	0	110.9	K417 C449 K454 V457 R458	K417-D452 IonicContact NZ-OD2 3.77Å; K417-D452 PolarHBondContact NZ-OD2 3.49Å; C449-D452 VanDerWaalsContact O-CB 3.27Å; C449-D452 WeakPolarHBondContact O-CB 3.47Å; C449-D452 PolarHBondContact O-N 2.98Å; D452-K454 PolarHBondContact O-N 2.9Å; D452-K454 PolarHBondContact OD1-N 3.5Å; D452-V457 HydrophobicContact CB-CB 4.18Å; D452-V457 HydrophobicContact CB-CG1 3.8Å; D452-R458 WeakPolarHBondContact O-CD 3.35Å; D452-R458 VanDerWaalsContact O-CG 3.29Å; D452-R458 WeakPolarHBondContact O-CG 3.4Å; D452-R458 PolarHBondContact O-NH1 3.35Å
453	K	94.4	Very high	97	Very high	172 Å²	172	33.7 Å²	33.7	75%	0.748	17%	0.168	S	C	*	.	S	Bend	trans	-67	-17.5	-179.8	63.8	177.4	-179.9	179.3	0	113.4	E323 R458	E323-K453 VanDerWaalsContact OE2-O 3.04Å; K453-R458 PolarHBondContact O-NH1 2.81Å
454	K	95.4	Very high	97	Very high	32 Å²	32	33.7 Å²	33.7	14%	0.139	17%	0.168	C	C	.	.			trans	-99.6	120.6	-178.7	-79.4	-59.6	-162.1	171.6	0	111.6	G320 D321 E323 W414 D452 L456 V457 R458	G320-K454 PolarHBondContact O-NZ 3.23Å; D321-K454 IonicContact OD1-NZ 2.61Å; D321-K454 PolarHBondContact OD1-NZ 2.86Å; E323-K454 WeakPolarHBondContact OE1-CA 3.23Å; W414-K454 HydrophobicContact CB-CB 4.47Å; W414-K454 HydrophobicContact CB-CG 4.03Å; W414-K454 HydrophobicContact CD2-CG 4.19Å; W414-K454 HydrophobicContact CG-CG 3.86Å; D452-K454 PolarHBondContact O-N 2.9Å; D452-K454 PolarHBondContact OD1-N 3.5Å; K454-L456 VanDerWaalsContact C-N 3.33Å; K454-L456 PolarHBondContact O-N 3.22Å; K454-V457 HydrophobicContact CB-CB 4.25Å; K454-V457 HydrophobicContact CB-CG2 3.86Å; K454-V457 WeakPolarHBondContact O-CB 3.29Å; K454-V457 PolarHBondContact O-N 2.91Å; K454-V457 VanDerWaalsContact O-N 3.09Å; K454-R458 PolarHBondContact O-N 3.36Å; K454-R458 VanDerWaalsContact O-N 3.12Å
455	A	94.3	Very high	97	Very high	5 Å²	5	31.5 Å²	31.5	4%	0.041	15%	0.153	C	C	.	.	H	α-helix	trans	-55.2	-44.3	-178.5	0	0	0	0	0	112.9	E323 V457 R458 S459 N496 V499	E323-A455 PolarHBondContact OE1-N 2.85Å; E323-A455 WeakPolarHBondContact OE2-CB 3.25Å; E323-A455 PolarHBondContact OE2-N 2.96Å; A455-V457 VanDerWaalsContact C-N 3.29Å; A455-V457 PolarHBondContact O-N 3.32Å; A455-R458 WeakPolarHBondContact O-CB 3.08Å; A455-R458 PolarHBondContact O-N 3.27Å; A455-R458 VanDerWaalsContact O-N 3.11Å; A455-S459 WeakPolarHBondContact O-CB 3.42Å; A455-S459 PolarHBondContact O-N 3.21Å; A455-N496 HydrophobicContact CB-CB 3.99Å; A455-V499 HydrophobicContact CB-CG2 3.83Å; A455-V499 VanDerWaalsContact O-CG2 3.29Å; A455-V499 WeakPolarHBondContact O-CG2 3.21Å
456	L	93.5	Very high	96.9	Very high	9 Å²	9	30.5 Å²	30.5	5%	0.047	15%	0.151	C	C	.	.	H	α-helix	trans	-63.1	-34	179.2	-65.7	174.5	0	0	0	112.7	Y310 L318 W414 K454 I460	Y310-L456 HydrophobicContact CE2-CD1 4.35Å; L318-L456 HydrophobicContact CD1-CD2 4.45Å; W414-L456 HydrophobicContact CE3-CB 4.48Å; W414-L456 HydrophobicContact CH2-CB 4.45Å; W414-L456 HydrophobicContact CH2-CD1 3.52Å; W414-L456 HydrophobicContact CZ3-CB 3.79Å; W414-L456 HydrophobicContact CZ3-CD1 3.71Å; W414-L456 HydrophobicContact CZ3-CG 4.38Å; K454-L456 VanDerWaalsContact C-N 3.33Å; K454-L456 PolarHBondContact O-N 3.22Å; L456-I460 WeakPolarHBondContact O-CG2 3.49Å; L456-I460 PolarHBondContact O-N 3.33Å; L456-I460 VanDerWaalsContact O-N 3.16Å
457	V	97.1	Very high	96.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-67.7	-44.5	172.9	177.9	0	0	0	0	110.5	W414 K417 E418 I421 D452 K454 A455 S459 I460 T461	W414-V457 HydrophobicContact CB-CG2 3.98Å; W414-V457 HydrophobicContact CE3-CG2 4.11Å; K417-V457 HydrophobicContact CD-CG1 4.34Å; E418-V457 HydrophobicContact CB-CG2 4.17Å; E418-V457 HydrophobicContact CG-CG2 4.48Å; I421-V457 HydrophobicContact CD1-CG1 3.94Å; D452-V457 HydrophobicContact CB-CB 4.18Å; D452-V457 HydrophobicContact CB-CG1 3.8Å; K454-V457 HydrophobicContact CB-CB 4.25Å; K454-V457 HydrophobicContact CB-CG2 3.86Å; K454-V457 WeakPolarHBondContact O-CB 3.29Å; K454-V457 PolarHBondContact O-N 2.91Å; K454-V457 VanDerWaalsContact O-N 3.09Å; A455-V457 VanDerWaalsContact C-N 3.29Å; A455-V457 PolarHBondContact O-N 3.32Å; V457-S459 VanDerWaalsContact C-N 3.34Å; V457-S459 PolarHBondContact O-N 3.36Å; V457-I460 WeakPolarHBondContact O-CG2 3.35Å; V457-T461 VanDerWaalsContact O-CB 3.3Å; V457-T461 WeakPolarHBondContact O-CB 3.5Å; V457-T461 PolarHBondContact O-N 2.75Å; V457-T461 PolarHBondContact O-OG1 2.68Å
458	R	98.1	Very high	96.7	Very high	11 Å²	11	33.3 Å²	33.3	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-46.1	177.9	-60.9	-163.2	-67	-73.8	0.8	111.2	E323 L450 D452 K453 K454 A455 T461 C462 R491 D494 V499	E323-R458 IonicContact OE2-CZ 3.33Å; E323-R458 IonicContact OE2-NH1 2.61Å; E323-R458 PolarHBondContact OE2-NH1 3.38Å; E323-R458 IonicContact OE2-NH2 2.99Å; E323-R458 PolarHBondContact OE2-NH2 3.14Å; L450-R458 WeakPolarHBondContact O-CD 3.17Å; L450-R458 WeakPolarHBondContact O-CG 3.47Å; D452-R458 WeakPolarHBondContact O-CD 3.35Å; D452-R458 VanDerWaalsContact O-CG 3.29Å; D452-R458 WeakPolarHBondContact O-CG 3.4Å; D452-R458 PolarHBondContact O-NH1 3.35Å; K453-R458 PolarHBondContact O-NH1 2.81Å; K454-R458 PolarHBondContact O-N 3.36Å; K454-R458 VanDerWaalsContact O-N 3.12Å; A455-R458 WeakPolarHBondContact O-CB 3.08Å; A455-R458 PolarHBondContact O-N 3.27Å; A455-R458 VanDerWaalsContact O-N 3.11Å; R458-T461 WeakPolarHBondContact O-CB 3.34Å; R458-T461 PolarHBondContact O-N 3.24Å; R458-C462 PolarHBondContact O-N 2.9Å; R458-C462 PolarHBondContact O-SG 2.98Å; R458-C462 VanDerWaalsContact O-SG 3.33Å; R458-R491 VanDerWaalsContact CD-NH1 3.34Å; R458-D494 IonicContact CZ-OD1 3.31Å; R458-D494 IonicContact CZ-OD2 3.54Å; R458-D494 IonicContact NE-OD1 3.41Å; R458-D494 IonicContact NE-OD2 3.79Å; R458-D494 PolarHBondContact NE-OD2 3.07Å; R458-D494 IonicContact NH2-OD1 2.79Å; R458-D494 PolarHBondContact NH2-OD1 3.11Å; R458-D494 IonicContact NH2-OD2 3.06Å; R458-D494 PolarHBondContact NH2-OD2 3.2Å; R458-V499 HydrophobicContact CB-CG1 3.94Å; R458-V499 HydrophobicContact CB-CG2 4.03Å
459	S	95.4	Very high	96.6	Very high	19 Å²	19	27 Å²	27	13%	0.133	13%	0.13	C	C	.	.	H	α-helix	trans	-59	-53.6	-179.8	173.3	0	0	0	0	112.1	A455 V457 T461 C462 W463 A502	A455-S459 WeakPolarHBondContact O-CB 3.42Å; A455-S459 PolarHBondContact O-N 3.21Å; V457-S459 VanDerWaalsContact C-N 3.34Å; V457-S459 PolarHBondContact O-N 3.36Å; S459-T461 PolarHBondContact O-N 2.83Å; S459-C462 WeakPolarHBondContact O-CB 3.42Å; S459-C462 PolarHBondContact O-N 3.02Å; S459-C462 VanDerWaalsContact O-N 3.14Å; S459-W463 PolarHBondContact O-N 3.26Å; S459-A502 WeakPolarHBondContact OG-CB 3.48Å
460	I	96.6	Very high	96.4	Very high	17 Å²	17	31.1 Å²	31.1	9%	0.087	15%	0.149	C	C	.	.	H	α-helix	trans	-66.5	-27.5	179	-167.3	59.2	0	0	0	112.9	E418 I421 L422 L456 V457 W463 T464	E418-I460 HydrophobicContact CG-CG2 3.76Å; E418-I460 WeakPolarHBondContact OE1-CB 3.34Å; E418-I460 WeakPolarHBondContact OE1-CG2 3.43Å; I421-I460 HydrophobicContact CB-CG2 4.07Å; I421-I460 HydrophobicContact CG2-CG1 4.2Å; I421-I460 HydrophobicContact CG2-CG2 3.86Å; L422-I460 HydrophobicContact CB-CD1 4.03Å; L422-I460 HydrophobicContact CB-CG1 3.93Å; L422-I460 HydrophobicContact CD1-CD1 3.66Å; L422-I460 HydrophobicContact CG-CD1 4.4Å; L456-I460 WeakPolarHBondContact O-CG2 3.49Å; L456-I460 PolarHBondContact O-N 3.33Å; L456-I460 VanDerWaalsContact O-N 3.16Å; V457-I460 WeakPolarHBondContact O-CG2 3.35Å; I460-W463 HydrophobicContact CD1-CD2 4.29Å; I460-W463 HydrophobicContact CD1-CE3 3.59Å; I460-W463 HydrophobicContact CD1-CZ3 4.2Å; I460-W463 PolarHBondContact O-N 2.99Å; I460-T464 WeakPolarHBondContact O-CB 3.44Å; I460-T464 PolarHBondContact O-N 3.38Å; I460-T464 PolarHBondContact O-OG1 3.44Å
461	T	98.7	Very high	96.3	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.5	-39.2	175.4	-58	0	0	0	0	111.2	L446 C449 L450 V457 R458 S459 T464 L465	L446-T461 HydrophobicContact CB-CG2 4.18Å; L446-T461 HydrophobicContact CD2-CG2 4.41Å; L446-T461 WeakPolarHBondContact O-CG2 3.35Å; C449-T461 HydrophobicContact CB-CG2 3.74Å; L450-T461 HydrophobicContact CD2-CG2 3.71Å; L450-T461 HydrophobicContact CG-CG2 3.9Å; V457-T461 VanDerWaalsContact O-CB 3.3Å; V457-T461 WeakPolarHBondContact O-CB 3.5Å; V457-T461 PolarHBondContact O-N 2.75Å; V457-T461 PolarHBondContact O-OG1 2.68Å; R458-T461 WeakPolarHBondContact O-CB 3.34Å; R458-T461 PolarHBondContact O-N 3.24Å; S459-T461 PolarHBondContact O-N 2.83Å; T461-T464 PolarHBondContact O-N 3.04Å; T461-L465 HydrophobicContact CG2-CD1 3.79Å; T461-L465 HydrophobicContact CG2-CG 4.43Å; T461-L465 WeakPolarHBondContact O-CB 3.42Å; T461-L465 WeakPolarHBondContact O-CD1 3.42Å; T461-L465 WeakPolarHBondContact O-CG 3.42Å; T461-L465 PolarHBondContact O-N 3.42Å
462	C	98.4	Very high	96.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-57.1	-53.8	173.5	-65.1	0	0	0	0	110.5	L450 R458 S459 T464 L465 S466 L488 A502 A506	L450-C462 HydrophobicContact CD2-CB 4.5Å; L450-C462 VanDerWaalsContact CD2-SG 3.56Å; R458-C462 PolarHBondContact O-N 2.9Å; R458-C462 PolarHBondContact O-SG 2.98Å; R458-C462 VanDerWaalsContact O-SG 3.33Å; S459-C462 WeakPolarHBondContact O-CB 3.42Å; S459-C462 PolarHBondContact O-N 3.02Å; S459-C462 VanDerWaalsContact O-N 3.14Å; C462-T464 PolarHBondContact O-N 3.08Å; C462-L465 PolarHBondContact O-N 2.97Å; C462-S466 PolarHBondContact O-N 3.36Å; C462-S466 VanDerWaalsContact O-N 3.11Å; C462-L488 HydrophobicContact CB-CD2 4.23Å; C462-A502 HydrophobicContact CB-CB 4.18Å; C462-A502 WeakPolarHBondContact CB-O 3.43Å; C462-A506 HydrophobicContact CB-CB 3.85Å; C462-A506 VanDerWaalsContact O-CB 3.25Å; C462-A506 WeakPolarHBondContact O-CB 3.4Å
463	W	96.2	Very high	96.3	Very high	94 Å²	94	28.3 Å²	28.3	36%	0.356	13%	0.127	S	C	.	.	H	α-helix	trans	-60.3	-44.7	179	178.2	83.9	0	0	0	112.6	L422 S459 I460 L465 S466 R467	L422-W463 HydrophobicContact CD1-CE3 4.44Å; L422-W463 HydrophobicContact CD1-CH2 4.24Å; L422-W463 HydrophobicContact CD1-CZ3 3.82Å; S459-W463 PolarHBondContact O-N 3.26Å; I460-W463 HydrophobicContact CD1-CD2 4.29Å; I460-W463 HydrophobicContact CD1-CE3 3.59Å; I460-W463 HydrophobicContact CD1-CZ3 4.2Å; I460-W463 PolarHBondContact O-N 2.99Å; W463-L465 VanDerWaalsContact C-N 3.3Å; W463-L465 PolarHBondContact O-N 3.18Å; W463-S466 PolarHBondContact O-N 3Å; W463-S466 PolarHBondContact O-OG 3.23Å; W463-R467 HydrophobicContact CD2-CG 4.37Å; W463-R467 HydrophobicContact CH2-CG 4.39Å; W463-R467 HydrophobicContact CZ2-CG 4.14Å; W463-R467 WeakPolarHBondContact O-CG 3.28Å; W463-R467 PolarHBondContact O-N 3.01Å
464	T	98.1	Very high	96.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.7	-36.2	179.4	-59	0	0	0	0	112	I421 L424 L446 I460 T461 C462 Y468	I421-T464 HydrophobicContact CG2-CG2 4.11Å; I421-T464 VanDerWaalsContact CG2-OG1 3.27Å; I421-T464 WeakPolarHBondContact CG2-OG1 3.46Å; I421-T464 PolarHBondContact O-OG1 3.05Å; I421-T464 VanDerWaalsContact O-OG1 3.08Å; L424-T464 HydrophobicContact CB-CG2 4.24Å; L424-T464 HydrophobicContact CD2-CG2 4.33Å; L424-T464 HydrophobicContact CG-CG2 4.13Å; L446-T464 HydrophobicContact CD1-CG2 3.86Å; I460-T464 WeakPolarHBondContact O-CB 3.44Å; I460-T464 PolarHBondContact O-N 3.38Å; I460-T464 PolarHBondContact O-OG1 3.44Å; T461-T464 PolarHBondContact O-N 3.04Å; C462-T464 PolarHBondContact O-N 3.08Å; T464-Y468 HydrophobicContact CG2-CE2 4.47Å; T464-Y468 WeakPolarHBondContact O-CD2 3.34Å
465	L	98.5	Very high	96.3	Very high	1 Å²	1	25 Å²	25	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-68.3	-35.5	176.5	-79.3	163.4	0	0	0	112.3	I443 L446 I447 L450 T461 C462 W463 R467 Y468 A469 L484	I443-L465 HydrophobicContact CD1-CD2 4.09Å; I443-L465 HydrophobicContact CG2-CD2 4.27Å; L446-L465 HydrophobicContact CB-CD1 4.13Å; L446-L465 HydrophobicContact CB-CD2 3.64Å; L446-L465 HydrophobicContact CB-CG 3.87Å; L446-L465 HydrophobicContact CD1-CD2 4.02Å; L446-L465 HydrophobicContact CD1-CG 4.27Å; I447-L465 HydrophobicContact CG1-CD2 4.34Å; L450-L465 HydrophobicContact CD1-CD1 3.71Å; L450-L465 HydrophobicContact CD2-CD1 3.97Å; L450-L465 HydrophobicContact CG-CD1 3.8Å; T461-L465 HydrophobicContact CG2-CD1 3.79Å; T461-L465 HydrophobicContact CG2-CG 4.43Å; T461-L465 WeakPolarHBondContact O-CB 3.42Å; T461-L465 WeakPolarHBondContact O-CD1 3.42Å; T461-L465 WeakPolarHBondContact O-CG 3.42Å; T461-L465 PolarHBondContact O-N 3.42Å; C462-L465 PolarHBondContact O-N 2.97Å; W463-L465 VanDerWaalsContact C-N 3.3Å; W463-L465 PolarHBondContact O-N 3.18Å; L465-R467 VanDerWaalsContact C-N 3.35Å; L465-Y468 CarbonylContact O-C 3.59Å; L465-Y468 PolarHBondContact O-N 3.1Å; L465-A469 PolarHBondContact O-N 2.98Å; L465-L484 HydrophobicContact CB-CD1 4.03Å; L465-L484 HydrophobicContact CD1-CD1 3.63Å; L465-L484 HydrophobicContact CD2-CD1 4.01Å; L465-L484 HydrophobicContact CG-CD1 4.1Å
466	S	95.6	Very high	96.4	Very high	14 Å²	14	28.1 Å²	28.1	10%	0.098	14%	0.143	C	C	.	.	H	α-helix	trans	-67	-35.5	176.8	64.3	0	0	0	0	112.2	C462 W463 Y468 A469	C462-S466 PolarHBondContact O-N 3.36Å; C462-S466 VanDerWaalsContact O-N 3.11Å; W463-S466 PolarHBondContact O-N 3Å; W463-S466 PolarHBondContact O-OG 3.23Å; S466-Y468 PolarHBondContact O-N 3.39Å; S466-A469 WeakPolarHBondContact O-CB 3.22Å; S466-A469 PolarHBondContact O-N 2.86Å
467	R	95.4	Very high	96.3	Very high	79 Å²	79	29.9 Å²	29.9	30%	0.298	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.1	173.8	-61.1	-69.1	-79	165.7	-1.8	114.2	D387 A428 E429 W463 L465	D387-R467 IonicContact OD2-NH2 3.03Å; D387-R467 PolarHBondContact OD2-NH2 3.17Å; A428-R467 HydrophobicContact CB-CB 3.84Å; E429-R467 IonicContact OE2-CZ 3.75Å; E429-R467 IonicContact OE2-NH1 3.65Å; E429-R467 IonicContact OE2-NH2 2.8Å; E429-R467 PolarHBondContact OE2-NH2 2.92Å; W463-R467 HydrophobicContact CD2-CG 4.37Å; W463-R467 HydrophobicContact CH2-CG 4.39Å; W463-R467 HydrophobicContact CZ2-CG 4.14Å; W463-R467 WeakPolarHBondContact O-CG 3.28Å; W463-R467 PolarHBondContact O-N 3.01Å; L465-R467 VanDerWaalsContact C-N 3.35Å
468	Y	97.6	Very high	96.1	Very high	1 Å²	1	35.2 Å²	35.2	0%	0.004	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	15.1	173	-66.1	-82.5	0	0	0	113	L424 A428 M432 M435 L439 I443 T464 L465 S466 H470 W471 V472	L424-Y468 HydrophobicContact CD1-CE2 4.36Å; L424-Y468 HydrophobicContact CG-CE2 4.17Å; L424-Y468 WeakPolarHBondContact O-CE2 3.47Å; L424-Y468 PolarHBondContact O-OH 3.19Å; A428-Y468 WeakPolarHBondContact CA-OH 3.26Å; A428-Y468 HydrophobicContact CB-CD1 4.39Å; A428-Y468 HydrophobicContact CB-CD2 4.25Å; A428-Y468 HydrophobicContact CB-CE1 3.8Å; A428-Y468 HydrophobicContact CB-CE2 3.63Å; M432-Y468 HydrophobicContact CE-CD1 3.49Å; M432-Y468 VanDerWaalsContact CE-CD1 3.49Å; M432-Y468 HydrophobicContact CE-CE1 3.81Å; M432-Y468 HydrophobicContact CE-CG 4.42Å; M432-Y468 HydrophobicContact SD-CD1 3.77Å; M432-Y468 HydrophobicContact SD-CE1 3.96Å; M435-Y468 HydrophobicContact CB-CE1 4.48Å; L439-Y468 HydrophobicContact CD1-CD1 3.8Å; L439-Y468 HydrophobicContact CD1-CE1 4.24Å; L439-Y468 HydrophobicContact CD2-CD1 3.64Å; L439-Y468 HydrophobicContact CD2-CE1 3.63Å; L439-Y468 HydrophobicContact CD2-CG 4.23Å; L439-Y468 HydrophobicContact CG-CD1 4.39Å; I443-Y468 HydrophobicContact CD1-CG 4.3Å; T464-Y468 HydrophobicContact CG2-CE2 4.47Å; T464-Y468 WeakPolarHBondContact O-CD2 3.34Å; L465-Y468 CarbonylContact O-C 3.59Å; L465-Y468 PolarHBondContact O-N 3.1Å; S466-Y468 PolarHBondContact O-N 3.39Å; Y468-H470 VanDerWaalsContact C-N 3.34Å; Y468-H470 PolarHBondContact O-N 3.36Å; Y468-W471 PolarHBondContact O-N 2.83Å; Y468-V472 PolarHBondContact O-N 2.87Å; Y468-V472 VanDerWaalsContact O-N 3.12Å
469	A	95	Very high	96	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-43.8	-176.4	0	0	0	0	0	112.3	L465 S466 W471 V472 V473 L510 E513	L465-A469 PolarHBondContact O-N 2.98Å; S466-A469 WeakPolarHBondContact O-CB 3.22Å; S466-A469 PolarHBondContact O-N 2.86Å; A469-W471 VanDerWaalsContact C-N 3.32Å; A469-W471 PolarHBondContact O-N 2.82Å; A469-V472 WeakPolarHBondContact O-CA 3.41Å; A469-V472 WeakPolarHBondContact O-CB 3.46Å; A469-V472 PolarHBondContact O-N 2.74Å; A469-V473 WeakPolarHBondContact O-CG2 3.38Å; A469-V473 PolarHBondContact O-N 2.72Å; A469-L510 HydrophobicContact CB-CD1 4Å; A469-E513 HydrophobicContact CB-CB 4.27Å; A469-E513 HydrophobicContact CB-CG 3.98Å
470	H	93.3	Very high	96.1	Very high	93 Å²	93	39.7 Å²	39.7	43%	0.431	20%	0.204	S	C	.	.	H	α-helix	trans	-51.9	-49.3	176.1	-174.1	72.1	0	0	0	112.4	Y468 V472 V473 S474 E513	Y468-H470 VanDerWaalsContact C-N 3.34Å; Y468-H470 PolarHBondContact O-N 3.36Å; H470-V472 PolarHBondContact O-N 3.29Å; H470-V473 PolarHBondContact O-N 3.24Å; H470-S474 PolarHBondContact O-N 2.99Å; H470-E513 WeakPolarHBondContact CA-OE2 3.43Å; H470-E513 WeakPolarHBondContact CB-OE2 3.41Å; H470-E513 IonicContact CE1-OE2 2.89Å; H470-E513 IonicContact CG-OE2 3.14Å; H470-E513 IonicContact ND1-OE2 3.77Å; H470-E513 PolarHBondContact ND1-OE2 3.25Å
471	W	97.5	Very high	96.2	Very high	18 Å²	18	39 Å²	39	7%	0.068	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-45	177	-178.5	85	0	0	0	111	L439 P440 I443 Y468 A469 V473 S474 Q475 Y480	L439-W471 HydrophobicContact CB-CD2 3.96Å; L439-W471 HydrophobicContact CB-CE3 4Å; L439-W471 HydrophobicContact CB-CH2 3.78Å; L439-W471 HydrophobicContact CB-CZ2 3.73Å; L439-W471 HydrophobicContact CB-CZ3 3.92Å; L439-W471 HydrophobicContact CD1-CB 4.01Å; L439-W471 HydrophobicContact CD1-CD2 3.54Å; L439-W471 HydrophobicContact CD1-CE3 4.08Å; L439-W471 HydrophobicContact CD1-CG 3.48Å; L439-W471 VanDerWaalsContact CD1-CG 3.48Å; L439-W471 HydrophobicContact CG-CD2 4.4Å; P440-W471 HydrophobicContact CG-CH2 4.25Å; P440-W471 HydrophobicContact CG-CZ2 4.06Å; I443-W471 HydrophobicContact CB-CZ3 4.15Å; I443-W471 HydrophobicContact CG1-CE3 3.97Å; I443-W471 HydrophobicContact CG1-CZ3 3.68Å; Y468-W471 PolarHBondContact O-N 2.83Å; A469-W471 VanDerWaalsContact C-N 3.32Å; A469-W471 PolarHBondContact O-N 2.82Å; W471-V473 VanDerWaalsContact C-N 3.34Å; W471-V473 PolarHBondContact O-N 3.4Å; W471-S474 PolarHBondContact O-N 3.09Å; W471-S474 PolarHBondContact O-OG 3.41Å; W471-Q475 HydrophobicContact CD2-CG 4.19Å; W471-Q475 HydrophobicContact CE3-CG 4.31Å; W471-Q475 HydrophobicContact CH2-CG 4.05Å; W471-Q475 HydrophobicContact CZ2-CG 3.91Å; W471-Q475 HydrophobicContact CZ3-CG 4.23Å; W471-Q475 WeakPolarHBondContact O-CG 3.44Å; W471-Q475 PolarHBondContact O-N 3.12Å; W471-Y480 HydrophobicContact CH2-CD2 4.22Å; W471-Y480 HydrophobicContact CH2-CE1 4.24Å; W471-Y480 AromaticContact CH2-CE2 3.87Å; W471-Y480 HydrophobicContact CH2-CE2 3.87Å; W471-Y480 AromaticContact CH2-CZ 3.89Å; W471-Y480 HydrophobicContact CZ3-CD1 4.33Å; W471-Y480 HydrophobicContact CZ3-CD2 4.23Å; W471-Y480 HydrophobicContact CZ3-CE1 4.43Å; W471-Y480 HydrophobicContact CZ3-CE2 4.33Å; W471-Y480 HydrophobicContact CZ3-CG 4.23Å
472	V	97.9	Very high	96.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-42.8	-179.8	171.3	0	0	0	0	112.2	I443 Y468 A469 H470 Q475 L481 L484	I443-V472 HydrophobicContact CD1-CG2 4.41Å; I443-V472 HydrophobicContact CG1-CG2 4.46Å; I443-V472 HydrophobicContact CG2-CG2 3.97Å; Y468-V472 PolarHBondContact O-N 2.87Å; Y468-V472 VanDerWaalsContact O-N 3.12Å; A469-V472 WeakPolarHBondContact O-CA 3.41Å; A469-V472 WeakPolarHBondContact O-CB 3.46Å; A469-V472 PolarHBondContact O-N 2.74Å; H470-V472 PolarHBondContact O-N 3.29Å; V472-Q475 PolarHBondContact O-N 3.44Å; V472-L481 HydrophobicContact CG1-CB 4.07Å; V472-L481 HydrophobicContact CG1-CD1 4.46Å; V472-L484 HydrophobicContact CB-CD2 4.34Å; V472-L484 HydrophobicContact CG1-CD2 3.83Å; V472-L484 HydrophobicContact CG2-CD2 4.21Å
473	V	95.1	Very high	96.1	Very high	28 Å²	28	45 Å²	45	17%	0.17	23%	0.231	C	C	.	.	H	α-helix	trans	-68.6	-34.8	179.1	173.9	0	0	0	0	111.6	A469 H470 W471 Q475 L481 L510 E513 A514	A469-V473 WeakPolarHBondContact O-CG2 3.38Å; A469-V473 PolarHBondContact O-N 2.72Å; H470-V473 PolarHBondContact O-N 3.24Å; W471-V473 VanDerWaalsContact C-N 3.34Å; W471-V473 PolarHBondContact O-N 3.4Å; V473-Q475 PolarHBondContact O-N 3.15Å; V473-L481 HydrophobicContact CG2-CD1 4.14Å; V473-L510 HydrophobicContact CG2-CD1 4.03Å; V473-E513 HydrophobicContact CG2-CB 4.05Å; V473-A514 HydrophobicContact CG1-CB 4.45Å; V473-A514 HydrophobicContact CG2-CB 3.84Å
474	S	93.8	Very high	96.2	Very high	72 Å²	72	40.6 Å²	40.6	50%	0.503	21%	0.214	S	C	.	.	H	α-helix	trans	-67.3	-13.9	177.6	77.3	0	0	0	0	114.5	H470 W471	H470-S474 PolarHBondContact O-N 2.99Å; W471-S474 PolarHBondContact O-N 3.09Å; W471-S474 PolarHBondContact O-OG 3.41Å
475	Q	96.7	Very high	96.2	Very high	62 Å²	62	40.7 Å²	40.7	29%	0.29	22%	0.215	S	C	.	.	S	Bend	trans	-93.1	166.2	-179.1	-62	-45.1	-64.7	0	0	112.5	W471 V472 V473 P477 Y480	W471-Q475 HydrophobicContact CD2-CG 4.19Å; W471-Q475 HydrophobicContact CE3-CG 4.31Å; W471-Q475 HydrophobicContact CH2-CG 4.05Å; W471-Q475 HydrophobicContact CZ2-CG 3.91Å; W471-Q475 HydrophobicContact CZ3-CG 4.23Å; W471-Q475 WeakPolarHBondContact O-CG 3.44Å; W471-Q475 PolarHBondContact O-N 3.12Å; V472-Q475 PolarHBondContact O-N 3.44Å; V473-Q475 PolarHBondContact O-N 3.15Å; Q475-P477 WeakPolarHBondContact O-CD 3.38Å; Q475-Y480 HydrophobicContact CB-CD2 3.65Å; Q475-Y480 HydrophobicContact CB-CE2 4.14Å; Q475-Y480 HydrophobicContact CG-CD2 3.93Å; Q475-Y480 HydrophobicContact CG-CE2 4.13Å
476	P	95.3	Very high	96.2	Very high	72 Å²	72	42.5 Å²	42.5	47%	0.468	23%	0.226	S	C	.	.			trans	-54.1	123.5	174.5	-27.4	36.1	0	0	0	112.3	D478 I479	P476-D478 VanDerWaalsContact C-N 3.3Å; P476-D478 PolarHBondContact O-N 3.33Å; P476-D478 VanDerWaalsContact O-N 3.11Å; P476-I479 HydrophobicContact CB-CD1 3.89Å; P476-I479 HydrophobicContact CB-CG1 4.16Å; P476-I479 HydrophobicContact CG-CD1 4.08Å; P476-I479 PolarHBondContact O-N 3.37Å
477	P	91.8	Very high	96.4	Very high	45 Å²	45	43.7 Å²	43.7	29%	0.292	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-36.1	-166.8	-31.4	34.9	0	0	0	115.5	Q475 I479 L481 K482	Q475-P477 WeakPolarHBondContact O-CD 3.38Å; P477-I479 PolarHBondContact O-N 2.88Å; P477-L481 HydrophobicContact CB-CD2 4.38Å; P477-L481 PolarHBondContact O-N 3.04Å; P477-K482 WeakPolarHBondContact O-CB 3.43Å; P477-K482 PolarHBondContact O-N 3.22Å
478	D	94.3	Very high	96.5	Very high	113 Å²	113	40 Å²	40	60%	0.604	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.1	-177.6	-76.3	-52.7	0	0	0	114	P476 K482	P476-D478 VanDerWaalsContact C-N 3.3Å; P476-D478 PolarHBondContact O-N 3.33Å; P476-D478 VanDerWaalsContact O-N 3.11Å; D478-K482 WeakPolarHBondContact OD1-CD 3.5Å; D478-K482 IonicContact OD1-NZ 3.01Å; D478-K482 PolarHBondContact OD1-NZ 2.93Å
479	I	95.6	Very high	96.6	Very high	94 Å²	94	40 Å²	40	48%	0.482	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-46.3	-175.3	-54.6	179.7	0	0	0	111.4	P476 P477	P476-I479 HydrophobicContact CB-CD1 3.89Å; P476-I479 HydrophobicContact CB-CG1 4.16Å; P476-I479 HydrophobicContact CG-CD1 4.08Å; P476-I479 PolarHBondContact O-N 3.37Å; P477-I479 PolarHBondContact O-N 2.88Å
480	Y	97.2	Very high	96.7	Very high	30 Å²	30	44.5 Å²	44.5	12%	0.118	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-54.2	-171.6	-55.2	-73.6	0	0	0	112.9	I443 P444 W471 Q475 K482 P483 L484	I443-Y480 HydrophobicContact CB-CD1 4.49Å; I443-Y480 HydrophobicContact CG2-CD1 4.09Å; P444-Y480 HydrophobicContact CG-CD1 4.18Å; P444-Y480 HydrophobicContact CG-CE1 3.74Å; W471-Y480 HydrophobicContact CH2-CD2 4.22Å; W471-Y480 HydrophobicContact CH2-CE1 4.24Å; W471-Y480 AromaticContact CH2-CE2 3.87Å; W471-Y480 HydrophobicContact CH2-CE2 3.87Å; W471-Y480 AromaticContact CH2-CZ 3.89Å; W471-Y480 HydrophobicContact CZ3-CD1 4.33Å; W471-Y480 HydrophobicContact CZ3-CD2 4.23Å; W471-Y480 HydrophobicContact CZ3-CE1 4.43Å; W471-Y480 HydrophobicContact CZ3-CE2 4.33Å; W471-Y480 HydrophobicContact CZ3-CG 4.23Å; Q475-Y480 HydrophobicContact CB-CD2 3.65Å; Q475-Y480 HydrophobicContact CB-CE2 4.14Å; Q475-Y480 HydrophobicContact CG-CD2 3.93Å; Q475-Y480 HydrophobicContact CG-CE2 4.13Å; Y480-K482 PolarHBondContact O-N 2.91Å; Y480-P483 WeakPolarHBondContact O-CD 3.49Å; Y480-L484 WeakPolarHBondContact O-CB 3.48Å; Y480-L484 PolarHBondContact O-N 3.5Å
481	L	97.6	Very high	97	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-56.6	-52	-176.1	176.5	59.3	0	0	0	112.4	V472 V473 P477 L484 M485 L510 E517	V472-L481 HydrophobicContact CG1-CB 4.07Å; V472-L481 HydrophobicContact CG1-CD1 4.46Å; V473-L481 HydrophobicContact CG2-CD1 4.14Å; P477-L481 HydrophobicContact CB-CD2 4.38Å; P477-L481 PolarHBondContact O-N 3.04Å; L481-L484 PolarHBondContact O-N 3.17Å; L481-M485 VanDerWaalsContact O-CB 3.24Å; L481-M485 WeakPolarHBondContact O-CB 3.42Å; L481-M485 PolarHBondContact O-N 3.17Å; L481-L510 HydrophobicContact CD1-CD1 3.79Å; L481-L510 HydrophobicContact CD1-CD2 4.22Å; L481-L510 HydrophobicContact CD1-CG 4.26Å; L481-E517 HydrophobicContact CD2-CB 4.36Å
482	K	97.8	Very high	97	Very high	83 Å²	83	41.3 Å²	41.3	36%	0.361	22%	0.22	S	C	.	.	H	α-helix	trans	-65.5	-46.9	-177	175.9	-176	-176	178.4	0	112.9	P477 D478 Y480 T486 Y521	P477-K482 WeakPolarHBondContact O-CB 3.43Å; P477-K482 PolarHBondContact O-N 3.22Å; D478-K482 WeakPolarHBondContact OD1-CD 3.5Å; D478-K482 IonicContact OD1-NZ 3.01Å; D478-K482 PolarHBondContact OD1-NZ 2.93Å; Y480-K482 PolarHBondContact O-N 2.91Å; K482-T486 VanDerWaalsContact O-CB 3.32Å; K482-T486 WeakPolarHBondContact O-CB 3.43Å; K482-T486 PolarHBondContact O-N 3.01Å; K482-T486 PolarHBondContact O-OG1 3.28Å; K482-Y521 HydrophobicContact CD-CE1 4.15Å; K482-Y521 HydrophobicContact CG-CE1 4.23Å
483	P	98.3	Very high	97	Very high	44 Å²	44	43.4 Å²	43.4	29%	0.286	23%	0.23	S	C	.	.	H	α-helix	trans	-58.6	-43.8	171.1	-27.8	36	0	0	0	113.6	I447 Y480 T486 E487	I447-P483 HydrophobicContact CD1-CB 4.35Å; Y480-P483 WeakPolarHBondContact O-CD 3.49Å; P483-T486 PolarHBondContact O-N 3.1Å; P483-E487 PolarHBondContact O-N 3.26Å
484	L	98.4	Very high	97.2	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-56.9	178.3	174.3	59.8	0	0	0	111.3	I447 L450 L465 V472 Y480 L481 T486 E487 L488 L510	I447-L484 HydrophobicContact CD1-CB 4.02Å; I447-L484 HydrophobicContact CG1-CB 4.35Å; I447-L484 HydrophobicContact CG1-CD1 4.13Å; L450-L484 HydrophobicContact CD1-CD1 4.38Å; L465-L484 HydrophobicContact CB-CD1 4.03Å; L465-L484 HydrophobicContact CD1-CD1 3.63Å; L465-L484 HydrophobicContact CD2-CD1 4.01Å; L465-L484 HydrophobicContact CG-CD1 4.1Å; V472-L484 HydrophobicContact CB-CD2 4.34Å; V472-L484 HydrophobicContact CG1-CD2 3.83Å; V472-L484 HydrophobicContact CG2-CD2 4.21Å; Y480-L484 WeakPolarHBondContact O-CB 3.48Å; Y480-L484 PolarHBondContact O-N 3.5Å; L481-L484 PolarHBondContact O-N 3.17Å; L484-T486 PolarHBondContact O-N 3.16Å; L484-E487 PolarHBondContact O-N 3.3Å; L484-E487 VanDerWaalsContact O-N 3.16Å; L484-L488 HydrophobicContact CD1-CD1 3.76Å; L484-L488 HydrophobicContact CD1-CG 3.91Å; L484-L488 HydrophobicContact CG-CD1 3.92Å; L484-L488 HydrophobicContact CG-CG 4.43Å; L484-L488 WeakPolarHBondContact O-CB 3.4Å; L484-L488 PolarHBondContact O-N 3.12Å; L484-L510 HydrophobicContact CD2-CD1 4.27Å; L484-L510 HydrophobicContact CD2-CD2 4.22Å; L484-L510 HydrophobicContact CG-CD2 4.28Å
485	M	98.3	Very high	97.3	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-52.2	-44.8	176.2	175.5	-164.3	73.2	0	0	110.8	L481 E487 L488 L489 F507 L510 L518 Y521 F524 I525	L481-M485 VanDerWaalsContact O-CB 3.24Å; L481-M485 WeakPolarHBondContact O-CB 3.42Å; L481-M485 PolarHBondContact O-N 3.17Å; M485-E487 PolarHBondContact O-N 3.23Å; M485-L488 PolarHBondContact O-N 3.38Å; M485-L489 HydrophobicContact CG-CD1 3.98Å; M485-L489 HydrophobicContact CG-CG 4.45Å; M485-L489 WeakPolarHBondContact O-CB 3.21Å; M485-L489 WeakPolarHBondContact O-CG 3.32Å; M485-L489 PolarHBondContact O-N 3Å; M485-F507 HydrophobicContact CG-CE2 3.9Å; M485-F507 HydrophobicContact CG-CZ 4.4Å; M485-L510 HydrophobicContact CB-CD2 4.39Å; M485-L518 HydrophobicContact SD-CD2 4.28Å; M485-Y521 HydrophobicContact CE-CD1 3.74Å; M485-Y521 HydrophobicContact CE-CD2 3.98Å; M485-Y521 HydrophobicContact CE-CE1 4.35Å; M485-Y521 HydrophobicContact CE-CG 3.52Å; M485-Y521 HydrophobicContact SD-CD2 3.79Å; M485-Y521 HydrophobicContact SD-CG 3.74Å; M485-F524 HydrophobicContact CE-CD1 4.47Å; M485-I525 HydrophobicContact SD-CD1 4.09Å; M485-I525 HydrophobicContact SD-CG1 4.27Å
486	T	98.5	Very high	97.1	Very high	39 Å²	39	38.1 Å²	38.1	24%	0.239	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-44.9	-179.4	-58.9	0	0	0	0	112.5	K482 P483 L484 K490	K482-T486 VanDerWaalsContact O-CB 3.32Å; K482-T486 WeakPolarHBondContact O-CB 3.43Å; K482-T486 PolarHBondContact O-N 3.01Å; K482-T486 PolarHBondContact O-OG1 3.28Å; P483-T486 PolarHBondContact O-N 3.1Å; L484-T486 PolarHBondContact O-N 3.16Å; T486-K490 WeakPolarHBondContact O-CG 3.48Å; T486-K490 PolarHBondContact O-N 3.21Å
487	E	98.6	Very high	97	Very high	38 Å²	38	36 Å²	36	18%	0.178	18%	0.184	C	C	.	.	H	α-helix	trans	-75.5	-35.8	179.6	-64.9	-53.3	134.9	0	0	112.2	I447 L450 P483 L484 M485 K490 R491	I447-E487 HydrophobicContact CG2-CB 4.32Å; I447-E487 HydrophobicContact CG2-CG 3.85Å; L450-E487 HydrophobicContact CB-CB 4.47Å; L450-E487 HydrophobicContact CD1-CB 3.7Å; P483-E487 PolarHBondContact O-N 3.26Å; L484-E487 PolarHBondContact O-N 3.3Å; L484-E487 VanDerWaalsContact O-N 3.16Å; M485-E487 PolarHBondContact O-N 3.23Å; E487-K490 VanDerWaalsContact CD-NZ 3.3Å; E487-K490 WeakPolarHBondContact O-CB 3.49Å; E487-K490 PolarHBondContact O-N 2.91Å; E487-K490 IonicContact OE1-NZ 2.74Å; E487-K490 PolarHBondContact OE1-NZ 3.48Å; E487-K490 WeakPolarHBondContact OE2-CD 3.45Å; E487-K490 IonicContact OE2-NZ 3.18Å; E487-K490 PolarHBondContact OE2-NZ 3.16Å; E487-R491 WeakPolarHBondContact O-CG 3.46Å; E487-R491 PolarHBondContact O-N 3.06Å; E487-R491 VanDerWaalsContact O-N 3.12Å
488	L	98.3	Very high	96.9	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-45.2	173.3	-81	178	0	0	0	111.9	L450 C462 L484 M485 K490 R491 I492 A506 F507 L510	L450-L488 HydrophobicContact CD1-CD2 4.21Å; L450-L488 HydrophobicContact CD1-CG 4.28Å; L450-L488 HydrophobicContact CD2-CD2 4.2Å; C462-L488 HydrophobicContact CB-CD2 4.23Å; L484-L488 HydrophobicContact CD1-CD1 3.76Å; L484-L488 HydrophobicContact CD1-CG 3.91Å; L484-L488 HydrophobicContact CG-CD1 3.92Å; L484-L488 HydrophobicContact CG-CG 4.43Å; L484-L488 WeakPolarHBondContact O-CB 3.4Å; L484-L488 PolarHBondContact O-N 3.12Å; M485-L488 PolarHBondContact O-N 3.38Å; L488-K490 PolarHBondContact O-N 3.5Å; L488-R491 CarbonylContact O-C 3.58Å; L488-R491 WeakPolarHBondContact O-CA 3.16Å; L488-R491 WeakPolarHBondContact O-CB 3.48Å; L488-R491 PolarHBondContact O-N 3.1Å; L488-I492 PolarHBondContact O-N 3.07Å; L488-A506 HydrophobicContact CD2-CB 4.38Å; L488-F507 HydrophobicContact CB-CD2 4.28Å; L488-F507 HydrophobicContact CD1-CD2 4.41Å; L488-L510 HydrophobicContact CD1-CD2 4.05Å
489	L	98.6	Very high	97	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-59	-33.5	175.5	-71.3	173.2	0	0	0	112.1	M485 R491 I492 F507 F524 I525 T528	M485-L489 HydrophobicContact CG-CD1 3.98Å; M485-L489 HydrophobicContact CG-CG 4.45Å; M485-L489 WeakPolarHBondContact O-CB 3.21Å; M485-L489 WeakPolarHBondContact O-CG 3.32Å; M485-L489 PolarHBondContact O-N 3Å; L489-R491 VanDerWaalsContact C-N 3.3Å; L489-R491 PolarHBondContact O-N 3.19Å; L489-I492 HydrophobicContact CD2-CD1 3.97Å; L489-F507 HydrophobicContact CD2-CD1 4.37Å; L489-F507 HydrophobicContact CD2-CD2 4.48Å; L489-F507 HydrophobicContact CD2-CE1 3.84Å; L489-F507 HydrophobicContact CD2-CE2 4.01Å; L489-F507 HydrophobicContact CD2-CZ 3.67Å; L489-F507 HydrophobicContact CG-CE2 4.21Å; L489-F507 HydrophobicContact CG-CZ 4.26Å; L489-F524 HydrophobicContact CD1-CD1 3.54Å; L489-F524 HydrophobicContact CD1-CE1 3.37Å; L489-F524 HydrophobicContact CD1-CG 4.43Å; L489-F524 HydrophobicContact CD1-CZ 4.13Å; L489-I525 HydrophobicContact CD1-CG1 4.08Å; L489-I525 HydrophobicContact CD2-CG2 4.41Å; L489-T528 HydrophobicContact CB-CG2 4.01Å; L489-T528 HydrophobicContact CD2-CG2 3.99Å; L489-T528 VanDerWaalsContact O-CG2 3.3Å; L489-T528 WeakPolarHBondContact O-CG2 3.39Å
490	K	98.6	Very high	97.1	Very high	94 Å²	94	26.4 Å²	26.4	41%	0.409	13%	0.127	S	C	.	.	H	α-helix	trans	-70.7	-24.7	171.4	-66.4	173.2	-171.4	168	0	113.3	T486 E487 L488	T486-K490 WeakPolarHBondContact O-CG 3.48Å; T486-K490 PolarHBondContact O-N 3.21Å; E487-K490 VanDerWaalsContact CD-NZ 3.3Å; E487-K490 WeakPolarHBondContact O-CB 3.49Å; E487-K490 PolarHBondContact O-N 2.91Å; E487-K490 IonicContact OE1-NZ 2.74Å; E487-K490 PolarHBondContact OE1-NZ 3.48Å; E487-K490 WeakPolarHBondContact OE2-CD 3.45Å; E487-K490 IonicContact OE2-NZ 3.18Å; E487-K490 PolarHBondContact OE2-NZ 3.16Å; L488-K490 PolarHBondContact O-N 3.5Å
491	R	98.4	Very high	96.9	Very high	45 Å²	45	27 Å²	27	17%	0.17	13%	0.131	C	C	.	.	H	α-helix	trans	-84	-29.5	175.9	-65.7	-50.2	87.7	-173.8	-23.9	112.8	L450 R458 E487 L488 L489 L493 D494 V499 A503	L450-R491 HydrophobicContact CB-CG 4.17Å; L450-R491 HydrophobicContact CD2-CG 4.21Å; L450-R491 VanDerWaalsContact O-CD 3.23Å; L450-R491 WeakPolarHBondContact O-CD 3.21Å; R458-R491 VanDerWaalsContact CD-NH1 3.34Å; E487-R491 WeakPolarHBondContact O-CG 3.46Å; E487-R491 PolarHBondContact O-N 3.06Å; E487-R491 VanDerWaalsContact O-N 3.12Å; L488-R491 CarbonylContact O-C 3.58Å; L488-R491 WeakPolarHBondContact O-CA 3.16Å; L488-R491 WeakPolarHBondContact O-CB 3.48Å; L488-R491 PolarHBondContact O-N 3.1Å; L489-R491 VanDerWaalsContact C-N 3.3Å; L489-R491 PolarHBondContact O-N 3.19Å; R491-L493 PolarHBondContact O-N 3.37Å; R491-L493 VanDerWaalsContact O-N 3.15Å; R491-D494 IonicContact CZ-OD2 3.05Å; R491-D494 IonicContact NE-OD2 2.85Å; R491-D494 IonicContact NH1-OD2 3.76Å; R491-D494 PolarHBondContact NH1-OD2 3.16Å; R491-D494 IonicContact NH2-OD2 2.7Å; R491-D494 WeakPolarHBondContact O-CB 3.33Å; R491-D494 PolarHBondContact O-N 3.02Å; R491-V499 HydrophobicContact CB-CG1 4.27Å; R491-A503 HydrophobicContact CB-CB 3.44Å; R491-A503 VanDerWaalsContact CB-CB 3.44Å
492	I	98.4	Very high	96.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-52.9	-36.2	165.3	-68.2	-175.8	0	0	0	109.4	L488 L489 A503 F507 T528 L529 A532 Y536	L488-I492 PolarHBondContact O-N 3.07Å; L489-I492 HydrophobicContact CD2-CD1 3.97Å; I492-A503 HydrophobicContact CG1-CB 4.18Å; I492-F507 HydrophobicContact CD1-CB 3.92Å; I492-F507 HydrophobicContact CD1-CD1 3.8Å; I492-F507 HydrophobicContact CD1-CG 3.88Å; I492-T528 HydrophobicContact CB-CG2 4.41Å; I492-T528 HydrophobicContact CG2-CG2 4.27Å; I492-L529 HydrophobicContact CD1-CD2 3.91Å; I492-L529 HydrophobicContact CG2-CD2 4.4Å; I492-A532 HydrophobicContact CG2-CB 4.27Å; I492-Y536 WeakPolarHBondContact CG2-OH 3.24Å; I492-Y536 WeakPolarHBondContact O-CE1 3.29Å; I492-Y536 VanDerWaalsContact O-CZ 3.31Å; I492-Y536 PolarHBondContact O-OH 3.4Å
493	L	98.2	Very high	96.6	Very high	43 Å²	43	23.8 Å²	23.8	23%	0.225	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	24	176.3	-53.6	-175.4	0	0	0	114.3	R491 T528 F531 A532 K535	R491-L493 PolarHBondContact O-N 3.37Å; R491-L493 VanDerWaalsContact O-N 3.15Å; L493-T528 HydrophobicContact CD1-CG2 3.9Å; L493-T528 HydrophobicContact CD2-CG2 4.26Å; L493-T528 HydrophobicContact CG-CG2 3.82Å; L493-F531 HydrophobicContact CD1-CD1 3.71Å; L493-F531 HydrophobicContact CD1-CE1 4.31Å; L493-F531 HydrophobicContact CD1-CG 4.44Å; L493-F531 HydrophobicContact CD2-CD1 3.77Å; L493-F531 HydrophobicContact CG-CD1 4.35Å; L493-A532 HydrophobicContact CD2-CB 3.96Å; L493-K535 HydrophobicContact CD2-CD 4.47Å; L493-K535 WeakPolarHBondContact O-CE 3.34Å; L493-K535 PolarHBondContact O-NZ 3.48Å
494	D	98	Very high	96.4	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.027	11%	0.107	C	C	.	.			trans	-62	161	177.2	-157.5	-85.1	0	0	0	111.8	R458 R491 N496 V499 Q500 K535	R458-D494 IonicContact CZ-OD1 3.31Å; R458-D494 IonicContact CZ-OD2 3.54Å; R458-D494 IonicContact NE-OD1 3.41Å; R458-D494 IonicContact NE-OD2 3.79Å; R458-D494 PolarHBondContact NE-OD2 3.07Å; R458-D494 IonicContact NH2-OD1 2.79Å; R458-D494 PolarHBondContact NH2-OD1 3.11Å; R458-D494 IonicContact NH2-OD2 3.06Å; R458-D494 PolarHBondContact NH2-OD2 3.2Å; R491-D494 IonicContact CZ-OD2 3.05Å; R491-D494 IonicContact NE-OD2 2.85Å; R491-D494 IonicContact NH1-OD2 3.76Å; R491-D494 PolarHBondContact NH1-OD2 3.16Å; R491-D494 IonicContact NH2-OD2 2.7Å; R491-D494 WeakPolarHBondContact O-CB 3.33Å; R491-D494 PolarHBondContact O-N 3.02Å; D494-N496 PolarHBondContact OD1-N 3.2Å; D494-V499 HydrophobicContact CB-CB 3.8Å; D494-V499 HydrophobicContact CB-CG1 3.55Å; D494-V499 VanDerWaalsContact CG-CG1 3.45Å; D494-Q500 HydrophobicContact CB-CG 4.44Å; D494-Q500 WeakPolarHBondContact O-CG 3.32Å; D494-Q500 PolarHBondContact O-NE2 2.99Å; D494-K535 WeakPolarHBondContact O-CE 3.45Å; D494-K535 PolarHBondContact O-NZ 2.9Å
495	S	95.6	Very high	96.2	Very high	34 Å²	34	24.2 Å²	24.2	24%	0.238	12%	0.124	C	C	.	.	S	Bend	trans	-84.6	-13.9	177.9	52.2	0	0	0	0	113.8	E323 E324 D325 E326	E323-S495 PolarHBondContact O-OG 3.14Å; E324-S495 WeakPolarHBondContact CA-O 3.38Å; D325-S495 PolarHBondContact N-O 3.37Å; E326-S495 WeakPolarHBondContact CB-O 3.32Å; E326-S495 PolarHBondContact N-O 2.89Å; E326-S495 VanDerWaalsContact OE2-CA 3.27Å; E326-S495 WeakPolarHBondContact OE2-CA 3.09Å
496	N	94.3	Very high	96	Very high	13 Å²	13	24.2 Å²	24.2	7%	0.07	13%	0.125	C	C	.	.	S	Bend	trans	-99.3	128.7	174.4	-179.4	-80.1	0	0	0	110.7	I322 D325 A455 D494 R498 V499 Q500	I322-N496 PolarHBondContact O-ND2 3.03Å; D325-N496 VanDerWaalsContact OD1-CA 3.25Å; D325-N496 WeakPolarHBondContact OD1-CA 3.38Å; A455-N496 HydrophobicContact CB-CB 3.99Å; D494-N496 PolarHBondContact OD1-N 3.2Å; N496-R498 PolarHBondContact O-N 2.81Å; N496-R498 WeakPolarHBondContact OD1-CA 3.41Å; N496-R498 WeakPolarHBondContact OD1-CB 3.18Å; N496-R498 PolarHBondContact OD1-N 2.79Å; N496-V499 HydrophobicContact CB-CB 4.29Å; N496-V499 HydrophobicContact CB-CG2 3.95Å; N496-V499 PolarHBondContact O-N 3.33Å; N496-V499 VanDerWaalsContact O-N 3.16Å; N496-V499 PolarHBondContact OD1-N 3.03Å; N496-V499 VanDerWaalsContact OD1-N 3.14Å; N496-Q500 WeakPolarHBondContact O-CG 3.48Å; N496-Q500 PolarHBondContact O-N 3.11Å
497	K	92.1	Very high	95.9	Very high	26 Å²	26	22.4 Å²	22.4	11%	0.113	11%	0.114	C	C	.	.	H	α-helix	trans	-64.2	-35.9	-176.7	-68.5	-172.2	-63	177.1	0	113.5	D325 I328 D330 V499 Q500 E501 Q537 N540	D325-K497 PolarHBondContact OD1-N 3.01Å; D325-K497 WeakPolarHBondContact OD2-CE 3.48Å; I328-K497 PolarHBondContact O-NZ 2.91Å; D330-K497 IonicContact OD1-NZ 2.66Å; D330-K497 PolarHBondContact OD1-NZ 3Å; K497-V499 VanDerWaalsContact C-N 3.31Å; K497-V499 PolarHBondContact O-N 3.28Å; K497-Q500 WeakPolarHBondContact O-CB 3.43Å; K497-Q500 PolarHBondContact O-N 2.91Å; K497-E501 PolarHBondContact O-N 3.43Å; K497-Q537 HydrophobicContact CD-CB 4.34Å; K497-Q537 HydrophobicContact CD-CG 4.12Å; K497-N540 PolarHBondContact O-ND2 3.14Å
498	R	90.6	Very high	95.6	Very high	51 Å²	51	21.2 Å²	21.2	19%	0.192	11%	0.11	C	C	.	.	H	α-helix	trans	-66.7	-34.2	174.7	171.7	174.3	-93.1	120.3	6.3	111.8	L318 D371 N496 A502	L318-R498 VanDerWaalsContact CD2-NH2 3.33Å; D371-R498 IonicContact OD2-NH2 2.91Å; D371-R498 PolarHBondContact OD2-NH2 2.6Å; N496-R498 PolarHBondContact O-N 2.81Å; N496-R498 WeakPolarHBondContact OD1-CA 3.41Å; N496-R498 WeakPolarHBondContact OD1-CB 3.18Å; N496-R498 PolarHBondContact OD1-N 2.79Å; R498-A502 WeakPolarHBondContact O-CB 3.41Å; R498-A502 PolarHBondContact O-N 3.32Å
499	V	95.8	Very high	95.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-71.1	-38	174.5	-177.7	0	0	0	0	111.2	A455 R458 R491 D494 N496 K497 A503	A455-V499 HydrophobicContact CB-CG2 3.83Å; A455-V499 VanDerWaalsContact O-CG2 3.29Å; A455-V499 WeakPolarHBondContact O-CG2 3.21Å; R458-V499 HydrophobicContact CB-CG1 3.94Å; R458-V499 HydrophobicContact CB-CG2 4.03Å; R491-V499 HydrophobicContact CB-CG1 4.27Å; D494-V499 HydrophobicContact CB-CB 3.8Å; D494-V499 HydrophobicContact CB-CG1 3.55Å; D494-V499 VanDerWaalsContact CG-CG1 3.45Å; N496-V499 HydrophobicContact CB-CB 4.29Å; N496-V499 HydrophobicContact CB-CG2 3.95Å; N496-V499 PolarHBondContact O-N 3.33Å; N496-V499 VanDerWaalsContact O-N 3.16Å; N496-V499 PolarHBondContact OD1-N 3.03Å; N496-V499 VanDerWaalsContact OD1-N 3.14Å; K497-V499 VanDerWaalsContact C-N 3.31Å; K497-V499 PolarHBondContact O-N 3.28Å; V499-A503 WeakPolarHBondContact O-CB 3.25Å; V499-A503 PolarHBondContact O-N 2.91Å
500	Q	96.7	Very high	95.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.1	-50.5	174.1	-67.5	170.1	2.1	0	0	111.2	D494 N496 K497 A503 C504 Y536 N540	D494-Q500 HydrophobicContact CB-CG 4.44Å; D494-Q500 WeakPolarHBondContact O-CG 3.32Å; D494-Q500 PolarHBondContact O-NE2 2.99Å; N496-Q500 WeakPolarHBondContact O-CG 3.48Å; N496-Q500 PolarHBondContact O-N 3.11Å; K497-Q500 WeakPolarHBondContact O-CB 3.43Å; K497-Q500 PolarHBondContact O-N 2.91Å; Q500-A503 PolarHBondContact O-N 2.85Å; Q500-C504 VanDerWaalsContact O-CB 3.3Å; Q500-C504 WeakPolarHBondContact O-CB 3.45Å; Q500-C504 PolarHBondContact O-N 3.16Å; Q500-Y536 HydrophobicContact CB-CE1 3.87Å; Q500-Y536 HydrophobicContact CG-CE1 3.79Å; Q500-N540 WeakPolarHBondContact CB-ND2 3.44Å; Q500-N540 PolarHBondContact OE1-ND2 2.88Å
501	E	93.1	Very high	94.9	Very high	43 Å²	43	18.9 Å²	18.9	20%	0.201	10%	0.104	C	C	.	.	H	α-helix	trans	-54.2	-60.2	175.1	164.1	167.4	-152.9	0	0	111	K497 A503 C504 S505 K539 I543	K497-E501 PolarHBondContact O-N 3.43Å; E501-A503 VanDerWaalsContact C-N 3.26Å; E501-A503 PolarHBondContact O-N 3.47Å; E501-C504 PolarHBondContact O-N 3.26Å; E501-C504 VanDerWaalsContact O-N 3.11Å; E501-S505 PolarHBondContact O-N 2.85Å; E501-S505 PolarHBondContact O-OG 3.28Å; E501-K539 WeakPolarHBondContact OE1-CE 3.42Å; E501-K539 IonicContact OE1-NZ 3.72Å; E501-K539 PolarHBondContact OE1-NZ 3.44Å; E501-K539 IonicContact OE2-NZ 2.65Å; E501-K539 PolarHBondContact OE2-NZ 2.84Å; E501-I543 HydrophobicContact CB-CD1 3.86Å; E501-I543 HydrophobicContact CG-CD1 3.51Å
502	A	92.7	Very high	94.4	Very high	17 Å²	17	21.2 Å²	21.2	14%	0.14	12%	0.117	C	C	.	.	H	α-helix	trans	-59.9	-34.7	-179	0	0	0	0	0	113.4	S459 C462 R498 A506	S459-A502 WeakPolarHBondContact OG-CB 3.48Å; C462-A502 HydrophobicContact CB-CB 4.18Å; C462-A502 WeakPolarHBondContact CB-O 3.43Å; R498-A502 WeakPolarHBondContact O-CB 3.41Å; R498-A502 PolarHBondContact O-N 3.32Å; A502-A506 WeakPolarHBondContact O-CB 3.27Å; A502-A506 PolarHBondContact O-N 3.04Å; A502-A506 VanDerWaalsContact O-N 3.07Å
503	A	97.3	Very high	94	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-73.5	-37	177.6	0	0	0	0	0	113	R491 I492 V499 Q500 E501 F507	R491-A503 HydrophobicContact CB-CB 3.44Å; R491-A503 VanDerWaalsContact CB-CB 3.44Å; I492-A503 HydrophobicContact CG1-CB 4.18Å; V499-A503 WeakPolarHBondContact O-CB 3.25Å; V499-A503 PolarHBondContact O-N 2.91Å; Q500-A503 PolarHBondContact O-N 2.85Å; E501-A503 VanDerWaalsContact C-N 3.26Å; E501-A503 PolarHBondContact O-N 3.47Å; A503-F507 WeakPolarHBondContact O-CB 3.42Å; A503-F507 PolarHBondContact O-N 3.15Å
504	C	95.2	Very high	93.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69.2	-46.4	178.1	-157.8	0	0	0	0	110.4	Q500 E501 F507 A508 I543 A547	Q500-C504 VanDerWaalsContact O-CB 3.3Å; Q500-C504 WeakPolarHBondContact O-CB 3.45Å; Q500-C504 PolarHBondContact O-N 3.16Å; E501-C504 PolarHBondContact O-N 3.26Å; E501-C504 VanDerWaalsContact O-N 3.11Å; C504-F507 PolarHBondContact O-N 2.9Å; C504-F507 VanDerWaalsContact O-N 3.16Å; C504-A508 PolarHBondContact O-N 2.85Å; C504-I543 HydrophobicContact CB-CG2 3.82Å; C504-A547 VanDerWaalsContact SG-CB 3.59Å
505	S	92.6	Very high	93.5	Very high	54 Å²	54	24.3 Å²	24.3	38%	0.378	14%	0.136	S	C	.	.	H	α-helix	trans	-62.4	-46.4	175.6	-51.2	0	0	0	0	111.9	E501 F507 A508 T509	E501-S505 PolarHBondContact O-N 2.85Å; E501-S505 PolarHBondContact O-OG 3.28Å; S505-F507 PolarHBondContact O-N 3.22Å; S505-A508 PolarHBondContact O-N 2.81Å; S505-T509 PolarHBondContact O-N 2.88Å; S505-T509 VanDerWaalsContact O-N 3.16Å; S505-T509 PolarHBondContact O-OG1 2.93Å
506	A	94.1	Very high	93.3	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-62.6	-28.7	175.8	0	0	0	0	0	113.3	C462 L488 A502 L510	C462-A506 HydrophobicContact CB-CB 3.85Å; C462-A506 VanDerWaalsContact O-CB 3.25Å; C462-A506 WeakPolarHBondContact O-CB 3.4Å; L488-A506 HydrophobicContact CD2-CB 4.38Å; A502-A506 WeakPolarHBondContact O-CB 3.27Å; A502-A506 PolarHBondContact O-N 3.04Å; A502-A506 VanDerWaalsContact O-N 3.07Å; A506-L510 PolarHBondContact O-N 3.32Å
507	F	97.6	Very high	93.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-76.7	-37.3	176	-168.3	-110.8	0	0	0	112.1	M485 L488 L489 I492 A503 C504 S505 L510 E511 I525	M485-F507 HydrophobicContact CG-CE2 3.9Å; M485-F507 HydrophobicContact CG-CZ 4.4Å; L488-F507 HydrophobicContact CB-CD2 4.28Å; L488-F507 HydrophobicContact CD1-CD2 4.41Å; L489-F507 HydrophobicContact CD2-CD1 4.37Å; L489-F507 HydrophobicContact CD2-CD2 4.48Å; L489-F507 HydrophobicContact CD2-CE1 3.84Å; L489-F507 HydrophobicContact CD2-CE2 4.01Å; L489-F507 HydrophobicContact CD2-CZ 3.67Å; L489-F507 HydrophobicContact CG-CE2 4.21Å; L489-F507 HydrophobicContact CG-CZ 4.26Å; I492-F507 HydrophobicContact CD1-CB 3.92Å; I492-F507 HydrophobicContact CD1-CD1 3.8Å; I492-F507 HydrophobicContact CD1-CG 3.88Å; A503-F507 WeakPolarHBondContact O-CB 3.42Å; A503-F507 PolarHBondContact O-N 3.15Å; C504-F507 PolarHBondContact O-N 2.9Å; C504-F507 VanDerWaalsContact O-N 3.16Å; S505-F507 PolarHBondContact O-N 3.22Å; F507-L510 HydrophobicContact CD2-CD2 4.2Å; F507-L510 HydrophobicContact CE2-CD2 4.25Å; F507-L510 CarbonylContact O-C 3.59Å; F507-L510 WeakPolarHBondContact O-CA 3.34Å; F507-L510 WeakPolarHBondContact O-CB 3.33Å; F507-L510 PolarHBondContact O-N 3.02Å; F507-L510 VanDerWaalsContact O-N 3.1Å; F507-E511 HydrophobicContact CD1-CG 4.16Å; F507-E511 WeakPolarHBondContact CD1-OE1 3.2Å; F507-E511 HydrophobicContact CE1-CG 3.94Å; F507-E511 WeakPolarHBondContact CE1-OE1 3.41Å; F507-E511 HydrophobicContact CZ-CG 4.32Å; F507-E511 WeakPolarHBondContact O-CG 3.47Å; F507-E511 PolarHBondContact O-N 2.98Å; F507-I525 HydrophobicContact CE1-CG2 3.66Å; F507-I525 HydrophobicContact CZ-CD1 4.13Å; F507-I525 HydrophobicContact CZ-CG1 4.02Å; F507-I525 HydrophobicContact CZ-CG2 3.84Å
508	A	92.6	Very high	93.4	Very high	13 Å²	13	29 Å²	29	11%	0.107	16%	0.16	C	C	.	.	H	α-helix	trans	-58.8	-46.8	172.9	0	0	0	0	0	111.5	C504 S505 L510 E511 E512 A547 T550	C504-A508 PolarHBondContact O-N 2.85Å; S505-A508 PolarHBondContact O-N 2.81Å; A508-L510 VanDerWaalsContact C-N 3.27Å; A508-L510 PolarHBondContact O-N 2.69Å; A508-E511 WeakPolarHBondContact O-CA 3.32Å; A508-E511 VanDerWaalsContact O-CB 3.32Å; A508-E511 WeakPolarHBondContact O-CB 3.47Å; A508-E511 PolarHBondContact O-N 3.18Å; A508-E512 PolarHBondContact O-N 3.48Å; A508-A547 HydrophobicContact CB-CB 4.39Å; A508-T550 HydrophobicContact CB-CG2 4.43Å
509	T	91.4	Very high	93.8	Very high	49 Å²	49	27.9 Å²	27.9	30%	0.301	16%	0.159	S	C	.	.	H	α-helix	trans	-59.6	-37.3	173.2	-48.1	0	0	0	0	112.3	S505 E511 E513	S505-T509 PolarHBondContact O-N 2.88Å; S505-T509 VanDerWaalsContact O-N 3.16Å; S505-T509 PolarHBondContact O-OG1 2.93Å; T509-E511 VanDerWaalsContact C-N 3.31Å; T509-E511 PolarHBondContact O-N 2.76Å; T509-E513 PolarHBondContact O-N 2.7Å; T509-E513 VanDerWaalsContact O-N 3.17Å
510	L	94.7	Very high	93.8	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-68.1	-32	175.4	-175.7	64.4	0	0	0	112	A469 V473 L481 L484 M485 L488 A506 F507 A508 A514	A469-L510 HydrophobicContact CB-CD1 4Å; V473-L510 HydrophobicContact CG2-CD1 4.03Å; L481-L510 HydrophobicContact CD1-CD1 3.79Å; L481-L510 HydrophobicContact CD1-CD2 4.22Å; L481-L510 HydrophobicContact CD1-CG 4.26Å; L484-L510 HydrophobicContact CD2-CD1 4.27Å; L484-L510 HydrophobicContact CD2-CD2 4.22Å; L484-L510 HydrophobicContact CG-CD2 4.28Å; M485-L510 HydrophobicContact CB-CD2 4.39Å; L488-L510 HydrophobicContact CD1-CD2 4.05Å; A506-L510 PolarHBondContact O-N 3.32Å; F507-L510 HydrophobicContact CD2-CD2 4.2Å; F507-L510 HydrophobicContact CE2-CD2 4.25Å; F507-L510 CarbonylContact O-C 3.59Å; F507-L510 WeakPolarHBondContact O-CA 3.34Å; F507-L510 WeakPolarHBondContact O-CB 3.33Å; F507-L510 PolarHBondContact O-N 3.02Å; F507-L510 VanDerWaalsContact O-N 3.1Å; A508-L510 VanDerWaalsContact C-N 3.27Å; A508-L510 PolarHBondContact O-N 2.69Å; L510-A514 WeakPolarHBondContact O-CB 3.42Å; L510-A514 PolarHBondContact O-N 2.96Å
511	E	93.7	Very high	93.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-47	174.8	-70.6	169.2	151.6	0	0	111.5	F507 A508 T509 E513 A514 C515 L518 T550 L551 S554	F507-E511 HydrophobicContact CD1-CG 4.16Å; F507-E511 WeakPolarHBondContact CD1-OE1 3.2Å; F507-E511 HydrophobicContact CE1-CG 3.94Å; F507-E511 WeakPolarHBondContact CE1-OE1 3.41Å; F507-E511 HydrophobicContact CZ-CG 4.32Å; F507-E511 WeakPolarHBondContact O-CG 3.47Å; F507-E511 PolarHBondContact O-N 2.98Å; A508-E511 WeakPolarHBondContact O-CA 3.32Å; A508-E511 VanDerWaalsContact O-CB 3.32Å; A508-E511 WeakPolarHBondContact O-CB 3.47Å; A508-E511 PolarHBondContact O-N 3.18Å; T509-E511 VanDerWaalsContact C-N 3.31Å; T509-E511 PolarHBondContact O-N 2.76Å; E511-E513 PolarHBondContact O-N 2.98Å; E511-A514 PolarHBondContact O-N 2.77Å; E511-C515 PolarHBondContact O-N 3.06Å; E511-L518 HydrophobicContact CB-CD1 4Å; E511-L518 HydrophobicContact CG-CD1 3.59Å; E511-T550 HydrophobicContact CB-CG2 3.94Å; E511-L551 HydrophobicContact CG-CD1 4.26Å; E511-L551 WeakPolarHBondContact OE1-CB 3.44Å; E511-L551 WeakPolarHBondContact OE1-CD1 3.46Å; E511-L551 PolarHBondContact OE2-N 3.12Å; E511-S554 VanDerWaalsContact C-OG 3.29Å; E511-S554 PolarHBondContact O-OG 3.19Å; E511-S554 VanDerWaalsContact O-OG 3.06Å
512	E	88.6	Confident	94.1	Very high	94 Å²	94	32.8 Å²	32.8	44%	0.439	19%	0.188	S	C	.	.	H	α-helix	trans	-56.4	-47.6	175.5	-75.2	152.7	-163.6	0	0	111.7	A508 C515 T550	A508-E512 PolarHBondContact O-N 3.48Å; E512-C515 PolarHBondContact O-SG 2.88Å; E512-T550 HydrophobicContact CG-CG2 3.51Å; E512-T550 WeakPolarHBondContact OE1-CG2 3.4Å
513	E	88.6	Confident	94.3	Very high	53 Å²	53	34.1 Å²	34.1	25%	0.248	20%	0.2	C	C	.	.	H	α-helix	trans	-70.2	-43.1	179.6	-73.8	-66	161.3	0	0	112.9	A469 H470 V473 T509 E511	A469-E513 HydrophobicContact CB-CB 4.27Å; A469-E513 HydrophobicContact CB-CG 3.98Å; H470-E513 WeakPolarHBondContact CA-OE2 3.43Å; H470-E513 WeakPolarHBondContact CB-OE2 3.41Å; H470-E513 IonicContact CE1-OE2 2.89Å; H470-E513 IonicContact CG-OE2 3.14Å; H470-E513 IonicContact ND1-OE2 3.77Å; H470-E513 PolarHBondContact ND1-OE2 3.25Å; V473-E513 HydrophobicContact CG2-CB 4.05Å; T509-E513 PolarHBondContact O-N 2.7Å; T509-E513 VanDerWaalsContact O-N 3.17Å; E511-E513 PolarHBondContact O-N 2.98Å
514	A	92	Very high	94.4	Very high	3 Å²	3	38.5 Å²	38.5	3%	0.025	22%	0.219	C	C	.	.	H	α-helix	trans	-77.9	-28.3	-174.4	0	0	0	0	0	113	V473 L510 E511 T516 E517 L518	V473-A514 HydrophobicContact CG1-CB 4.45Å; V473-A514 HydrophobicContact CG2-CB 3.84Å; L510-A514 WeakPolarHBondContact O-CB 3.42Å; L510-A514 PolarHBondContact O-N 2.96Å; E511-A514 PolarHBondContact O-N 2.77Å; A514-T516 PolarHBondContact O-N 3.33Å; A514-T516 VanDerWaalsContact O-N 3.15Å; A514-E517 HydrophobicContact CB-CB 4.43Å; A514-E517 WeakPolarHBondContact O-CB 3.47Å; A514-E517 WeakPolarHBondContact O-CG 3.45Å; A514-E517 PolarHBondContact O-N 2.95Å; A514-L518 HydrophobicContact CB-CD1 4.09Å; A514-L518 HydrophobicContact CB-CD2 3.69Å; A514-L518 HydrophobicContact CB-CG 3.58Å
515	C	93.5	Very high	94.5	Very high	56 Å²	56	38.5 Å²	38.5	38%	0.378	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	45.3	-120.9	-179.2	-75.6	0	0	0	0	111.7	E511 E512 E517 L518 S554	E511-C515 PolarHBondContact O-N 3.06Å; E512-C515 PolarHBondContact O-SG 2.88Å; C515-E517 PolarHBondContact O-N 3.19Å; C515-L518 PolarHBondContact O-N 2.65Å; C515-S554 CarbonylContact C-O 3.48Å
516	T	92.3	Very high	94.8	Very high	76 Å²	76	36 Å²	36	47%	0.466	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-68.8	-13.7	-178.2	51.1	0	0	0	0	114.6	A514 L518 V519	A514-T516 PolarHBondContact O-N 3.33Å; A514-T516 VanDerWaalsContact O-N 3.15Å; T516-L518 PolarHBondContact O-N 3.19Å; T516-V519 WeakPolarHBondContact O-CB 3.42Å; T516-V519 VanDerWaalsContact O-CG2 3.26Å; T516-V519 WeakPolarHBondContact O-CG2 3.41Å; T516-V519 PolarHBondContact O-N 2.85Å; T516-V519 VanDerWaalsContact O-N 3.15Å
517	E	93	Very high	95	Very high	95 Å²	95	40.4 Å²	40.4	44%	0.444	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-66.1	-15.6	175.3	-61.9	-60.5	136.7	0	0	112.3	L481 A514 C515 P520	L481-E517 HydrophobicContact CD2-CB 4.36Å; A514-E517 HydrophobicContact CB-CB 4.43Å; A514-E517 WeakPolarHBondContact O-CB 3.47Å; A514-E517 WeakPolarHBondContact O-CG 3.45Å; A514-E517 PolarHBondContact O-N 2.95Å; C515-E517 PolarHBondContact O-N 3.19Å; E517-P520 VanDerWaalsContact O-CD 3.27Å; E517-P520 WeakPolarHBondContact O-CD 3.45Å
518	L	96.4	Very high	95.1	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-82.4	-17.6	174.7	-61.9	-175.9	0	0	0	114.3	M485 E511 A514 C515 T516 P520 Y521 L522 I525 L551 V555	M485-L518 HydrophobicContact SD-CD2 4.28Å; E511-L518 HydrophobicContact CB-CD1 4Å; E511-L518 HydrophobicContact CG-CD1 3.59Å; A514-L518 HydrophobicContact CB-CD1 4.09Å; A514-L518 HydrophobicContact CB-CD2 3.69Å; A514-L518 HydrophobicContact CB-CG 3.58Å; C515-L518 PolarHBondContact O-N 2.65Å; T516-L518 PolarHBondContact O-N 3.19Å; L518-P520 VanDerWaalsContact C-N 3.31Å; L518-Y521 WeakPolarHBondContact O-CA 3.36Å; L518-Y521 PolarHBondContact O-N 3.23Å; L518-L522 PolarHBondContact O-N 2.96Å; L518-I525 HydrophobicContact CB-CD1 4.06Å; L518-I525 HydrophobicContact CD1-CD1 4.41Å; L518-I525 HydrophobicContact CD2-CD1 4.33Å; L518-L551 HydrophobicContact CD1-CD1 4.4Å; L518-V555 HydrophobicContact CB-CG1 4.38Å
519	V	97.3	Very high	95.3	Very high	29 Å²	29	40.3 Å²	40.3	18%	0.176	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-51.8	-40.2	-177.5	174.1	0	0	0	0	113.4	T516 Y521 L522 V555 H558	T516-V519 WeakPolarHBondContact O-CB 3.42Å; T516-V519 VanDerWaalsContact O-CG2 3.26Å; T516-V519 WeakPolarHBondContact O-CG2 3.41Å; T516-V519 PolarHBondContact O-N 2.85Å; T516-V519 VanDerWaalsContact O-N 3.15Å; V519-Y521 PolarHBondContact O-N 3.47Å; V519-L522 WeakPolarHBondContact O-CB 3.3Å; V519-L522 PolarHBondContact O-N 2.88Å; V519-V555 HydrophobicContact CG2-CB 4.17Å; V519-V555 HydrophobicContact CG2-CG1 4.3Å; V519-H558 HydrophobicContact CG1-CB 4.06Å; V519-H558 HydrophobicContact CG2-CB 3.84Å
520	P	97.8	Very high	95.6	Very high	98 Å²	98	39.6 Å²	39.6	64%	0.636	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-62	-21.9	176.2	-23.6	35.9	0	0	0	114.7	E517 L518	E517-P520 VanDerWaalsContact O-CD 3.27Å; E517-P520 WeakPolarHBondContact O-CD 3.45Å; L518-P520 VanDerWaalsContact C-N 3.31Å
521	Y	97.9	Very high	95.8	Very high	47 Å²	47	44.9 Å²	44.9	18%	0.184	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-109.4	0.1	-174.4	-48.1	-69.7	0	0	0	113.2	K482 M485 L518 V519 A523 F524 I525	K482-Y521 HydrophobicContact CD-CE1 4.15Å; K482-Y521 HydrophobicContact CG-CE1 4.23Å; M485-Y521 HydrophobicContact CE-CD1 3.74Å; M485-Y521 HydrophobicContact CE-CD2 3.98Å; M485-Y521 HydrophobicContact CE-CE1 4.35Å; M485-Y521 HydrophobicContact CE-CG 3.52Å; M485-Y521 HydrophobicContact SD-CD2 3.79Å; M485-Y521 HydrophobicContact SD-CG 3.74Å; L518-Y521 WeakPolarHBondContact O-CA 3.36Å; L518-Y521 PolarHBondContact O-N 3.23Å; V519-Y521 PolarHBondContact O-N 3.47Å; Y521-A523 VanDerWaalsContact C-N 3.29Å; Y521-A523 PolarHBondContact O-N 3.49Å; Y521-A523 VanDerWaalsContact O-N 3.12Å; Y521-F524 WeakPolarHBondContact O-CB 3.15Å; Y521-F524 PolarHBondContact O-N 3.31Å; Y521-I525 PolarHBondContact O-N 2.94Å; Y521-I525 VanDerWaalsContact O-N 3.14Å
522	L	97	Very high	96	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-53.5	-39.1	-169	-172.5	55.3	0	0	0	114.4	L518 V519 F524 I525 L526 L551 V555 L559 Y564	L518-L522 PolarHBondContact O-N 2.96Å; V519-L522 WeakPolarHBondContact O-CB 3.3Å; V519-L522 PolarHBondContact O-N 2.88Å; L522-F524 VanDerWaalsContact C-N 3.33Å; L522-F524 PolarHBondContact O-N 3.18Å; L522-I525 PolarHBondContact O-N 3.34Å; L522-L526 HydrophobicContact CD1-CD1 4.1Å; L522-L526 HydrophobicContact CD1-CG 4.09Å; L522-L526 HydrophobicContact CG-CD1 3.94Å; L522-L526 HydrophobicContact CG-CG 4.39Å; L522-L526 WeakPolarHBondContact O-CB 3.07Å; L522-L526 VanDerWaalsContact O-CG 3.28Å; L522-L526 WeakPolarHBondContact O-CG 3.44Å; L522-L526 PolarHBondContact O-N 2.85Å; L522-L551 HydrophobicContact CD1-CD1 4.04Å; L522-L551 HydrophobicContact CD1-CD2 4.04Å; L522-L551 HydrophobicContact CD1-CG 4.25Å; L522-V555 HydrophobicContact CD1-CG1 4.34Å; L522-V555 HydrophobicContact CD1-CG2 4.35Å; L522-V555 HydrophobicContact CD2-CG2 4.17Å; L522-L559 HydrophobicContact CD1-CD1 4.33Å; L522-L559 HydrophobicContact CD2-CD1 4.22Å; L522-Y564 HydrophobicContact CB-CE2 4.44Å; L522-Y564 HydrophobicContact CD2-CD2 3.8Å; L522-Y564 HydrophobicContact CD2-CE2 3.52Å; L522-Y564 HydrophobicContact CG-CD2 4.27Å; L522-Y564 HydrophobicContact CG-CE2 3.99Å
523	A	97.8	Very high	96.4	Very high	45 Å²	45	41.5 Å²	41.5	37%	0.372	23%	0.225	S	C	.	.	H	α-helix	trans	-61.6	-40.8	177	0	0	0	0	0	112.7	Y521 D527 Y564	Y521-A523 VanDerWaalsContact C-N 3.29Å; Y521-A523 PolarHBondContact O-N 3.49Å; Y521-A523 VanDerWaalsContact O-N 3.12Å; A523-D527 PolarHBondContact O-N 3.18Å; A523-Y564 HydrophobicContact CB-CE1 3.94Å
524	F	98.1	Very high	96.7	Very high	92 Å²	92	43.4 Å²	43.4	40%	0.404	24%	0.244	S	C	.	.	H	α-helix	trans	-73.2	-37.4	-179.6	176.4	-124.3	0	0	0	112.1	M485 L489 Y521 L522 T528	M485-F524 HydrophobicContact CE-CD1 4.47Å; L489-F524 HydrophobicContact CD1-CD1 3.54Å; L489-F524 HydrophobicContact CD1-CE1 3.37Å; L489-F524 HydrophobicContact CD1-CG 4.43Å; L489-F524 HydrophobicContact CD1-CZ 4.13Å; Y521-F524 WeakPolarHBondContact O-CB 3.15Å; Y521-F524 PolarHBondContact O-N 3.31Å; L522-F524 VanDerWaalsContact C-N 3.33Å; L522-F524 PolarHBondContact O-N 3.18Å; F524-T528 PolarHBondContact O-N 2.94Å; F524-T528 PolarHBondContact O-OG1 3.12Å
525	I	98.6	Very high	96.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-53	173.7	-63	168.7	0	0	0	109.3	M485 L489 F507 L518 Y521 L522 D527 T528 L529 L551	M485-I525 HydrophobicContact SD-CD1 4.09Å; M485-I525 HydrophobicContact SD-CG1 4.27Å; L489-I525 HydrophobicContact CD1-CG1 4.08Å; L489-I525 HydrophobicContact CD2-CG2 4.41Å; F507-I525 HydrophobicContact CE1-CG2 3.66Å; F507-I525 HydrophobicContact CZ-CD1 4.13Å; F507-I525 HydrophobicContact CZ-CG1 4.02Å; F507-I525 HydrophobicContact CZ-CG2 3.84Å; L518-I525 HydrophobicContact CB-CD1 4.06Å; L518-I525 HydrophobicContact CD1-CD1 4.41Å; L518-I525 HydrophobicContact CD2-CD1 4.33Å; Y521-I525 PolarHBondContact O-N 2.94Å; Y521-I525 VanDerWaalsContact O-N 3.14Å; L522-I525 PolarHBondContact O-N 3.34Å; I525-D527 PolarHBondContact O-N 3.43Å; I525-T528 WeakPolarHBondContact O-CB 3.24Å; I525-T528 PolarHBondContact O-N 2.89Å; I525-L529 HydrophobicContact CG2-CD1 3.94Å; I525-L529 HydrophobicContact CG2-CG 4.29Å; I525-L529 PolarHBondContact O-N 3.41Å; I525-L551 HydrophobicContact CG2-CD1 4.32Å; I525-L551 HydrophobicContact CG2-CD2 3.75Å
526	L	98.3	Very high	97	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-41.4	-179.1	-72.2	171	0	0	0	112.9	L522 T528 L529 V530 L551 L559 Y564 M567 L568	L522-L526 HydrophobicContact CD1-CD1 4.1Å; L522-L526 HydrophobicContact CD1-CG 4.09Å; L522-L526 HydrophobicContact CG-CD1 3.94Å; L522-L526 HydrophobicContact CG-CG 4.39Å; L522-L526 WeakPolarHBondContact O-CB 3.07Å; L522-L526 VanDerWaalsContact O-CG 3.28Å; L522-L526 WeakPolarHBondContact O-CG 3.44Å; L522-L526 PolarHBondContact O-N 2.85Å; L526-T528 PolarHBondContact O-N 3.1Å; L526-L529 PolarHBondContact O-N 3.46Å; L526-V530 WeakPolarHBondContact O-CB 3.39Å; L526-V530 VanDerWaalsContact O-CG2 3.22Å; L526-V530 WeakPolarHBondContact O-CG2 3.36Å; L526-V530 PolarHBondContact O-N 3.04Å; L526-L551 HydrophobicContact CD2-CD2 3.97Å; L526-L559 HydrophobicContact CD1-CD1 3.88Å; L526-L559 HydrophobicContact CD2-CD1 4.19Å; L526-Y564 HydrophobicContact CD1-CD1 3.54Å; L526-Y564 HydrophobicContact CD1-CD2 4.19Å; L526-Y564 HydrophobicContact CD1-CE1 4.36Å; L526-Y564 HydrophobicContact CD1-CG 3.49Å; L526-Y564 VanDerWaalsContact CD1-CG 3.49Å; L526-M567 HydrophobicContact CB-SD 3.82Å; L526-L568 HydrophobicContact CD2-CD1 4.5Å; L526-L568 HydrophobicContact CD2-CD2 4.4Å
527	D	98.3	Very high	97.1	Very high	95 Å²	95	42.1 Å²	42.1	51%	0.508	23%	0.225	S	C	.	.	H	α-helix	trans	-55.6	-39.1	175	-88.6	-18.3	0	0	0	111.4	A523 I525 F531 M567	A523-D527 PolarHBondContact O-N 3.18Å; I525-D527 PolarHBondContact O-N 3.43Å; D527-F531 VanDerWaalsContact O-CB 3.32Å; D527-F531 WeakPolarHBondContact O-CB 3.14Å; D527-F531 PolarHBondContact O-N 3.49Å; D527-F531 VanDerWaalsContact O-N 3.12Å; D527-M567 WeakPolarHBondContact OD1-CE 3.38Å; D527-M567 VanDerWaalsContact OD1-SD 3.42Å
528	T	98.7	Very high	96.9	Very high	12 Å²	12	40.3 Å²	40.3	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-71.7	-51.5	-179.9	-54.4	0	0	0	0	111.5	L489 I492 L493 F524 I525 L526 V530 F531 A532	L489-T528 HydrophobicContact CB-CG2 4.01Å; L489-T528 HydrophobicContact CD2-CG2 3.99Å; L489-T528 VanDerWaalsContact O-CG2 3.3Å; L489-T528 WeakPolarHBondContact O-CG2 3.39Å; I492-T528 HydrophobicContact CB-CG2 4.41Å; I492-T528 HydrophobicContact CG2-CG2 4.27Å; L493-T528 HydrophobicContact CD1-CG2 3.9Å; L493-T528 HydrophobicContact CD2-CG2 4.26Å; L493-T528 HydrophobicContact CG-CG2 3.82Å; F524-T528 PolarHBondContact O-N 2.94Å; F524-T528 PolarHBondContact O-OG1 3.12Å; I525-T528 WeakPolarHBondContact O-CB 3.24Å; I525-T528 PolarHBondContact O-N 2.89Å; L526-T528 PolarHBondContact O-N 3.1Å; T528-V530 VanDerWaalsContact C-N 3.32Å; T528-V530 PolarHBondContact O-N 3.15Å; T528-F531 PolarHBondContact O-N 3.02Å; T528-A532 PolarHBondContact O-N 2.88Å
529	L	98.2	Very high	96.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-39.2	-179.8	-61.3	-178.8	0	0	0	111.4	I492 I525 L526 F531 A532 F533 L544 I548 L551	I492-L529 HydrophobicContact CD1-CD2 3.91Å; I492-L529 HydrophobicContact CG2-CD2 4.4Å; I525-L529 HydrophobicContact CG2-CD1 3.94Å; I525-L529 HydrophobicContact CG2-CG 4.29Å; I525-L529 PolarHBondContact O-N 3.41Å; L526-L529 PolarHBondContact O-N 3.46Å; L529-F531 VanDerWaalsContact C-N 3.33Å; L529-F531 PolarHBondContact O-N 3.13Å; L529-A532 WeakPolarHBondContact O-CB 3.44Å; L529-A532 PolarHBondContact O-N 3.44Å; L529-F533 PolarHBondContact O-N 3.31Å; L529-L544 HydrophobicContact CB-CD1 4.17Å; L529-L544 HydrophobicContact CD2-CD1 3.84Å; L529-I548 HydrophobicContact CB-CG1 4.32Å; L529-I548 HydrophobicContact CD1-CG1 3.99Å; L529-L551 HydrophobicContact CD1-CD2 3.77Å
530	V	98	Very high	96.2	Very high	33 Å²	33	40.6 Å²	40.6	20%	0.2	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-37.5	176.7	170.8	0	0	0	0	111.4	L526 T528 A532 F533 M567 L568 P571	L526-V530 WeakPolarHBondContact O-CB 3.39Å; L526-V530 VanDerWaalsContact O-CG2 3.22Å; L526-V530 WeakPolarHBondContact O-CG2 3.36Å; L526-V530 PolarHBondContact O-N 3.04Å; T528-V530 VanDerWaalsContact C-N 3.32Å; T528-V530 PolarHBondContact O-N 3.15Å; V530-A532 VanDerWaalsContact C-N 3.32Å; V530-F533 PolarHBondContact O-N 3.03Å; V530-M567 HydrophobicContact CB-CG 4.23Å; V530-M567 HydrophobicContact CB-SD 4.39Å; V530-M567 HydrophobicContact CG1-CG 4.11Å; V530-M567 HydrophobicContact CG2-CG 3.92Å; V530-M567 HydrophobicContact CG2-SD 4.13Å; V530-L568 HydrophobicContact CG2-CD1 4.21Å; V530-P571 HydrophobicContact CG1-CG 4.36Å
531	F	98.3	Very high	96.1	Very high	112 Å²	112	36.3 Å²	36.3	49%	0.491	19%	0.188	S	C	.	.	H	α-helix	trans	-66.1	-35.8	173.6	-173.3	-90.9	0	0	0	112.1	L493 D527 T528 L529 F533 S534 K535	L493-F531 HydrophobicContact CD1-CD1 3.71Å; L493-F531 HydrophobicContact CD1-CE1 4.31Å; L493-F531 HydrophobicContact CD1-CG 4.44Å; L493-F531 HydrophobicContact CD2-CD1 3.77Å; L493-F531 HydrophobicContact CG-CD1 4.35Å; D527-F531 VanDerWaalsContact O-CB 3.32Å; D527-F531 WeakPolarHBondContact O-CB 3.14Å; D527-F531 PolarHBondContact O-N 3.49Å; D527-F531 VanDerWaalsContact O-N 3.12Å; T528-F531 PolarHBondContact O-N 3.02Å; L529-F531 VanDerWaalsContact C-N 3.33Å; L529-F531 PolarHBondContact O-N 3.13Å; F531-F533 VanDerWaalsContact C-N 3.25Å; F531-F533 PolarHBondContact O-N 3.22Å; F531-S534 WeakPolarHBondContact O-CB 3.3Å; F531-S534 PolarHBondContact O-N 3.42Å; F531-S534 PolarHBondContact O-OG 2.74Å; F531-K535 HydrophobicContact CE1-CD 4.24Å
532	A	97.9	Very high	95.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.5	-34.6	178.6	0	0	0	0	0	112.5	I492 L493 T528 L529 V530 S534 K535 Y536 L544	I492-A532 HydrophobicContact CG2-CB 4.27Å; L493-A532 HydrophobicContact CD2-CB 3.96Å; T528-A532 PolarHBondContact O-N 2.88Å; L529-A532 WeakPolarHBondContact O-CB 3.44Å; L529-A532 PolarHBondContact O-N 3.44Å; V530-A532 VanDerWaalsContact C-N 3.32Å; A532-S534 PolarHBondContact O-N 2.97Å; A532-K535 PolarHBondContact O-N 2.97Å; A532-Y536 HydrophobicContact CB-CD1 4.1Å; A532-Y536 HydrophobicContact CB-CD2 4.34Å; A532-Y536 HydrophobicContact CB-CE1 3.94Å; A532-Y536 HydrophobicContact CB-CE2 4.21Å; A532-Y536 HydrophobicContact CB-CG 4.32Å; A532-Y536 WeakPolarHBondContact O-CB 3.48Å; A532-Y536 PolarHBondContact O-N 2.97Å; A532-L544 HydrophobicContact CB-CD1 3.96Å; A532-L544 HydrophobicContact CB-CD2 3.73Å
533	F	96.5	Very high	95.4	Very high	23 Å²	23	35.2 Å²	35.2	10%	0.101	19%	0.185	C	C	.	.	H	α-helix	trans	-54.1	-29.6	173.2	-80.8	-71.9	0	0	0	114.7	L529 V530 F531 L541 L544 Y545 I548 P571 L572	L529-F533 PolarHBondContact O-N 3.31Å; V530-F533 PolarHBondContact O-N 3.03Å; F531-F533 VanDerWaalsContact C-N 3.25Å; F531-F533 PolarHBondContact O-N 3.22Å; F533-L541 HydrophobicContact CD1-CD1 3.5Å; F533-L541 HydrophobicContact CE1-CD1 3.69Å; F533-L544 HydrophobicContact CD1-CD2 3.99Å; F533-L544 HydrophobicContact CD2-CD2 4.04Å; F533-L544 HydrophobicContact CE1-CD2 4.08Å; F533-L544 HydrophobicContact CE2-CD2 4.17Å; F533-L544 HydrophobicContact CG-CD2 3.95Å; F533-L544 HydrophobicContact CZ-CD2 4.18Å; F533-L544 HydrophobicContact CZ-CG 4.5Å; F533-Y545 HydrophobicContact CE1-CD1 4.16Å; F533-Y545 AromaticContact CE1-CE1 3.55Å; F533-Y545 HydrophobicContact CE1-CE1 3.55Å; F533-Y545 HydrophobicContact CZ-CD1 4.31Å; F533-Y545 HydrophobicContact CZ-CE1 4.07Å; F533-I548 HydrophobicContact CE2-CD1 3.38Å; F533-I548 HydrophobicContact CZ-CD1 3.44Å; F533-I548 VanDerWaalsContact CZ-CD1 3.44Å; F533-P571 HydrophobicContact CB-CB 4.12Å; F533-P571 HydrophobicContact CD1-CB 4.21Å; F533-P571 HydrophobicContact CD2-CB 3.66Å; F533-P571 HydrophobicContact CD2-CG 3.85Å; F533-P571 HydrophobicContact CE2-CB 4.08Å; F533-P571 HydrophobicContact CE2-CG 4.03Å; F533-P571 HydrophobicContact CG-CB 3.73Å; F533-P571 HydrophobicContact CG-CG 4.43Å; F533-L572 HydrophobicContact CE1-CD2 4.4Å; F533-L572 HydrophobicContact CZ-CD2 3.75Å; F533-L572 HydrophobicContact CZ-CG 4.34Å
534	S	95.2	Very high	95.3	Very high	93 Å²	93	33.1 Å²	33.1	65%	0.65	17%	0.167	S	C	*	.	H	α-helix	trans	-86.2	-14.1	179.5	74.4	0	0	0	0	113.5	F531 A532	F531-S534 WeakPolarHBondContact O-CB 3.3Å; F531-S534 PolarHBondContact O-N 3.42Å; F531-S534 PolarHBondContact O-OG 2.74Å; A532-S534 PolarHBondContact O-N 2.97Å
535	K	95.8	Very high	95.2	Very high	41 Å²	41	28.9 Å²	28.9	18%	0.178	15%	0.148	C	C	.	.	H	α-helix	trans	-111.2	-36.9	-171.5	-177.9	169.4	174.7	148.7	0	112.6	E326 L493 D494 F531 A532	E326-K535 WeakPolarHBondContact OE2-CE 3.45Å; E326-K535 IonicContact OE2-NZ 3.12Å; E326-K535 PolarHBondContact OE2-NZ 3.01Å; L493-K535 HydrophobicContact CD2-CD 4.47Å; L493-K535 WeakPolarHBondContact O-CE 3.34Å; L493-K535 PolarHBondContact O-NZ 3.48Å; D494-K535 WeakPolarHBondContact O-CE 3.45Å; D494-K535 PolarHBondContact O-NZ 2.9Å; F531-K535 HydrophobicContact CE1-CD 4.24Å; A532-K535 PolarHBondContact O-N 2.97Å
536	Y	96.1	Very high	94.7	Very high	15 Å²	15	31.1 Å²	31.1	6%	0.059	16%	0.16	C	C	.	.			trans	-71.2	139.3	-173.7	-77.7	12.4	0	0	0	111.7	I492 Q500 A532 N540 L544	I492-Y536 WeakPolarHBondContact CG2-OH 3.24Å; I492-Y536 WeakPolarHBondContact O-CE1 3.29Å; I492-Y536 VanDerWaalsContact O-CZ 3.31Å; I492-Y536 PolarHBondContact O-OH 3.4Å; Q500-Y536 HydrophobicContact CB-CE1 3.87Å; Q500-Y536 HydrophobicContact CG-CE1 3.79Å; A532-Y536 HydrophobicContact CB-CD1 4.1Å; A532-Y536 HydrophobicContact CB-CD2 4.34Å; A532-Y536 HydrophobicContact CB-CE1 3.94Å; A532-Y536 HydrophobicContact CB-CE2 4.21Å; A532-Y536 HydrophobicContact CB-CG 4.32Å; A532-Y536 WeakPolarHBondContact O-CB 3.48Å; A532-Y536 PolarHBondContact O-N 2.97Å; Y536-N540 VanDerWaalsContact CD2-C 3.48Å; Y536-N540 HydrophobicContact CD2-CB 3.63Å; Y536-N540 WeakPolarHBondContact CD2-O 3.47Å; Y536-N540 HydrophobicContact CE2-CB 3.96Å; Y536-N540 HydrophobicContact CG-CB 3.95Å; Y536-L544 HydrophobicContact CD2-CB 3.85Å; Y536-L544 HydrophobicContact CD2-CD2 4.04Å; Y536-L544 HydrophobicContact CD2-CG 4.44Å; Y536-L544 HydrophobicContact CE2-CB 3.96Å; Y536-L544 HydrophobicContact CE2-CD1 4.43Å; Y536-L544 HydrophobicContact CE2-CD2 4.47Å
537	Q	93.7	Very high	94.5	Very high	52 Å²	52	31.1 Å²	31.1	24%	0.243	16%	0.161	C	C	.	.			trans	-80	-178.6	164.3	-58.5	-57.8	-35.2	0	0	109.7	E326 D330 K497 K539 L541	E326-Q537 WeakPolarHBondContact O-CG 3.3Å; E326-Q537 PolarHBondContact O-NE2 3.12Å; D330-Q537 WeakPolarHBondContact OD2-CB 3.4Å; K497-Q537 HydrophobicContact CD-CB 4.34Å; K497-Q537 HydrophobicContact CD-CG 4.12Å; Q537-K539 PolarHBondContact O-N 3.28Å; Q537-L541 VanDerWaalsContact O-CB 3.25Å; Q537-L541 WeakPolarHBondContact O-CB 3.47Å; Q537-L541 PolarHBondContact O-N 3.15Å
538	H	90	Very high	94.4	Very high	58 Å²	58	26.7 Å²	26.7	27%	0.269	14%	0.137	S	C	.	.	H	α-helix	trans	-60.2	-47.9	-169.3	177.9	105.2	0	0	0	113	D330 I335 N540 L541 L542 D585	D330-H538 PolarHBondContact OD2-N 2.82Å; I335-H538 HydrophobicContact CD1-CB 4.3Å; I335-H538 WeakPolarHBondContact CD1-CD2 3.33Å; I335-H538 WeakPolarHBondContact CD1-NE2 3.29Å; I335-H538 WeakPolarHBondContact CG2-NE2 3.28Å; H538-N540 PolarHBondContact O-N 2.91Å; H538-L541 WeakPolarHBondContact O-CB 3.46Å; H538-L541 PolarHBondContact O-N 3.12Å; H538-L542 PolarHBondContact O-N 3.07Å; H538-D585 IonicContact CE1-OD1 2.76Å; H538-D585 PolarHBondContact CE1-OD1 2.99Å; H538-D585 IonicContact CE1-OD2 2.83Å; H538-D585 PolarHBondContact CE1-OD2 2.75Å; H538-D585 IonicContact ND1-OD2 2.75Å; H538-D585 PolarHBondContact ND1-OD2 3.42Å; H538-D585 IonicContact NE2-OD1 2.71Å; H538-D585 PolarHBondContact NE2-OD1 3.48Å; H538-D585 IonicContact NE2-OD2 2.72Å
539	K	87.8	Confident	94.3	Very high	34 Å²	34	26.3 Å²	26.3	15%	0.148	14%	0.135	C	C	.	.	H	α-helix	trans	-57.4	-54.2	-177.9	-174.2	-173.5	179.1	-162.2	0	111.3	D330 D371 E501 Q537 L541 L542	D330-K539 PolarHBondContact OD2-N 3.12Å; D371-K539 IonicContact OD1-NZ 3.79Å; D371-K539 PolarHBondContact OD1-NZ 3.47Å; D371-K539 VanDerWaalsContact OD1-NZ 3.1Å; E501-K539 WeakPolarHBondContact OE1-CE 3.42Å; E501-K539 IonicContact OE1-NZ 3.72Å; E501-K539 PolarHBondContact OE1-NZ 3.44Å; E501-K539 IonicContact OE2-NZ 2.65Å; E501-K539 PolarHBondContact OE2-NZ 2.84Å; Q537-K539 PolarHBondContact O-N 3.28Å; K539-L541 VanDerWaalsContact C-N 3.28Å; K539-L541 PolarHBondContact O-N 3.11Å; K539-L542 WeakPolarHBondContact O-CB 3.03Å; K539-L542 PolarHBondContact O-N 3.14Å
540	N	91.3	Very high	94	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-71.8	-23.5	-176.6	-65.8	-2.5	0	0	0	112.9	K497 Q500 Y536 H538 L542 I543 L544	K497-N540 PolarHBondContact O-ND2 3.14Å; Q500-N540 WeakPolarHBondContact CB-ND2 3.44Å; Q500-N540 PolarHBondContact OE1-ND2 2.88Å; Y536-N540 VanDerWaalsContact CD2-C 3.48Å; Y536-N540 HydrophobicContact CD2-CB 3.63Å; Y536-N540 WeakPolarHBondContact CD2-O 3.47Å; Y536-N540 HydrophobicContact CE2-CB 3.96Å; Y536-N540 HydrophobicContact CG-CB 3.95Å; H538-N540 PolarHBondContact O-N 2.91Å; N540-L542 PolarHBondContact O-N 3.02Å; N540-I543 PolarHBondContact O-N 2.94Å; N540-L544 PolarHBondContact O-N 3.18Å
541	L	94.2	Very high	94	Very high	8 Å²	8	26 Å²	26	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-63	-32.3	174.3	179.8	65.9	0	0	0	111.9	F533 Q537 H538 K539 L544 Y545 K575	F533-L541 HydrophobicContact CD1-CD1 3.5Å; F533-L541 HydrophobicContact CE1-CD1 3.69Å; Q537-L541 VanDerWaalsContact O-CB 3.25Å; Q537-L541 WeakPolarHBondContact O-CB 3.47Å; Q537-L541 PolarHBondContact O-N 3.15Å; H538-L541 WeakPolarHBondContact O-CB 3.46Å; H538-L541 PolarHBondContact O-N 3.12Å; K539-L541 VanDerWaalsContact C-N 3.28Å; K539-L541 PolarHBondContact O-N 3.11Å; L541-L544 HydrophobicContact CD1-CD2 4.16Å; L541-L544 WeakPolarHBondContact O-CB 3.31Å; L541-L544 PolarHBondContact O-N 3.08Å; L541-Y545 HydrophobicContact CD1-CE1 4.36Å; L541-Y545 HydrophobicContact CD1-CE2 4.46Å; L541-Y545 HydrophobicContact CD2-CE2 4.38Å; L541-Y545 HydrophobicContact CG-CE2 3.86Å; L541-Y545 VanDerWaalsContact O-CD2 3.25Å; L541-Y545 WeakPolarHBondContact O-CD2 2.98Å; L541-Y545 PolarHBondContact O-N 3.46Å; L541-K575 HydrophobicContact CD2-CD 3.91Å; L541-K575 VanDerWaalsContact CD2-CE 3.44Å
542	L	90.8	Very high	93.9	Very high	11 Å²	11	20.7 Å²	20.7	6%	0.058	11%	0.11	C	C	.	.	H	α-helix	trans	-63.5	-47.7	175.7	-52.2	-178.1	0	0	0	110.5	H538 K539 N540 L544 Y545 D546 D585 P588	H538-L542 PolarHBondContact O-N 3.07Å; K539-L542 WeakPolarHBondContact O-CB 3.03Å; K539-L542 PolarHBondContact O-N 3.14Å; N540-L542 PolarHBondContact O-N 3.02Å; L542-L544 VanDerWaalsContact C-N 3.26Å; L542-L544 PolarHBondContact O-N 3.48Å; L542-Y545 HydrophobicContact CD2-CE2 4.42Å; L542-Y545 WeakPolarHBondContact O-CB 3.36Å; L542-Y545 PolarHBondContact O-N 3.37Å; L542-D546 PolarHBondContact O-N 3.08Å; L542-D585 HydrophobicContact CD2-CB 4.4Å; L542-P588 HydrophobicContact CB-CG 4.22Å; L542-P588 HydrophobicContact CD2-CG 3.77Å; L542-P588 HydrophobicContact CG-CG 4.48Å
543	I	90.1	Very high	93.6	Very high	14 Å²	14	25.5 Å²	25.5	7%	0.072	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-32.7	177.2	-51.5	177.3	0	0	0	111.8	E501 C504 N540 Y545 D546 A547	E501-I543 HydrophobicContact CB-CD1 3.86Å; E501-I543 HydrophobicContact CG-CD1 3.51Å; C504-I543 HydrophobicContact CB-CG2 3.82Å; N540-I543 PolarHBondContact O-N 2.94Å; I543-Y545 VanDerWaalsContact C-N 3.31Å; I543-Y545 PolarHBondContact O-N 3.37Å; I543-D546 PolarHBondContact O-N 3.39Å; I543-A547 PolarHBondContact O-N 3.45Å
544	L	96.3	Very high	93.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.5	-34.2	175.4	-178.4	63.1	0	0	0	112.2	L529 A532 F533 Y536 N540 L541 L542 I548	L529-L544 HydrophobicContact CB-CD1 4.17Å; L529-L544 HydrophobicContact CD2-CD1 3.84Å; A532-L544 HydrophobicContact CB-CD1 3.96Å; A532-L544 HydrophobicContact CB-CD2 3.73Å; F533-L544 HydrophobicContact CD1-CD2 3.99Å; F533-L544 HydrophobicContact CD2-CD2 4.04Å; F533-L544 HydrophobicContact CE1-CD2 4.08Å; F533-L544 HydrophobicContact CE2-CD2 4.17Å; F533-L544 HydrophobicContact CG-CD2 3.95Å; F533-L544 HydrophobicContact CZ-CD2 4.18Å; F533-L544 HydrophobicContact CZ-CG 4.5Å; Y536-L544 HydrophobicContact CD2-CB 3.85Å; Y536-L544 HydrophobicContact CD2-CD2 4.04Å; Y536-L544 HydrophobicContact CD2-CG 4.44Å; Y536-L544 HydrophobicContact CE2-CB 3.96Å; Y536-L544 HydrophobicContact CE2-CD1 4.43Å; Y536-L544 HydrophobicContact CE2-CD2 4.47Å; N540-L544 PolarHBondContact O-N 3.18Å; L541-L544 HydrophobicContact CD1-CD2 4.16Å; L541-L544 WeakPolarHBondContact O-CB 3.31Å; L541-L544 PolarHBondContact O-N 3.08Å; L542-L544 VanDerWaalsContact C-N 3.26Å; L542-L544 PolarHBondContact O-N 3.48Å; L544-I548 HydrophobicContact CD1-CD1 4.22Å; L544-I548 HydrophobicContact CD1-CG1 4.47Å; L544-I548 HydrophobicContact CG-CD1 4.02Å; L544-I548 WeakPolarHBondContact O-CD1 3.47Å; L544-I548 VanDerWaalsContact O-CG1 3.25Å; L544-I548 WeakPolarHBondContact O-CG1 3.32Å; L544-I548 PolarHBondContact O-N 3.2Å; L544-I548 VanDerWaalsContact O-N 3.1Å
545	Y	95.3	Very high	93.3	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.016	11%	0.106	C	C	.	.	H	α-helix	trans	-64.3	-44.6	174.3	-64.4	-49.6	0	0	0	111	F533 L541 L542 I543 I548 G549 L572 K575 P588 L589 C592	F533-Y545 HydrophobicContact CE1-CD1 4.16Å; F533-Y545 AromaticContact CE1-CE1 3.55Å; F533-Y545 HydrophobicContact CE1-CE1 3.55Å; F533-Y545 HydrophobicContact CZ-CD1 4.31Å; F533-Y545 HydrophobicContact CZ-CE1 4.07Å; L541-Y545 HydrophobicContact CD1-CE1 4.36Å; L541-Y545 HydrophobicContact CD1-CE2 4.46Å; L541-Y545 HydrophobicContact CD2-CE2 4.38Å; L541-Y545 HydrophobicContact CG-CE2 3.86Å; L541-Y545 VanDerWaalsContact O-CD2 3.25Å; L541-Y545 WeakPolarHBondContact O-CD2 2.98Å; L541-Y545 PolarHBondContact O-N 3.46Å; L542-Y545 HydrophobicContact CD2-CE2 4.42Å; L542-Y545 WeakPolarHBondContact O-CB 3.36Å; L542-Y545 PolarHBondContact O-N 3.37Å; I543-Y545 VanDerWaalsContact C-N 3.31Å; I543-Y545 PolarHBondContact O-N 3.37Å; Y545-I548 PolarHBondContact O-N 3.32Å; Y545-G549 PolarHBondContact O-N 3.37Å; Y545-L572 HydrophobicContact CD1-CD2 4.05Å; Y545-L572 HydrophobicContact CE1-CD2 4.03Å; Y545-K575 VanDerWaalsContact OH-CB 3.24Å; Y545-K575 WeakPolarHBondContact OH-CB 3.48Å; Y545-K575 WeakPolarHBondContact OH-CG 3.43Å; Y545-P588 WeakPolarHBondContact CB-O 3.5Å; Y545-P588 HydrophobicContact CD2-CB 4.07Å; Y545-P588 HydrophobicContact CD2-CG 4.15Å; Y545-L589 HydrophobicContact CD1-CD1 3.95Å; Y545-L589 HydrophobicContact CD2-CB 4.31Å; Y545-L589 HydrophobicContact CE1-CD1 3.55Å; Y545-L589 HydrophobicContact CE2-CB 4.19Å; Y545-C592 WeakPolarHBondContact O-CB 3.46Å; Y545-C592 PolarHBondContact O-SG 2.95Å
546	D	87.9	Confident	93.2	Very high	47 Å²	47	19.8 Å²	19.8	25%	0.251	11%	0.107	S	C	.	.	H	α-helix	trans	-59.5	-51.8	179.5	-54	-22.3	0	0	0	109.7	R338 L542 I543 I548 G549 T550	R338-D546 IonicContact CZ-OD2 3.52Å; R338-D546 IonicContact NH1-OD1 2.67Å; R338-D546 IonicContact NH1-OD2 3.59Å; R338-D546 PolarHBondContact NH1-OD2 3.19Å; R338-D546 IonicContact NH2-OD2 3.43Å; L542-D546 PolarHBondContact O-N 3.08Å; I543-D546 PolarHBondContact O-N 3.39Å; D546-I548 VanDerWaalsContact C-N 3.32Å; D546-I548 PolarHBondContact O-N 3.34Å; D546-G549 CarbonylContact O-C 3.54Å; D546-G549 WeakPolarHBondContact O-CA 3.38Å; D546-G549 PolarHBondContact O-N 2.8Å; D546-T550 PolarHBondContact O-N 3.44Å; D546-T550 PolarHBondContact O-OG1 3.28Å
547	A	93.6	Very high	93.2	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-58.3	-38.6	176.3	0	0	0	0	0	113.4	C504 A508 I543 G549 L551	C504-A547 VanDerWaalsContact SG-CB 3.59Å; A508-A547 HydrophobicContact CB-CB 4.39Å; I543-A547 PolarHBondContact O-N 3.45Å; A547-G549 VanDerWaalsContact C-N 3.35Å; A547-L551 WeakPolarHBondContact O-CB 3.37Å; A547-L551 PolarHBondContact O-N 3.4Å
548	I	97.9	Very high	93.3	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-68.2	-37.1	175.4	-69.5	165.7	0	0	0	111.4	L529 F533 L544 Y545 D546 A552 L568 C592 V596	L529-I548 HydrophobicContact CB-CG1 4.32Å; L529-I548 HydrophobicContact CD1-CG1 3.99Å; F533-I548 HydrophobicContact CE2-CD1 3.38Å; F533-I548 HydrophobicContact CZ-CD1 3.44Å; F533-I548 VanDerWaalsContact CZ-CD1 3.44Å; L544-I548 HydrophobicContact CD1-CD1 4.22Å; L544-I548 HydrophobicContact CD1-CG1 4.47Å; L544-I548 HydrophobicContact CG-CD1 4.02Å; L544-I548 WeakPolarHBondContact O-CD1 3.47Å; L544-I548 VanDerWaalsContact O-CG1 3.25Å; L544-I548 WeakPolarHBondContact O-CG1 3.32Å; L544-I548 PolarHBondContact O-N 3.2Å; L544-I548 VanDerWaalsContact O-N 3.1Å; Y545-I548 PolarHBondContact O-N 3.32Å; D546-I548 VanDerWaalsContact C-N 3.32Å; D546-I548 PolarHBondContact O-N 3.34Å; I548-A552 WeakPolarHBondContact O-CB 3.21Å; I548-A552 PolarHBondContact O-N 2.92Å; I548-L568 HydrophobicContact CD1-CD1 4.15Å; I548-L568 HydrophobicContact CG2-CD1 3.93Å; I548-L568 HydrophobicContact CG2-CD2 4.13Å; I548-C592 VanDerWaalsContact CG2-SG 3.57Å; I548-V596 HydrophobicContact CG2-CG2 4.02Å
549	G	94.9	Very high	93.7	Very high	4 Å²	4	22.6 Å²	22.6	4%	0.041	12%	0.12	C	C	.	.	H	α-helix	trans	-61.1	-53.6	173.9	0	0	0	0	0	111	Y545 D546 A547 L551 A552 D553 S595	Y545-G549 PolarHBondContact O-N 3.37Å; D546-G549 CarbonylContact O-C 3.54Å; D546-G549 WeakPolarHBondContact O-CA 3.38Å; D546-G549 PolarHBondContact O-N 2.8Å; A547-G549 VanDerWaalsContact C-N 3.35Å; G549-L551 VanDerWaalsContact C-N 3.34Å; G549-L551 PolarHBondContact O-N 2.99Å; G549-A552 WeakPolarHBondContact O-CA 3.33Å; G549-A552 WeakPolarHBondContact O-CB 3.36Å; G549-A552 PolarHBondContact O-N 3.22Å; G549-D553 PolarHBondContact O-N 3.47Å; G549-S595 WeakPolarHBondContact O-CB 3.48Å
550	T	92.7	Very high	94.2	Very high	23 Å²	23	23.3 Å²	23.3	14%	0.141	13%	0.126	C	C	.	.	H	α-helix	trans	-56.8	-44.1	177	-57.1	0	0	0	0	112.2	A508 E511 E512 D546 A552 D553 S554	A508-T550 HydrophobicContact CB-CG2 4.43Å; E511-T550 HydrophobicContact CB-CG2 3.94Å; E512-T550 HydrophobicContact CG-CG2 3.51Å; E512-T550 WeakPolarHBondContact OE1-CG2 3.4Å; D546-T550 PolarHBondContact O-N 3.44Å; D546-T550 PolarHBondContact O-OG1 3.28Å; T550-A552 VanDerWaalsContact C-N 3.31Å; T550-A552 PolarHBondContact O-N 2.88Å; T550-D553 PolarHBondContact O-N 2.72Å; T550-S554 VanDerWaalsContact O-CB 3.23Å; T550-S554 WeakPolarHBondContact O-CB 3.45Å; T550-S554 PolarHBondContact O-N 3.01Å; T550-S554 PolarHBondContact O-OG 3.1Å
551	L	96.9	Very high	94.5	Very high	2 Å²	2	27 Å²	27	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-57.6	-45.1	173.3	-177.2	59.4	0	0	0	111.9	E511 L518 L522 I525 L526 L529 A547 G549 S554 V555	E511-L551 HydrophobicContact CG-CD1 4.26Å; E511-L551 WeakPolarHBondContact OE1-CB 3.44Å; E511-L551 WeakPolarHBondContact OE1-CD1 3.46Å; E511-L551 PolarHBondContact OE2-N 3.12Å; L518-L551 HydrophobicContact CD1-CD1 4.4Å; L522-L551 HydrophobicContact CD1-CD1 4.04Å; L522-L551 HydrophobicContact CD1-CD2 4.04Å; L522-L551 HydrophobicContact CD1-CG 4.25Å; I525-L551 HydrophobicContact CG2-CD1 4.32Å; I525-L551 HydrophobicContact CG2-CD2 3.75Å; L526-L551 HydrophobicContact CD2-CD2 3.97Å; L529-L551 HydrophobicContact CD1-CD2 3.77Å; A547-L551 WeakPolarHBondContact O-CB 3.37Å; A547-L551 PolarHBondContact O-N 3.4Å; G549-L551 VanDerWaalsContact C-N 3.34Å; G549-L551 PolarHBondContact O-N 2.99Å; L551-S554 PolarHBondContact O-N 3.02Å; L551-V555 HydrophobicContact CD1-CG1 3.85Å; L551-V555 WeakPolarHBondContact O-CG2 3.34Å; L551-V555 PolarHBondContact O-N 3.47Å
552	A	97.1	Very high	94.6	Very high	1 Å²	1	31 Å²	31	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-41.5	-178.9	0	0	0	0	0	111.6	I548 G549 T550 G556 L559 V596 A599	I548-A552 WeakPolarHBondContact O-CB 3.21Å; I548-A552 PolarHBondContact O-N 2.92Å; G549-A552 WeakPolarHBondContact O-CA 3.33Å; G549-A552 WeakPolarHBondContact O-CB 3.36Å; G549-A552 PolarHBondContact O-N 3.22Å; T550-A552 VanDerWaalsContact C-N 3.31Å; T550-A552 PolarHBondContact O-N 2.88Å; A552-G556 VanDerWaalsContact O-CA 3.25Å; A552-G556 WeakPolarHBondContact O-CA 3.44Å; A552-G556 PolarHBondContact O-N 3.25Å; A552-L559 HydrophobicContact CB-CD2 3.92Å; A552-V596 HydrophobicContact CB-CG2 3.97Å; A552-A599 HydrophobicContact CB-CB 3.95Å; A552-A599 WeakPolarHBondContact O-CB 3.09Å
553	D	91.3	Very high	94.9	Very high	101 Å²	101	35.9 Å²	35.9	54%	0.54	19%	0.191	S	C	.	.	H	α-helix	trans	-67.1	-40.4	175.8	-68.3	-32.4	0	0	0	111.6	G549 T550 S595	G549-D553 PolarHBondContact O-N 3.47Å; T550-D553 PolarHBondContact O-N 2.72Å; D553-S595 VanDerWaalsContact OD1-CB 3.23Å; D553-S595 WeakPolarHBondContact OD1-CB 3.32Å; D553-S595 PolarHBondContact OD1-OG 3.5Å; D553-S595 VanDerWaalsContact OD2-CB 3.29Å; D553-S595 WeakPolarHBondContact OD2-CB 3.44Å; D553-S595 PolarHBondContact OD2-OG 3.05Å
554	S	90.9	Very high	95.3	Very high	15 Å²	15	36.1 Å²	36.1	11%	0.105	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-44.4	-179.1	-64.9	0	0	0	0	113.7	E511 C515 T550 L551	E511-S554 VanDerWaalsContact C-OG 3.29Å; E511-S554 PolarHBondContact O-OG 3.19Å; E511-S554 VanDerWaalsContact O-OG 3.06Å; C515-S554 CarbonylContact C-O 3.48Å; T550-S554 VanDerWaalsContact O-CB 3.23Å; T550-S554 WeakPolarHBondContact O-CB 3.45Å; T550-S554 PolarHBondContact O-N 3.01Å; T550-S554 PolarHBondContact O-OG 3.1Å; L551-S554 PolarHBondContact O-N 3.02Å
555	V	94.8	Very high	95.4	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.018	20%	0.195	C	C	.	.	H	α-helix	trans	-94	-18	-178	-51.2	0	0	0	0	113.1	L518 V519 L522 L551 H557 H558 L559	L518-V555 HydrophobicContact CB-CG1 4.38Å; V519-V555 HydrophobicContact CG2-CB 4.17Å; V519-V555 HydrophobicContact CG2-CG1 4.3Å; L522-V555 HydrophobicContact CD1-CG1 4.34Å; L522-V555 HydrophobicContact CD1-CG2 4.35Å; L522-V555 HydrophobicContact CD2-CG2 4.17Å; L551-V555 HydrophobicContact CD1-CG1 3.85Å; L551-V555 WeakPolarHBondContact O-CG2 3.34Å; L551-V555 PolarHBondContact O-N 3.47Å; V555-H557 PolarHBondContact O-N 3.47Å; V555-H558 HydrophobicContact CB-CB 4.43Å; V555-H558 WeakPolarHBondContact O-CB 3.42Å; V555-H558 PolarHBondContact O-N 3.32Å; V555-H558 PolarHBondContact O-ND1 2.88Å; V555-L559 HydrophobicContact CG2-CB 3.91Å
556	G	94.1	Very high	95.4	Very high	20 Å²	20	43.5 Å²	43.5	21%	0.206	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	50.6	-132.6	-179.1	0	0	0	0	0	113.2	A552 H558 L559	A552-G556 VanDerWaalsContact O-CA 3.25Å; A552-G556 WeakPolarHBondContact O-CA 3.44Å; A552-G556 PolarHBondContact O-N 3.25Å; G556-H558 PolarHBondContact O-N 3.03Å; G556-L559 WeakPolarHBondContact O-CB 3.44Å; G556-L559 PolarHBondContact O-N 3.38Å
557	H	95	Very high	95.7	Very high	117 Å²	117	43.7 Å²	43.7	54%	0.542	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-59.8	-13.2	-175.8	70.9	-79.6	0	0	0	115.4	V555 L559 N560 A599	V555-H557 PolarHBondContact O-N 3.47Å; H557-L559 PolarHBondContact O-N 2.76Å; H557-N560 VanDerWaalsContact O-CB 3.29Å; H557-N560 WeakPolarHBondContact O-CB 2.98Å; H557-N560 PolarHBondContact O-N 2.91Å; H557-N560 VanDerWaalsContact O-N 3.08Å; H557-A599 WeakPolarHBondContact CA-O 3.36Å
558	H	96.9	Very high	95.9	Very high	63 Å²	63	43.8 Å²	43.8	29%	0.292	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-64.6	-22.5	173.5	-61.3	95.9	0	0	0	112.8	V519 V555 G556 N560	V519-H558 HydrophobicContact CG1-CB 4.06Å; V519-H558 HydrophobicContact CG2-CB 3.84Å; V555-H558 HydrophobicContact CB-CB 4.43Å; V555-H558 WeakPolarHBondContact O-CB 3.42Å; V555-H558 PolarHBondContact O-N 3.32Å; V555-H558 PolarHBondContact O-ND1 2.88Å; G556-H558 PolarHBondContact O-N 3.03Å; H558-N560 PolarHBondContact O-N 3.06Å
559	L	97.8	Very high	95.9	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.016	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-69.3	-21.5	173.8	-167.1	61.8	0	0	0	112.5	L522 L526 A552 V555 G556 H557 K561 Y564 L568 A599 L600	L522-L559 HydrophobicContact CD1-CD1 4.33Å; L522-L559 HydrophobicContact CD2-CD1 4.22Å; L526-L559 HydrophobicContact CD1-CD1 3.88Å; L526-L559 HydrophobicContact CD2-CD1 4.19Å; A552-L559 HydrophobicContact CB-CD2 3.92Å; V555-L559 HydrophobicContact CG2-CB 3.91Å; G556-L559 WeakPolarHBondContact O-CB 3.44Å; G556-L559 PolarHBondContact O-N 3.38Å; H557-L559 PolarHBondContact O-N 2.76Å; L559-K561 PolarHBondContact O-N 2.77Å; L559-Y564 HydrophobicContact CD1-CD2 4.47Å; L559-L568 HydrophobicContact CD2-CD2 4.27Å; L559-A599 HydrophobicContact CB-CB 4.42Å; L559-A599 HydrophobicContact CD2-CB 4.23Å; L559-L600 HydrophobicContact CB-CD2 4.2Å; L559-L600 HydrophobicContact CD2-CD2 4.23Å; L559-L600 HydrophobicContact CG-CD2 3.88Å; L559-L600 WeakPolarHBondContact O-CD2 3.31Å
560	N	97.8	Very high	96	Very high	50 Å²	50	47 Å²	47	27%	0.267	25%	0.247	S	C	.	.			trans	-75.8	65	-178	-170	9	0	0	0	112.6	H557 H558 L600	H557-N560 VanDerWaalsContact O-CB 3.29Å; H557-N560 WeakPolarHBondContact O-CB 2.98Å; H557-N560 PolarHBondContact O-N 2.91Å; H557-N560 VanDerWaalsContact O-N 3.08Å; H558-N560 PolarHBondContact O-N 3.06Å; N560-L600 HydrophobicContact CB-CD2 4.38Å; N560-L600 PolarHBondContact ND2-O 3.07Å; N560-L600 PolarHBondContact OD1-O 2.66Å
561	K	97.6	Very high	96.2	Very high	77 Å²	77	46.7 Å²	46.7	34%	0.335	25%	0.245	S	C	.	.			trans	-123.6	141.9	170.5	-59.3	-170.6	-161.2	161.2	0	110.4	L559 E563 Y564 I565	L559-K561 PolarHBondContact O-N 2.77Å; K561-E563 HydrophobicContact CB-CG 4.03Å; K561-E563 PolarHBondContact O-N 2.88Å; K561-E563 VanDerWaalsContact O-N 3.12Å; K561-Y564 HydrophobicContact CB-CD2 3.78Å; K561-Y564 HydrophobicContact CB-CE2 4.06Å; K561-Y564 HydrophobicContact CB-CG 4.29Å; K561-Y564 HydrophobicContact CD-CD2 4.09Å; K561-Y564 HydrophobicContact CD-CE2 3.49Å; K561-Y564 VanDerWaalsContact CD-CE2 3.49Å; K561-Y564 HydrophobicContact CG-CD2 4.04Å; K561-Y564 HydrophobicContact CG-CE2 3.93Å; K561-Y564 PolarHBondContact NZ-OH 3.44Å; K561-Y564 VanDerWaalsContact NZ-OH 3.15Å; K561-Y564 PolarHBondContact O-N 3.15Å; K561-Y564 VanDerWaalsContact O-N 3.07Å; K561-I565 WeakPolarHBondContact O-CG1 3.41Å; K561-I565 PolarHBondContact O-N 3.06Å
562	P	97.2	Very high	96.2	Very high	94 Å²	94	46.6 Å²	46.6	61%	0.61	25%	0.245	S	C	*	.	H	α-helix	trans	-54	-37	-178.7	-28	34.9	0	0	0	114.1	Q566	P562-Q566 VanDerWaalsContact O-CB 3.28Å; P562-Q566 WeakPolarHBondContact O-CB 3.3Å; P562-Q566 WeakPolarHBondContact O-CG 3.19Å; P562-Q566 PolarHBondContact O-N 2.85Å
563	E	97	Very high	96.1	Very high	113 Å²	113	48.5 Å²	48.5	53%	0.528	25%	0.254	S	S	.	.	H	α-helix	trans	-63.9	-43.4	178.3	56.9	-173.5	-167.3	0	0	112.9	K561 M567	K561-E563 HydrophobicContact CB-CG 4.03Å; K561-E563 PolarHBondContact O-N 2.88Å; K561-E563 VanDerWaalsContact O-N 3.12Å; E563-M567 PolarHBondContact O-N 3.37Å
564	Y	98.2	Very high	96.3	Very high	18 Å²	18	49.2 Å²	49.2	7%	0.071	25%	0.254	C	S	.	.	H	α-helix	trans	-73.5	-42.8	-179.9	-56.3	-25.9	0	0	0	111.3	L522 A523 L526 L559 K561 Q566 M567 L568	L522-Y564 HydrophobicContact CB-CE2 4.44Å; L522-Y564 HydrophobicContact CD2-CD2 3.8Å; L522-Y564 HydrophobicContact CD2-CE2 3.52Å; L522-Y564 HydrophobicContact CG-CD2 4.27Å; L522-Y564 HydrophobicContact CG-CE2 3.99Å; A523-Y564 HydrophobicContact CB-CE1 3.94Å; L526-Y564 HydrophobicContact CD1-CD1 3.54Å; L526-Y564 HydrophobicContact CD1-CD2 4.19Å; L526-Y564 HydrophobicContact CD1-CE1 4.36Å; L526-Y564 HydrophobicContact CD1-CG 3.49Å; L526-Y564 VanDerWaalsContact CD1-CG 3.49Å; L559-Y564 HydrophobicContact CD1-CD2 4.47Å; K561-Y564 HydrophobicContact CB-CD2 3.78Å; K561-Y564 HydrophobicContact CB-CE2 4.06Å; K561-Y564 HydrophobicContact CB-CG 4.29Å; K561-Y564 HydrophobicContact CD-CD2 4.09Å; K561-Y564 HydrophobicContact CD-CE2 3.49Å; K561-Y564 VanDerWaalsContact CD-CE2 3.49Å; K561-Y564 HydrophobicContact CG-CD2 4.04Å; K561-Y564 HydrophobicContact CG-CE2 3.93Å; K561-Y564 PolarHBondContact NZ-OH 3.44Å; K561-Y564 VanDerWaalsContact NZ-OH 3.15Å; K561-Y564 PolarHBondContact O-N 3.15Å; K561-Y564 VanDerWaalsContact O-N 3.07Å; Y564-Q566 VanDerWaalsContact C-N 3.34Å; Y564-Q566 PolarHBondContact O-N 2.92Å; Y564-M567 WeakPolarHBondContact O-CB 3.06Å; Y564-M567 PolarHBondContact O-N 2.98Å; Y564-M567 VanDerWaalsContact O-N 3.13Å; Y564-L568 WeakPolarHBondContact O-CB 3.19Å; Y564-L568 PolarHBondContact O-N 2.88Å
565	I	97.6	Very high	96.5	Very high	17 Å²	17	50.9 Å²	50.9	9%	0.087	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-44.8	177.6	-62.4	169.4	0	0	0	111	K561 M567 L568 M569 L600 Y607	K561-I565 WeakPolarHBondContact O-CG1 3.41Å; K561-I565 PolarHBondContact O-N 3.06Å; I565-M567 PolarHBondContact O-N 3.05Å; I565-L568 PolarHBondContact O-N 3.46Å; I565-M569 HydrophobicContact CG2-CG 3.81Å; I565-M569 WeakPolarHBondContact O-CB 3.1Å; I565-M569 WeakPolarHBondContact O-CG 3.42Å; I565-M569 PolarHBondContact O-N 3.15Å; I565-L600 HydrophobicContact CD1-CD2 4Å; I565-L600 HydrophobicContact CG1-CD1 3.96Å; I565-L600 HydrophobicContact CG1-CD2 3.57Å; I565-L600 HydrophobicContact CG1-CG 4.39Å; I565-Y607 HydrophobicContact CG2-CE2 3.9Å
566	Q	95.9	Very high	96.5	Very high	142 Å²	142	51.3 Å²	51.3	66%	0.664	26%	0.261	S	S	*	.	H	α-helix	trans	-66.7	-23.2	179.4	-74.5	171.4	25.8	0	0	113.1	P562 Y564 P570	P562-Q566 VanDerWaalsContact O-CB 3.28Å; P562-Q566 WeakPolarHBondContact O-CB 3.3Å; P562-Q566 WeakPolarHBondContact O-CG 3.19Å; P562-Q566 PolarHBondContact O-N 2.85Å; Y564-Q566 VanDerWaalsContact C-N 3.34Å; Y564-Q566 PolarHBondContact O-N 2.92Å; Q566-P570 WeakPolarHBondContact O-CD 3.32Å; Q566-P570 VanDerWaalsContact O-CG 3.28Å; Q566-P570 WeakPolarHBondContact O-CG 3.25Å
567	M	94.9	Very high	96.5	Very high	52 Å²	52	55.9 Å²	55.9	26%	0.256	28%	0.281	S	S	.	.	H	α-helix	trans	-85	-46.5	177.1	-165.5	-164.5	-72.2	0	0	111.7	L526 D527 V530 E563 Y564 I565 P571	L526-M567 HydrophobicContact CB-SD 3.82Å; D527-M567 WeakPolarHBondContact OD1-CE 3.38Å; D527-M567 VanDerWaalsContact OD1-SD 3.42Å; V530-M567 HydrophobicContact CB-CG 4.23Å; V530-M567 HydrophobicContact CB-SD 4.39Å; V530-M567 HydrophobicContact CG1-CG 4.11Å; V530-M567 HydrophobicContact CG2-CG 3.92Å; V530-M567 HydrophobicContact CG2-SD 4.13Å; E563-M567 PolarHBondContact O-N 3.37Å; Y564-M567 WeakPolarHBondContact O-CB 3.06Å; Y564-M567 PolarHBondContact O-N 2.98Å; Y564-M567 VanDerWaalsContact O-N 3.13Å; I565-M567 PolarHBondContact O-N 3.05Å; M567-P571 WeakPolarHBondContact O-CD 3.46Å
568	L	97.2	Very high	96.5	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-83.5	-40.2	-170.1	-176.4	62.4	0	0	0	114.1	L526 V530 I548 L559 Y564 I565 P571 L572 V596	L526-L568 HydrophobicContact CD2-CD1 4.5Å; L526-L568 HydrophobicContact CD2-CD2 4.4Å; V530-L568 HydrophobicContact CG2-CD1 4.21Å; I548-L568 HydrophobicContact CD1-CD1 4.15Å; I548-L568 HydrophobicContact CG2-CD1 3.93Å; I548-L568 HydrophobicContact CG2-CD2 4.13Å; L559-L568 HydrophobicContact CD2-CD2 4.27Å; Y564-L568 WeakPolarHBondContact O-CB 3.19Å; Y564-L568 PolarHBondContact O-N 2.88Å; I565-L568 PolarHBondContact O-N 3.46Å; L568-P571 WeakPolarHBondContact O-CD 3.21Å; L568-P571 VanDerWaalsContact O-CG 3.24Å; L568-P571 WeakPolarHBondContact O-CG 3.39Å; L568-L572 HydrophobicContact CD1-CD1 4.25Å; L568-L572 HydrophobicContact CG-CD1 3.95Å; L568-V596 HydrophobicContact CD2-CG1 4.49Å; L568-V596 HydrophobicContact CD2-CG2 4.32Å
569	M	97.4	Very high	96.4	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-38.4	-173.6	-67.5	-55.3	-55.8	0	0	114.5	I565 L572 I573 L593 V596 L600 F604 Y607	I565-M569 HydrophobicContact CG2-CG 3.81Å; I565-M569 WeakPolarHBondContact O-CB 3.1Å; I565-M569 WeakPolarHBondContact O-CG 3.42Å; I565-M569 PolarHBondContact O-N 3.15Å; M569-L572 PolarHBondContact O-N 3.02Å; M569-L572 HydrophobicContact SD-CD1 4.38Å; M569-I573 HydrophobicContact CE-CD1 4.13Å; M569-I573 HydrophobicContact CE-CG1 4.08Å; M569-I573 WeakPolarHBondContact O-CB 3.11Å; M569-I573 VanDerWaalsContact O-CG1 3.29Å; M569-I573 WeakPolarHBondContact O-CG1 3.44Å; M569-I573 PolarHBondContact O-N 2.77Å; M569-L593 HydrophobicContact CE-CD2 4.39Å; M569-V596 HydrophobicContact SD-CG1 4.05Å; M569-L600 HydrophobicContact CG-CD1 4.44Å; M569-L600 HydrophobicContact SD-CD1 4.03Å; M569-F604 HydrophobicContact CE-CD2 4.22Å; M569-F604 HydrophobicContact CE-CE2 3.49Å; M569-F604 VanDerWaalsContact CE-CE2 3.49Å; M569-F604 HydrophobicContact CE-CZ 4.13Å; M569-F604 HydrophobicContact SD-CD2 4.36Å; M569-F604 HydrophobicContact SD-CE2 3.99Å; M569-Y607 HydrophobicContact CB-CE1 3.85Å; M569-Y607 HydrophobicContact CB-CE2 4.16Å; M569-Y607 HydrophobicContact CE-CD1 4.02Å; M569-Y607 HydrophobicContact CE-CD2 3.94Å; M569-Y607 HydrophobicContact CE-CE1 4.41Å; M569-Y607 HydrophobicContact CE-CE2 4.36Å; M569-Y607 HydrophobicContact CE-CG 3.76Å; M569-Y607 HydrophobicContact CG-CD2 4.21Å; M569-Y607 HydrophobicContact CG-CE1 4.27Å; M569-Y607 HydrophobicContact CG-CE2 3.7Å
570	P	97.1	Very high	96.3	Very high	71 Å²	71	60.6 Å²	60.6	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-55.4	-50	179.6	-25.9	35	0	0	0	115.4	Q566 I573 Q574	Q566-P570 WeakPolarHBondContact O-CD 3.32Å; Q566-P570 VanDerWaalsContact O-CG 3.28Å; Q566-P570 WeakPolarHBondContact O-CG 3.25Å; P570-I573 PolarHBondContact O-N 3.31Å; P570-Q574 WeakPolarHBondContact O-CB 3.44Å; P570-Q574 PolarHBondContact O-N 3.32Å
571	P	97.2	Very high	96.1	Very high	18 Å²	18	59.9 Å²	59.9	12%	0.117	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-38	178	24.6	-34.2	0	0	0	113.2	V530 F533 M567 L568 Q574 K575	V530-P571 HydrophobicContact CG1-CG 4.36Å; F533-P571 HydrophobicContact CB-CB 4.12Å; F533-P571 HydrophobicContact CD1-CB 4.21Å; F533-P571 HydrophobicContact CD2-CB 3.66Å; F533-P571 HydrophobicContact CD2-CG 3.85Å; F533-P571 HydrophobicContact CE2-CB 4.08Å; F533-P571 HydrophobicContact CE2-CG 4.03Å; F533-P571 HydrophobicContact CG-CB 3.73Å; F533-P571 HydrophobicContact CG-CG 4.43Å; M567-P571 WeakPolarHBondContact O-CD 3.46Å; L568-P571 WeakPolarHBondContact O-CD 3.21Å; L568-P571 VanDerWaalsContact O-CG 3.24Å; L568-P571 WeakPolarHBondContact O-CG 3.39Å; P571-Q574 WeakPolarHBondContact O-CB 3.3Å; P571-Q574 PolarHBondContact O-N 3.33Å; P571-K575 WeakPolarHBondContact O-CG 3.28Å; P571-K575 PolarHBondContact O-N 3.35Å; P571-K575 VanDerWaalsContact O-N 3.14Å
572	L	96.9	Very high	95.8	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-47.7	175.7	-70.4	174.3	0	0	0	111.7	F533 Y545 L568 M569 Q574 K575 W576 L589 L593	F533-L572 HydrophobicContact CE1-CD2 4.4Å; F533-L572 HydrophobicContact CZ-CD2 3.75Å; F533-L572 HydrophobicContact CZ-CG 4.34Å; Y545-L572 HydrophobicContact CD1-CD2 4.05Å; Y545-L572 HydrophobicContact CE1-CD2 4.03Å; L568-L572 HydrophobicContact CD1-CD1 4.25Å; L568-L572 HydrophobicContact CG-CD1 3.95Å; M569-L572 PolarHBondContact O-N 3.02Å; M569-L572 HydrophobicContact SD-CD1 4.38Å; L572-Q574 VanDerWaalsContact C-N 3.29Å; L572-Q574 PolarHBondContact O-N 2.94Å; L572-K575 PolarHBondContact O-N 3.01Å; L572-W576 WeakPolarHBondContact O-CB 3.41Å; L572-W576 PolarHBondContact O-N 3.21Å; L572-L589 HydrophobicContact CD2-CD1 3.93Å; L572-L593 HydrophobicContact CB-CD2 4.46Å; L572-L593 HydrophobicContact CD1-CD2 4.22Å
573	I	95.3	Very high	95.6	Very high	40 Å²	40	60.9 Å²	60.9	21%	0.205	30%	0.297	C	S	.	.	H	α-helix	trans	-67.3	-31.9	178.5	-65.1	-63.3	0	0	0	111.7	M569 P570 K575 N577 Y607	M569-I573 HydrophobicContact CE-CD1 4.13Å; M569-I573 HydrophobicContact CE-CG1 4.08Å; M569-I573 WeakPolarHBondContact O-CB 3.11Å; M569-I573 VanDerWaalsContact O-CG1 3.29Å; M569-I573 WeakPolarHBondContact O-CG1 3.44Å; M569-I573 PolarHBondContact O-N 2.77Å; P570-I573 PolarHBondContact O-N 3.31Å; I573-K575 VanDerWaalsContact C-N 3.33Å; I573-N577 WeakPolarHBondContact CG2-ND2 2.8Å; I573-N577 PolarHBondContact O-N 3.35Å; I573-N577 VanDerWaalsContact O-N 3.13Å; I573-N577 PolarHBondContact O-ND2 3.47Å; I573-Y607 HydrophobicContact CD1-CD1 4.33Å; I573-Y607 HydrophobicContact CG1-CD1 4.18Å
574	Q	95.8	Very high	95.3	Very high	116 Å²	116	58.8 Å²	58.8	54%	0.542	29%	0.287	S	S	.	.	H	α-helix	trans	-60.3	-46.1	173.1	-179.8	180	-2.4	0	0	110.9	P570 P571 L572 Q578	P570-Q574 WeakPolarHBondContact O-CB 3.44Å; P570-Q574 PolarHBondContact O-N 3.32Å; P571-Q574 WeakPolarHBondContact O-CB 3.3Å; P571-Q574 PolarHBondContact O-N 3.33Å; L572-Q574 VanDerWaalsContact C-N 3.29Å; L572-Q574 PolarHBondContact O-N 2.94Å; Q574-Q578 VanDerWaalsContact O-CG 3.3Å; Q574-Q578 WeakPolarHBondContact O-CG 3.45Å; Q574-Q578 PolarHBondContact O-N 3.03Å
575	K	95	Very high	94.9	Very high	50 Å²	50	59 Å²	59	22%	0.217	29%	0.289	C	S	.	.	H	α-helix	trans	-69.3	-42.6	178.7	-68.1	-73.1	-177.6	172.8	0	112.3	L541 Y545 P571 L572 I573 N577 Q578 L579 L589	L541-K575 HydrophobicContact CD2-CD 3.91Å; L541-K575 VanDerWaalsContact CD2-CE 3.44Å; Y545-K575 VanDerWaalsContact OH-CB 3.24Å; Y545-K575 WeakPolarHBondContact OH-CB 3.48Å; Y545-K575 WeakPolarHBondContact OH-CG 3.43Å; P571-K575 WeakPolarHBondContact O-CG 3.28Å; P571-K575 PolarHBondContact O-N 3.35Å; P571-K575 VanDerWaalsContact O-N 3.14Å; L572-K575 PolarHBondContact O-N 3.01Å; I573-K575 VanDerWaalsContact C-N 3.33Å; K575-N577 VanDerWaalsContact C-N 3.27Å; K575-N577 PolarHBondContact O-N 3.26Å; K575-Q578 WeakPolarHBondContact O-CB 3.47Å; K575-Q578 PolarHBondContact O-N 3.41Å; K575-L579 PolarHBondContact O-N 3.46Å; K575-L579 VanDerWaalsContact O-N 3.16Å; K575-L589 HydrophobicContact CB-CD2 4.39Å
576	W	93.8	Very high	94.6	Very high	12 Å²	12	58.1 Å²	58.1	5%	0.045	28%	0.284	C	S	.	.	H	α-helix	trans	-49.2	-46.1	172.5	172.9	-98.6	0	0	0	113.5	L572 Q578 L589 L590 L593 V611 R614	L572-W576 WeakPolarHBondContact O-CB 3.41Å; L572-W576 PolarHBondContact O-N 3.21Å; W576-Q578 VanDerWaalsContact C-N 3.3Å; W576-Q578 PolarHBondContact O-N 3.47Å; W576-L589 HydrophobicContact CB-CD2 4.25Å; W576-L589 HydrophobicContact CE3-CD2 4.3Å; W576-L590 HydrophobicContact CE3-CD2 4.07Å; W576-L590 HydrophobicContact CH2-CD2 3.94Å; W576-L590 HydrophobicContact CZ3-CD2 3.22Å; W576-L590 HydrophobicContact CZ3-CG 4.23Å; W576-L593 HydrophobicContact CE3-CD1 3.97Å; W576-L593 HydrophobicContact CZ3-CD1 4.33Å; W576-V611 HydrophobicContact CH2-CG1 4.42Å; W576-V611 HydrophobicContact CZ2-CB 4.41Å; W576-V611 HydrophobicContact CZ2-CG2 4.22Å; W576-R614 HydrophobicContact CH2-CB 3.73Å; W576-R614 HydrophobicContact CH2-CG 3.99Å; W576-R614 HydrophobicContact CZ2-CB 3.54Å; W576-R614 HydrophobicContact CZ2-CG 3.99Å; W576-R614 PolarHBondContact O-NH1 3.09Å
577	N	94.5	Very high	94.4	Very high	117 Å²	117	51.4 Å²	51.4	63%	0.626	25%	0.253	S	S	*	.	H	α-helix	trans	-75.8	-16	-179.1	-69.2	-46.1	0	0	0	113.7	I573 K575	I573-N577 WeakPolarHBondContact CG2-ND2 2.8Å; I573-N577 PolarHBondContact O-N 3.35Å; I573-N577 VanDerWaalsContact O-N 3.13Å; I573-N577 PolarHBondContact O-ND2 3.47Å; K575-N577 VanDerWaalsContact C-N 3.27Å; K575-N577 PolarHBondContact O-N 3.26Å
578	Q	95	Very high	94.3	Very high	112 Å²	112	49 Å²	49	52%	0.523	24%	0.241	S	C	.	.	H	α-helix	trans	-85.9	-40	179.5	-73.8	171.6	5.3	0	0	112.2	Q574 K575 W576	Q574-Q578 VanDerWaalsContact O-CG 3.3Å; Q574-Q578 WeakPolarHBondContact O-CG 3.45Å; Q574-Q578 PolarHBondContact O-N 3.03Å; K575-Q578 WeakPolarHBondContact O-CB 3.47Å; K575-Q578 PolarHBondContact O-N 3.41Å; W576-Q578 VanDerWaalsContact C-N 3.3Å; W576-Q578 PolarHBondContact O-N 3.47Å
579	L	94.4	Very high	94.2	Very high	22 Å²	22	48.9 Å²	48.9	12%	0.115	24%	0.24	C	C	.	.	S	Bend	trans	-73.1	141.3	-176	-63.4	178.1	0	0	0	111.9	K575 D585 L586 L589 R614	K575-L579 PolarHBondContact O-N 3.46Å; K575-L579 VanDerWaalsContact O-N 3.16Å; L579-D585 HydrophobicContact CD1-CB 3.69Å; L579-D585 HydrophobicContact CD2-CB 3.66Å; L579-D585 HydrophobicContact CG-CB 4.32Å; L579-L586 HydrophobicContact CB-CD2 3.81Å; L579-L586 HydrophobicContact CB-CG 4.23Å; L579-L586 HydrophobicContact CD1-CD2 3.96Å; L579-L586 HydrophobicContact CD1-CG 4.42Å; L579-L589 HydrophobicContact CD1-CD2 3.78Å; L579-R614 PolarHBondContact O-NH2 3.43Å
580	K	95.9	Very high	94.1	Very high	147 Å²	147	48.8 Å²	48.8	64%	0.639	24%	0.24	S	C	*	.			trans	-87.7	167.2	174.1	-63.7	178	-172.8	163.8	0	110.8	E582 D583 L586	K580-E582 PolarHBondContact O-N 3.47Å; K580-D583 WeakPolarHBondContact O-CB 3.22Å; K580-D583 PolarHBondContact O-N 2.81Å; K580-L586 WeakPolarHBondContact O-CD1 3.37Å
581	D	94.1	Very high	93.8	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.193	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.2	-178.2	-73	-3.6	0	0	0	113.4	R614 L618 K621 F643	D581-R614 IonicContact OD1-CZ 3.02Å; D581-R614 IonicContact OD1-NE 3.6Å; D581-R614 PolarHBondContact OD1-NE 3.46Å; D581-R614 IonicContact OD1-NH2 2.82Å; D581-R614 PolarHBondContact OD1-NH2 3.46Å; D581-L618 HydrophobicContact CB-CD2 3.69Å; D581-K621 IonicContact OD2-NZ 3.03Å; D581-K621 PolarHBondContact OD2-NZ 3.48Å; D581-F643 WeakPolarHBondContact O-CD1 3.23Å; D581-F643 WeakPolarHBondContact O-CE1 3.32Å
582	E	91.9	Very high	93.7	Very high	134 Å²	134	47.6 Å²	47.6	63%	0.626	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	3.2	178.1	-50.7	78.3	-164.5	0	0	112.6	K580 F643	K580-E582 PolarHBondContact O-N 3.47Å; E582-F643 VanDerWaalsContact C-CZ 3.49Å
583	D	92.3	Very high	93.8	Very high	57 Å²	57	47.6 Å²	47.6	31%	0.305	23%	0.227	S	C	.	.			trans	-89.8	121.9	-175.4	-158.3	-30	0	0	0	110.9	K580 D585 L586 F643	K580-D583 WeakPolarHBondContact O-CB 3.22Å; K580-D583 PolarHBondContact O-N 2.81Å; D583-D585 PolarHBondContact O-N 3.48Å; D583-D585 PolarHBondContact OD1-N 2.66Å; D583-L586 VanDerWaalsContact O-CB 3.29Å; D583-L586 WeakPolarHBondContact O-CB 3.5Å; D583-L586 WeakPolarHBondContact O-CG 3.26Å; D583-L586 PolarHBondContact O-N 2.61Å; D583-L586 VanDerWaalsContact O-N 3.07Å; D583-F643 WeakPolarHBondContact O-CE1 3.33Å
584	K	90.1	Very high	93.7	Very high	70 Å²	70	46.3 Å²	46.3	30%	0.304	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.5	-176.4	-68.1	-165.1	169.4	-134.7	0	113.1	L586 F587 D640 F643	K584-L586 PolarHBondContact O-N 2.9Å; K584-F587 HydrophobicContact CB-CD2 4.34Å; K584-F587 HydrophobicContact CB-CE2 4.02Å; K584-F587 HydrophobicContact CB-CZ 4.38Å; K584-F587 HydrophobicContact CD-CE2 4.14Å; K584-F587 HydrophobicContact CG-CE2 3.96Å; K584-F587 HydrophobicContact CG-CZ 4.09Å; K584-F587 WeakPolarHBondContact O-CB 3.24Å; K584-F587 WeakPolarHBondContact O-CD2 3.26Å; K584-F587 VanDerWaalsContact O-CG 3.29Å; K584-F587 WeakPolarHBondContact O-CG 3.49Å; K584-F587 PolarHBondContact O-N 2.95Å; K584-D640 WeakPolarHBondContact CE-OD2 3.48Å; K584-D640 IonicContact NZ-OD2 3.17Å; K584-D640 PolarHBondContact NZ-OD2 2.95Å; K584-F643 HydrophobicContact CG-CZ 4.29Å
585	D	89.9	Confident	93.7	Very high	21 Å²	21	41.6 Å²	41.6	11%	0.112	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-17.9	169.4	-72.6	8.7	0	0	0	113.1	H538 L542 L579 D583 F587 P588	H538-D585 IonicContact CE1-OD1 2.76Å; H538-D585 PolarHBondContact CE1-OD1 2.99Å; H538-D585 IonicContact CE1-OD2 2.83Å; H538-D585 PolarHBondContact CE1-OD2 2.75Å; H538-D585 IonicContact ND1-OD2 2.75Å; H538-D585 PolarHBondContact ND1-OD2 3.42Å; H538-D585 IonicContact NE2-OD1 2.71Å; H538-D585 PolarHBondContact NE2-OD1 3.48Å; H538-D585 IonicContact NE2-OD2 2.72Å; L542-D585 HydrophobicContact CD2-CB 4.4Å; L579-D585 HydrophobicContact CD1-CB 3.69Å; L579-D585 HydrophobicContact CD2-CB 3.66Å; L579-D585 HydrophobicContact CG-CB 4.32Å; D583-D585 PolarHBondContact O-N 3.48Å; D583-D585 PolarHBondContact OD1-N 2.66Å; D585-F587 PolarHBondContact O-N 2.99Å; D585-P588 WeakPolarHBondContact O-CD 3.45Å
586	L	92.3	Very high	93.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-27.5	172.6	-76.8	-179	0	0	0	112.5	L579 K580 D583 K584 L590 F643	L579-L586 HydrophobicContact CB-CD2 3.81Å; L579-L586 HydrophobicContact CB-CG 4.23Å; L579-L586 HydrophobicContact CD1-CD2 3.96Å; L579-L586 HydrophobicContact CD1-CG 4.42Å; K580-L586 WeakPolarHBondContact O-CD1 3.37Å; D583-L586 VanDerWaalsContact O-CB 3.29Å; D583-L586 WeakPolarHBondContact O-CB 3.5Å; D583-L586 WeakPolarHBondContact O-CG 3.26Å; D583-L586 PolarHBondContact O-N 2.61Å; D583-L586 VanDerWaalsContact O-N 3.07Å; K584-L586 PolarHBondContact O-N 2.9Å; L586-L590 HydrophobicContact CB-CD1 4.37Å; L586-L590 WeakPolarHBondContact O-CB 3.32Å; L586-L590 WeakPolarHBondContact O-CG 3.23Å; L586-L590 PolarHBondContact O-N 3.12Å; L586-F643 HydrophobicContact CB-CE1 4.42Å; L586-F643 HydrophobicContact CD1-CD1 4.41Å; L586-F643 HydrophobicContact CD1-CE1 4.17Å
587	F	92.3	Very high	94	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-62.3	-176.2	-53.1	-20.7	0	0	0	111.8	R338 H340 K584 D585 L589 L590 E591 D642 F643 V646	R338-F587 WeakPolarHBondContact O-CD2 3.24Å; R338-F587 WeakPolarHBondContact O-CE2 3.44Å; H340-F587 HydrophobicContact CB-CB 4.33Å; H340-F587 HydrophobicContact CB-CD2 4.48Å; H340-F587 HydrophobicContact CB-CG 4.26Å; K584-F587 HydrophobicContact CB-CD2 4.34Å; K584-F587 HydrophobicContact CB-CE2 4.02Å; K584-F587 HydrophobicContact CB-CZ 4.38Å; K584-F587 HydrophobicContact CD-CE2 4.14Å; K584-F587 HydrophobicContact CG-CE2 3.96Å; K584-F587 HydrophobicContact CG-CZ 4.09Å; K584-F587 WeakPolarHBondContact O-CB 3.24Å; K584-F587 WeakPolarHBondContact O-CD2 3.26Å; K584-F587 VanDerWaalsContact O-CG 3.29Å; K584-F587 WeakPolarHBondContact O-CG 3.49Å; K584-F587 PolarHBondContact O-N 2.95Å; D585-F587 PolarHBondContact O-N 2.99Å; F587-L589 VanDerWaalsContact C-N 3.31Å; F587-L589 PolarHBondContact O-N 3.18Å; F587-L590 PolarHBondContact O-N 3.43Å; F587-E591 WeakPolarHBondContact O-CG 3.16Å; F587-E591 PolarHBondContact O-N 3.12Å; F587-D642 HydrophobicContact CE1-CB 3.95Å; F587-D642 HydrophobicContact CE2-CB 3.87Å; F587-D642 HydrophobicContact CZ-CB 3.5Å; F587-F643 HydrophobicContact CD1-CD1 4.5Å; F587-F643 HydrophobicContact CD1-CE1 4.48Å; F587-F643 AromaticContact CE1-CD1 3.64Å; F587-F643 HydrophobicContact CE1-CD1 3.64Å; F587-F643 AromaticContact CE1-CD2 3.97Å; F587-F643 HydrophobicContact CE1-CD2 3.97Å; F587-F643 AromaticContact CE1-CE1 3.65Å; F587-F643 HydrophobicContact CE1-CE1 3.65Å; F587-F643 AromaticContact CE1-CE2 4Å; F587-F643 HydrophobicContact CE1-CE2 4Å; F587-F643 AromaticContact CE1-CG 3.8Å; F587-F643 HydrophobicContact CE1-CG 3.8Å; F587-F643 AromaticContact CE1-CZ 3.83Å; F587-F643 HydrophobicContact CE1-CZ 3.83Å; F587-F643 HydrophobicContact CZ-CD1 4.44Å; F587-F643 HydrophobicContact CZ-CD2 4.04Å; F587-F643 HydrophobicContact CZ-CE1 4.24Å; F587-F643 AromaticContact CZ-CE2 3.84Å; F587-F643 HydrophobicContact CZ-CE2 3.84Å; F587-F643 HydrophobicContact CZ-CG 4.34Å; F587-F643 AromaticContact CZ-CZ 3.94Å; F587-F643 HydrophobicContact CZ-CZ 3.94Å; F587-V646 HydrophobicContact CD1-CG1 4.04Å
588	P	91.3	Very high	94	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-64.9	-34.6	-179.7	25.2	-34.9	0	0	0	112.6	L542 Y545 D585 L590 E591 C592	L542-P588 HydrophobicContact CB-CG 4.22Å; L542-P588 HydrophobicContact CD2-CG 3.77Å; L542-P588 HydrophobicContact CG-CG 4.48Å; Y545-P588 WeakPolarHBondContact CB-O 3.5Å; Y545-P588 HydrophobicContact CD2-CB 4.07Å; Y545-P588 HydrophobicContact CD2-CG 4.15Å; D585-P588 WeakPolarHBondContact O-CD 3.45Å; P588-L590 VanDerWaalsContact C-N 3.3Å; P588-L590 PolarHBondContact O-N 3.41Å; P588-E591 VanDerWaalsContact CA-OE2 3.32Å; P588-E591 WeakPolarHBondContact CA-OE2 3.43Å; P588-C592 WeakPolarHBondContact O-CB 2.94Å; P588-C592 PolarHBondContact O-N 3.3Å
589	L	95.3	Very high	94.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-38.4	175.5	177	62.8	0	0	0	111.8	Y545 L572 K575 W576 L579 F587 L593	Y545-L589 HydrophobicContact CD1-CD1 3.95Å; Y545-L589 HydrophobicContact CD2-CB 4.31Å; Y545-L589 HydrophobicContact CE1-CD1 3.55Å; Y545-L589 HydrophobicContact CE2-CB 4.19Å; L572-L589 HydrophobicContact CD2-CD1 3.93Å; K575-L589 HydrophobicContact CB-CD2 4.39Å; W576-L589 HydrophobicContact CB-CD2 4.25Å; W576-L589 HydrophobicContact CE3-CD2 4.3Å; L579-L589 HydrophobicContact CD1-CD2 3.78Å; F587-L589 VanDerWaalsContact C-N 3.31Å; F587-L589 PolarHBondContact O-N 3.18Å; L589-L593 HydrophobicContact CD1-CD1 4.33Å; L589-L593 HydrophobicContact CD1-CG 4.44Å; L589-L593 HydrophobicContact CG-CD1 4.24Å; L589-L593 WeakPolarHBondContact O-CB 3.32Å; L589-L593 VanDerWaalsContact O-CG 3.32Å; L589-L593 WeakPolarHBondContact O-CG 3.44Å; L589-L593 PolarHBondContact O-N 3.04Å
590	L	95.2	Very high	94.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-78.9	-36.9	-177.6	-75.8	-174.2	0	0	0	113.3	W576 L586 F587 P588 L593 S594 L618 V646 L650	W576-L590 HydrophobicContact CE3-CD2 4.07Å; W576-L590 HydrophobicContact CH2-CD2 3.94Å; W576-L590 HydrophobicContact CZ3-CD2 3.22Å; W576-L590 HydrophobicContact CZ3-CG 4.23Å; L586-L590 HydrophobicContact CB-CD1 4.37Å; L586-L590 WeakPolarHBondContact O-CB 3.32Å; L586-L590 WeakPolarHBondContact O-CG 3.23Å; L586-L590 PolarHBondContact O-N 3.12Å; F587-L590 PolarHBondContact O-N 3.43Å; P588-L590 VanDerWaalsContact C-N 3.3Å; P588-L590 PolarHBondContact O-N 3.41Å; L590-L593 HydrophobicContact CD2-CD1 4.19Å; L590-L593 PolarHBondContact O-N 3.03Å; L590-S594 WeakPolarHBondContact O-CB 3.48Å; L590-S594 PolarHBondContact O-N 2.95Å; L590-L618 HydrophobicContact CD1-CD1 4.37Å; L590-V646 HydrophobicContact CB-CG1 4.44Å; L590-V646 HydrophobicContact CB-CG2 3.46Å; L590-V646 VanDerWaalsContact CB-CG2 3.46Å; L590-V646 HydrophobicContact CD1-CG1 3.74Å; L590-V646 HydrophobicContact CD1-CG2 4.32Å; L590-L650 HydrophobicContact CD2-CD2 3.29Å; L590-L650 HydrophobicContact CG-CD2 4.42Å
591	E	91.6	Very high	94.2	Very high	61 Å²	61	25.6 Å²	25.6	29%	0.285	13%	0.129	S	C	.	.	H	α-helix	trans	-57.4	-50.8	168.6	-70.6	165.3	145.1	0	0	110	H340 F587 P588 L593 S594 S595 V646	H340-E591 IonicContact CE1-OE1 2.82Å; H340-E591 PolarHBondContact CE1-OE1 2.99Å; H340-E591 IonicContact CG-OE1 2.65Å; H340-E591 VanDerWaalsContact ND1-CD 3.33Å; H340-E591 WeakPolarHBondContact ND1-CG 3.45Å; H340-E591 IonicContact ND1-OE1 3.87Å; H340-E591 PolarHBondContact ND1-OE1 3.18Å; F587-E591 WeakPolarHBondContact O-CG 3.16Å; F587-E591 PolarHBondContact O-N 3.12Å; P588-E591 VanDerWaalsContact CA-OE2 3.32Å; P588-E591 WeakPolarHBondContact CA-OE2 3.43Å; E591-L593 PolarHBondContact O-N 3.41Å; E591-S594 WeakPolarHBondContact O-CA 3.32Å; E591-S594 WeakPolarHBondContact O-CB 3.34Å; E591-S594 PolarHBondContact O-N 3.31Å; E591-S595 PolarHBondContact O-N 2.99Å; E591-V646 HydrophobicContact CG-CG2 4.11Å
592	C	95.9	Very high	94.3	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.014	14%	0.142	C	C	.	.	H	α-helix	trans	-54.9	-47.6	174.5	176.4	0	0	0	0	112.6	Y545 I548 P588 S594 S595 V596	Y545-C592 WeakPolarHBondContact O-CB 3.46Å; Y545-C592 PolarHBondContact O-SG 2.95Å; I548-C592 VanDerWaalsContact CG2-SG 3.57Å; P588-C592 WeakPolarHBondContact O-CB 2.94Å; P588-C592 PolarHBondContact O-N 3.3Å; C592-S594 PolarHBondContact O-N 3.46Å; C592-S595 PolarHBondContact O-N 3.03Å; C592-V596 WeakPolarHBondContact O-CB 3.45Å; C592-V596 VanDerWaalsContact O-CG2 3.25Å; C592-V596 WeakPolarHBondContact O-CG2 3.28Å; C592-V596 PolarHBondContact O-N 3.38Å
593	L	97.4	Very high	94.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.2	-26.9	177.2	-77.4	172.5	0	0	0	112.9	M569 L572 W576 L589 L590 E591 A597 F604 L650	M569-L593 HydrophobicContact CE-CD2 4.39Å; L572-L593 HydrophobicContact CB-CD2 4.46Å; L572-L593 HydrophobicContact CD1-CD2 4.22Å; W576-L593 HydrophobicContact CE3-CD1 3.97Å; W576-L593 HydrophobicContact CZ3-CD1 4.33Å; L589-L593 HydrophobicContact CD1-CD1 4.33Å; L589-L593 HydrophobicContact CD1-CG 4.44Å; L589-L593 HydrophobicContact CG-CD1 4.24Å; L589-L593 WeakPolarHBondContact O-CB 3.32Å; L589-L593 VanDerWaalsContact O-CG 3.32Å; L589-L593 WeakPolarHBondContact O-CG 3.44Å; L589-L593 PolarHBondContact O-N 3.04Å; L590-L593 HydrophobicContact CD2-CD1 4.19Å; L590-L593 PolarHBondContact O-N 3.03Å; E591-L593 PolarHBondContact O-N 3.41Å; L593-A597 WeakPolarHBondContact O-CB 3.36Å; L593-A597 PolarHBondContact O-N 3.45Å; L593-F604 HydrophobicContact CD2-CE2 4.3Å; L593-F604 HydrophobicContact CD2-CZ 4.25Å; L593-L650 HydrophobicContact CB-CD1 4.02Å
594	S	94.5	Very high	94.7	Very high	13 Å²	13	18.8 Å²	18.8	9%	0.091	11%	0.106	C	C	.	.	H	α-helix	trans	-66.3	-51.1	176.5	-166.1	0	0	0	0	110.8	L590 E591 C592 A597 T598 D649	L590-S594 WeakPolarHBondContact O-CB 3.48Å; L590-S594 PolarHBondContact O-N 2.95Å; E591-S594 WeakPolarHBondContact O-CA 3.32Å; E591-S594 WeakPolarHBondContact O-CB 3.34Å; E591-S594 PolarHBondContact O-N 3.31Å; C592-S594 PolarHBondContact O-N 3.46Å; S594-A597 PolarHBondContact O-N 3.07Å; S594-T598 PolarHBondContact O-N 3.46Å; S594-T598 VanDerWaalsContact O-N 3.13Å; S594-T598 PolarHBondContact O-OG1 2.75Å; S594-D649 PolarHBondContact OG-O 3.03Å
595	S	95.3	Very high	95	Very high	18 Å²	18	18.6 Å²	18.6	13%	0.126	11%	0.108	C	C	.	.	H	α-helix	trans	-62.9	-46.1	175.5	-57.3	0	0	0	0	111.5	G549 D553 E591 C592 A597 T598 A599	G549-S595 WeakPolarHBondContact O-CB 3.48Å; D553-S595 VanDerWaalsContact OD1-CB 3.23Å; D553-S595 WeakPolarHBondContact OD1-CB 3.32Å; D553-S595 PolarHBondContact OD1-OG 3.5Å; D553-S595 VanDerWaalsContact OD2-CB 3.29Å; D553-S595 WeakPolarHBondContact OD2-CB 3.44Å; D553-S595 PolarHBondContact OD2-OG 3.05Å; E591-S595 PolarHBondContact O-N 2.99Å; C592-S595 PolarHBondContact O-N 3.03Å; S595-A597 PolarHBondContact O-N 3.42Å; S595-T598 PolarHBondContact O-N 3.35Å; S595-A599 WeakPolarHBondContact O-CB 3.31Å; S595-A599 PolarHBondContact O-N 3.03Å
596	V	97.8	Very high	95.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.2	-41.6	178	171	0	0	0	0	112	I548 A552 L568 M569 C592 T598 A599 L600 F604	I548-V596 HydrophobicContact CG2-CG2 4.02Å; A552-V596 HydrophobicContact CB-CG2 3.97Å; L568-V596 HydrophobicContact CD2-CG1 4.49Å; L568-V596 HydrophobicContact CD2-CG2 4.32Å; M569-V596 HydrophobicContact SD-CG1 4.05Å; C592-V596 WeakPolarHBondContact O-CB 3.45Å; C592-V596 VanDerWaalsContact O-CG2 3.25Å; C592-V596 WeakPolarHBondContact O-CG2 3.28Å; C592-V596 PolarHBondContact O-N 3.38Å; V596-T598 VanDerWaalsContact C-N 3.33Å; V596-T598 PolarHBondContact O-N 3.21Å; V596-A599 PolarHBondContact O-N 2.94Å; V596-L600 HydrophobicContact CG1-CD1 3.68Å; V596-L600 HydrophobicContact CG1-CG 4.03Å; V596-L600 VanDerWaalsContact O-CB 3.26Å; V596-L600 WeakPolarHBondContact O-CB 3.21Å; V596-L600 VanDerWaalsContact O-CG 3.24Å; V596-L600 WeakPolarHBondContact O-CG 3.3Å; V596-L600 PolarHBondContact O-N 3.4Å; V596-F604 HydrophobicContact CG1-CE2 4.38Å
597	A	97.2	Very high	95.6	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-62.7	-41.5	177.3	0	0	0	0	0	111.8	L593 S594 S595 Q601 F604 L654	L593-A597 WeakPolarHBondContact O-CB 3.36Å; L593-A597 PolarHBondContact O-N 3.45Å; S594-A597 PolarHBondContact O-N 3.07Å; S595-A597 PolarHBondContact O-N 3.42Å; A597-Q601 PolarHBondContact O-N 3.21Å; A597-F604 HydrophobicContact CB-CD1 4.09Å; A597-F604 HydrophobicContact CB-CD2 4.22Å; A597-F604 HydrophobicContact CB-CE1 4.22Å; A597-F604 HydrophobicContact CB-CE2 4.32Å; A597-F604 HydrophobicContact CB-CG 4.1Å; A597-F604 HydrophobicContact CB-CZ 4.33Å; A597-L654 HydrophobicContact CB-CD2 3.93Å
598	T	94.8	Very high	95.8	Very high	28 Å²	28	25.6 Å²	25.6	17%	0.172	15%	0.148	C	C	.	.	H	α-helix	trans	-64.8	-46.9	177.5	-55	0	0	0	0	111.2	S594 S595 V596 Q601 G653 E656	S594-T598 PolarHBondContact O-N 3.46Å; S594-T598 VanDerWaalsContact O-N 3.13Å; S594-T598 PolarHBondContact O-OG1 2.75Å; S595-T598 PolarHBondContact O-N 3.35Å; V596-T598 VanDerWaalsContact C-N 3.33Å; V596-T598 PolarHBondContact O-N 3.21Å; T598-Q601 VanDerWaalsContact O-CG 3.27Å; T598-Q601 WeakPolarHBondContact O-CG 3.42Å; T598-Q601 PolarHBondContact O-N 3.31Å; T598-G653 WeakPolarHBondContact OG1-CA 3.47Å; T598-G653 PolarHBondContact OG1-O 3.1Å; T598-E656 HydrophobicContact CG2-CG 4.05Å
599	A	96.1	Very high	96.1	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.041	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-40.8	178.3	0	0	0	0	0	113.1	A552 H557 L559 S595 V596 Q601	A552-A599 HydrophobicContact CB-CB 3.95Å; A552-A599 WeakPolarHBondContact O-CB 3.09Å; H557-A599 WeakPolarHBondContact CA-O 3.36Å; L559-A599 HydrophobicContact CB-CB 4.42Å; L559-A599 HydrophobicContact CD2-CB 4.23Å; S595-A599 WeakPolarHBondContact O-CB 3.31Å; S595-A599 PolarHBondContact O-N 3.03Å; V596-A599 PolarHBondContact O-N 2.94Å; A599-Q601 VanDerWaalsContact C-N 3.34Å
600	L	97.5	Very high	96.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-77.3	-19.6	-179.1	-68.5	-171.7	0	0	0	113.5	L559 N560 I565 M569 V596 S602 G603 F604	L559-L600 HydrophobicContact CB-CD2 4.2Å; L559-L600 HydrophobicContact CD2-CD2 4.23Å; L559-L600 HydrophobicContact CG-CD2 3.88Å; L559-L600 WeakPolarHBondContact O-CD2 3.31Å; N560-L600 HydrophobicContact CB-CD2 4.38Å; N560-L600 PolarHBondContact ND2-O 3.07Å; N560-L600 PolarHBondContact OD1-O 2.66Å; I565-L600 HydrophobicContact CD1-CD2 4Å; I565-L600 HydrophobicContact CG1-CD1 3.96Å; I565-L600 HydrophobicContact CG1-CD2 3.57Å; I565-L600 HydrophobicContact CG1-CG 4.39Å; M569-L600 HydrophobicContact CG-CD1 4.44Å; M569-L600 HydrophobicContact SD-CD1 4.03Å; V596-L600 HydrophobicContact CG1-CD1 3.68Å; V596-L600 HydrophobicContact CG1-CG 4.03Å; V596-L600 VanDerWaalsContact O-CB 3.26Å; V596-L600 WeakPolarHBondContact O-CB 3.21Å; V596-L600 VanDerWaalsContact O-CG 3.24Å; V596-L600 WeakPolarHBondContact O-CG 3.3Å; V596-L600 PolarHBondContact O-N 3.4Å; L600-S602 PolarHBondContact O-N 3.31Å; L600-G603 VanDerWaalsContact O-CA 3.32Å; L600-G603 WeakPolarHBondContact O-CA 3.41Å; L600-G603 PolarHBondContact O-N 3.46Å; L600-F604 HydrophobicContact CB-CB 4.12Å; L600-F604 HydrophobicContact CD1-CD2 4.07Å
601	Q	95.9	Very high	96.4	Very high	88 Å²	88	35.1 Å²	35.1	41%	0.411	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	48.5	-128	-179.5	-57.7	178.4	-24.2	0	0	111.8	A597 T598 A599 G603 F604 G657 L658	A597-Q601 PolarHBondContact O-N 3.21Å; T598-Q601 VanDerWaalsContact O-CG 3.27Å; T598-Q601 WeakPolarHBondContact O-CG 3.42Å; T598-Q601 PolarHBondContact O-N 3.31Å; A599-Q601 VanDerWaalsContact C-N 3.34Å; Q601-G603 PolarHBondContact O-N 2.69Å; Q601-F604 WeakPolarHBondContact O-CB 3.35Å; Q601-F604 PolarHBondContact O-N 2.91Å; Q601-G657 CarbonylContact C-O 3.35Å; Q601-G657 WeakPolarHBondContact CA-O 3.24Å; Q601-G657 WeakPolarHBondContact CB-O 3.01Å; Q601-L658 WeakPolarHBondContact O-CD2 3.42Å
602	S	95	Very high	96.7	Very high	68 Å²	68	32.5 Å²	32.5	48%	0.476	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-59.2	-18.7	175.4	61.7	0	0	0	0	114.5	L600 F604 L605	L600-S602 PolarHBondContact O-N 3.31Å; S602-F604 PolarHBondContact O-N 2.91Å; S602-L605 WeakPolarHBondContact O-CB 3.26Å; S602-L605 VanDerWaalsContact O-CD1 3.31Å; S602-L605 WeakPolarHBondContact O-CD1 3.39Å; S602-L605 WeakPolarHBondContact O-CG 3.44Å; S602-L605 PolarHBondContact O-N 3Å
603	G	96.6	Very high	96.8	Very high	16 Å²	16	37 Å²	37	17%	0.165	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-63.6	-23	172.9	0	0	0	0	0	113.2	L600 Q601 L605 P606	L600-G603 VanDerWaalsContact O-CA 3.32Å; L600-G603 WeakPolarHBondContact O-CA 3.41Å; L600-G603 PolarHBondContact O-N 3.46Å; Q601-G603 PolarHBondContact O-N 2.69Å; G603-L605 VanDerWaalsContact C-N 3.33Å; G603-P606 VanDerWaalsContact O-CD 3.29Å; G603-P606 WeakPolarHBondContact O-CD 3.31Å
604	F	97.8	Very high	96.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-80.9	-8.9	177.8	-158.1	-98.1	0	0	0	113.9	M569 L593 V596 A597 L600 Q601 S602 P606 Y607 C608 V611 L654 L658	M569-F604 HydrophobicContact CE-CD2 4.22Å; M569-F604 HydrophobicContact CE-CE2 3.49Å; M569-F604 VanDerWaalsContact CE-CE2 3.49Å; M569-F604 HydrophobicContact CE-CZ 4.13Å; M569-F604 HydrophobicContact SD-CD2 4.36Å; M569-F604 HydrophobicContact SD-CE2 3.99Å; L593-F604 HydrophobicContact CD2-CE2 4.3Å; L593-F604 HydrophobicContact CD2-CZ 4.25Å; V596-F604 HydrophobicContact CG1-CE2 4.38Å; A597-F604 HydrophobicContact CB-CD1 4.09Å; A597-F604 HydrophobicContact CB-CD2 4.22Å; A597-F604 HydrophobicContact CB-CE1 4.22Å; A597-F604 HydrophobicContact CB-CE2 4.32Å; A597-F604 HydrophobicContact CB-CG 4.1Å; A597-F604 HydrophobicContact CB-CZ 4.33Å; L600-F604 HydrophobicContact CB-CB 4.12Å; L600-F604 HydrophobicContact CD1-CD2 4.07Å; Q601-F604 WeakPolarHBondContact O-CB 3.35Å; Q601-F604 PolarHBondContact O-N 2.91Å; S602-F604 PolarHBondContact O-N 2.91Å; F604-P606 VanDerWaalsContact C-N 3.33Å; F604-P606 VanDerWaalsContact O-N 3.15Å; F604-Y607 HydrophobicContact CD2-CD2 4.4Å; F604-Y607 PolarHBondContact O-N 3.41Å; F604-C608 HydrophobicContact CD1-CB 4.05Å; F604-C608 HydrophobicContact CE1-CB 4.43Å; F604-C608 PolarHBondContact O-N 2.85Å; F604-V611 HydrophobicContact CE1-CB 4.48Å; F604-V611 HydrophobicContact CE1-CG2 4.23Å; F604-V611 HydrophobicContact CZ-CG2 4.26Å; F604-L654 HydrophobicContact CD1-CD2 3.66Å; F604-L654 HydrophobicContact CE1-CD2 3.6Å; F604-L658 HydrophobicContact CB-CD2 4.3Å
605	L	96.1	Very high	97	Very high	66 Å²	66	37.8 Å²	37.8	35%	0.346	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-39	-177.6	-74.6	171.3	0	0	0	115.7	S602 G603 Y607 C608 L658 T661	S602-L605 WeakPolarHBondContact O-CB 3.26Å; S602-L605 VanDerWaalsContact O-CD1 3.31Å; S602-L605 WeakPolarHBondContact O-CD1 3.39Å; S602-L605 WeakPolarHBondContact O-CG 3.44Å; S602-L605 PolarHBondContact O-N 3Å; G603-L605 VanDerWaalsContact C-N 3.33Å; L605-Y607 PolarHBondContact O-N 3.42Å; L605-Y607 VanDerWaalsContact O-N 3.11Å; L605-C608 PolarHBondContact O-SG 3.17Å; L605-L658 HydrophobicContact CD2-CD2 3.72Å; L605-L658 HydrophobicContact CG-CD2 4.01Å; L605-T661 HydrophobicContact CD1-CG2 4.08Å; L605-T661 HydrophobicContact CD2-CG2 3.33Å; L605-T661 HydrophobicContact CG-CG2 4.35Å
606	P	97.7	Very high	97.2	Very high	102 Å²	102	37 Å²	37	66%	0.662	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.8	178.3	-23	35.6	0	0	0	114.4	G603 F604	G603-P606 VanDerWaalsContact O-CD 3.29Å; G603-P606 WeakPolarHBondContact O-CD 3.31Å; F604-P606 VanDerWaalsContact C-N 3.33Å; F604-P606 VanDerWaalsContact O-N 3.15Å
607	Y	97.4	Very high	97.2	Very high	57 Å²	57	40 Å²	40	22%	0.224	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-14.2	-172.1	-47.6	-78.7	0	0	0	113	I565 M569 I573 F604 L605 E609 P610 V611	I565-Y607 HydrophobicContact CG2-CE2 3.9Å; M569-Y607 HydrophobicContact CB-CE1 3.85Å; M569-Y607 HydrophobicContact CB-CE2 4.16Å; M569-Y607 HydrophobicContact CE-CD1 4.02Å; M569-Y607 HydrophobicContact CE-CD2 3.94Å; M569-Y607 HydrophobicContact CE-CE1 4.41Å; M569-Y607 HydrophobicContact CE-CE2 4.36Å; M569-Y607 HydrophobicContact CE-CG 3.76Å; M569-Y607 HydrophobicContact CG-CD2 4.21Å; M569-Y607 HydrophobicContact CG-CE1 4.27Å; M569-Y607 HydrophobicContact CG-CE2 3.7Å; I573-Y607 HydrophobicContact CD1-CD1 4.33Å; I573-Y607 HydrophobicContact CG1-CD1 4.18Å; F604-Y607 HydrophobicContact CD2-CD2 4.4Å; F604-Y607 PolarHBondContact O-N 3.41Å; L605-Y607 PolarHBondContact O-N 3.42Å; L605-Y607 VanDerWaalsContact O-N 3.11Å; Y607-E609 PolarHBondContact O-N 2.87Å; Y607-P610 WeakPolarHBondContact O-CD 3.45Å; Y607-P610 WeakPolarHBondContact O-CG 2.83Å; Y607-V611 VanDerWaalsContact O-CG2 3.28Å; Y607-V611 WeakPolarHBondContact O-CG2 3.49Å
608	C	96	Very high	97.2	Very high	11 Å²	11	40.2 Å²	40.2	7%	0.074	22%	0.219	C	C	.	.	H	α-helix	trans	-70.3	-35.2	-165.5	66.3	0	0	0	0	115.2	F604 L605 V611 Y612 L654 L658	F604-C608 HydrophobicContact CD1-CB 4.05Å; F604-C608 HydrophobicContact CE1-CB 4.43Å; F604-C608 PolarHBondContact O-N 2.85Å; L605-C608 PolarHBondContact O-SG 3.17Å; C608-V611 PolarHBondContact O-N 3.38Å; C608-Y612 VanDerWaalsContact O-CB 3.24Å; C608-Y612 WeakPolarHBondContact O-CB 3.35Å; C608-Y612 PolarHBondContact O-N 2.93Å; C608-L654 HydrophobicContact CB-CD2 4.25Å; C608-L658 HydrophobicContact CB-CD1 3.57Å
609	E	97.4	Very high	97.4	Very high	126 Å²	126	38.9 Å²	38.9	59%	0.589	21%	0.211	S	C	*	.	H	α-helix	trans	-60.6	-52.2	-175.2	-175.8	170.8	-161.3	0	0	113.6	Y607 V611 Q613 L665	Y607-E609 PolarHBondContact O-N 2.87Å; E609-V611 VanDerWaalsContact C-N 3.32Å; E609-V611 PolarHBondContact O-N 3.47Å; E609-Q613 WeakPolarHBondContact O-CB 3.25Å; E609-Q613 PolarHBondContact O-N 3.04Å; E609-Q613 VanDerWaalsContact O-N 3.07Å; E609-L665 HydrophobicContact CB-CD2 4.18Å; E609-L665 HydrophobicContact CG-CD2 3.99Å
610	P	97.6	Very high	97.5	Very high	74 Å²	74	42.9 Å²	42.9	48%	0.481	23%	0.229	S	C	.	.	H	α-helix	trans	-66.2	-33.4	176.7	25.4	-34.8	0	0	0	113.1	Y607 R614	Y607-P610 WeakPolarHBondContact O-CD 3.45Å; Y607-P610 WeakPolarHBondContact O-CG 2.83Å; P610-R614 PolarHBondContact O-N 3.18Å; P610-R614 VanDerWaalsContact O-N 3.14Å
611	V	97.8	Very high	97.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-53.7	178	177.4	0	0	0	0	110	W576 F604 Y607 C608 E609 Q613 R614 C615 L650 L654	W576-V611 HydrophobicContact CH2-CG1 4.42Å; W576-V611 HydrophobicContact CZ2-CB 4.41Å; W576-V611 HydrophobicContact CZ2-CG2 4.22Å; F604-V611 HydrophobicContact CE1-CB 4.48Å; F604-V611 HydrophobicContact CE1-CG2 4.23Å; F604-V611 HydrophobicContact CZ-CG2 4.26Å; Y607-V611 VanDerWaalsContact O-CG2 3.28Å; Y607-V611 WeakPolarHBondContact O-CG2 3.49Å; C608-V611 PolarHBondContact O-N 3.38Å; E609-V611 VanDerWaalsContact C-N 3.32Å; E609-V611 PolarHBondContact O-N 3.47Å; V611-Q613 VanDerWaalsContact C-N 3.35Å; V611-Q613 PolarHBondContact O-N 2.93Å; V611-R614 PolarHBondContact O-N 3.41Å; V611-C615 PolarHBondContact O-N 2.91Å; V611-C615 VanDerWaalsContact O-N 3.15Å; V611-C615 PolarHBondContact O-SG 2.88Å; V611-L650 HydrophobicContact CG1-CD1 4.29Å; V611-L650 HydrophobicContact CG1-CD2 3.41Å; V611-L650 VanDerWaalsContact CG1-CD2 3.41Å; V611-L650 HydrophobicContact CG1-CG 4.08Å; V611-L654 HydrophobicContact CG1-CD1 3.96Å
612	Y	98.4	Very high	97.6	Very high	6 Å²	6	43.4 Å²	43.4	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-55.7	-47.2	177.2	-177.1	-89.2	0	0	0	112.2	C608 R614 C615 V616 L651 L654 I662 L665 V666 S669 I671	C608-Y612 VanDerWaalsContact O-CB 3.24Å; C608-Y612 WeakPolarHBondContact O-CB 3.35Å; C608-Y612 PolarHBondContact O-N 2.93Å; Y612-R614 VanDerWaalsContact C-N 3.33Å; Y612-R614 PolarHBondContact O-N 3.17Å; Y612-C615 PolarHBondContact O-N 2.97Å; Y612-V616 HydrophobicContact CD1-CG2 4.14Å; Y612-V616 HydrophobicContact CE1-CG2 3.78Å; Y612-V616 WeakPolarHBondContact O-CG2 3.27Å; Y612-V616 PolarHBondContact O-N 2.96Å; Y612-V616 VanDerWaalsContact O-N 3.09Å; Y612-L651 HydrophobicContact CD2-CD2 3.28Å; Y612-L651 HydrophobicContact CE2-CD2 3.5Å; Y612-L651 VanDerWaalsContact CE2-CD2 3.5Å; Y612-L651 HydrophobicContact CG-CD2 3.97Å; Y612-L654 HydrophobicContact CD2-CD1 4.32Å; Y612-I662 HydrophobicContact CD2-CD1 4.08Å; Y612-I662 HydrophobicContact CD2-CG1 4.37Å; Y612-I662 HydrophobicContact CE2-CD1 4.02Å; Y612-I662 HydrophobicContact CE2-CG1 4.28Å; Y612-L665 HydrophobicContact CD1-CB 3.88Å; Y612-L665 HydrophobicContact CD2-CB 4.3Å; Y612-L665 HydrophobicContact CD2-CD1 4.4Å; Y612-L665 HydrophobicContact CE1-CB 3.84Å; Y612-L665 HydrophobicContact CE2-CB 4.29Å; Y612-L665 HydrophobicContact CG-CB 4.11Å; Y612-L665 HydrophobicContact CG-CD1 4.12Å; Y612-V666 HydrophobicContact CE2-CG2 4.41Å; Y612-V666 WeakPolarHBondContact OH-CA 3.4Å; Y612-S669 PolarHBondContact OH-OG 2.9Å; Y612-I671 WeakPolarHBondContact OH-CG2 3.42Å
613	Q	98.2	Very high	97.7	Very high	96 Å²	96	40.6 Å²	40.6	45%	0.449	21%	0.21	S	C	.	.	H	α-helix	trans	-63.7	-38	-178.1	-173.1	61.4	51.6	0	0	112.4	E609 V611 N617	E609-Q613 WeakPolarHBondContact O-CB 3.25Å; E609-Q613 PolarHBondContact O-N 3.04Å; E609-Q613 VanDerWaalsContact O-N 3.07Å; V611-Q613 VanDerWaalsContact C-N 3.35Å; V611-Q613 PolarHBondContact O-N 2.93Å; Q613-N617 PolarHBondContact NE2-OD1 3.39Å; Q613-N617 VanDerWaalsContact NE2-OD1 3.15Å; Q613-N617 WeakPolarHBondContact O-CB 3.34Å; Q613-N617 PolarHBondContact O-N 2.85Å; Q613-N617 VanDerWaalsContact O-N 3.11Å; Q613-N617 PolarHBondContact O-ND2 3.41Å
614	R	98.3	Very high	97.7	Very high	31 Å²	31	42.1 Å²	42.1	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-44.4	178.2	-165	-175.6	-168.1	168.5	-0.1	111.2	W576 L579 D581 P610 V611 Y612 V616 N617 L618	W576-R614 HydrophobicContact CH2-CB 3.73Å; W576-R614 HydrophobicContact CH2-CG 3.99Å; W576-R614 HydrophobicContact CZ2-CB 3.54Å; W576-R614 HydrophobicContact CZ2-CG 3.99Å; W576-R614 PolarHBondContact O-NH1 3.09Å; L579-R614 PolarHBondContact O-NH2 3.43Å; D581-R614 IonicContact OD1-CZ 3.02Å; D581-R614 IonicContact OD1-NE 3.6Å; D581-R614 PolarHBondContact OD1-NE 3.46Å; D581-R614 IonicContact OD1-NH2 2.82Å; D581-R614 PolarHBondContact OD1-NH2 3.46Å; P610-R614 PolarHBondContact O-N 3.18Å; P610-R614 VanDerWaalsContact O-N 3.14Å; V611-R614 PolarHBondContact O-N 3.41Å; Y612-R614 VanDerWaalsContact C-N 3.33Å; Y612-R614 PolarHBondContact O-N 3.17Å; R614-V616 PolarHBondContact O-N 3.37Å; R614-N617 WeakPolarHBondContact O-CB 3.49Å; R614-N617 PolarHBondContact O-N 3.45Å; R614-N617 VanDerWaalsContact O-N 3.15Å; R614-L618 HydrophobicContact CG-CD1 4.48Å; R614-L618 WeakPolarHBondContact O-CG 3.4Å; R614-L618 PolarHBondContact O-N 2.86Å
615	C	98.4	Very high	97.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-47.6	177.6	-65.5	0	0	0	0	112.3	V611 Y612 N617 L618 V619 A647 L650 L651	V611-C615 PolarHBondContact O-N 2.91Å; V611-C615 VanDerWaalsContact O-N 3.15Å; V611-C615 PolarHBondContact O-SG 2.88Å; Y612-C615 PolarHBondContact O-N 2.97Å; C615-N617 VanDerWaalsContact C-N 3.25Å; C615-N617 PolarHBondContact O-N 3.5Å; C615-L618 PolarHBondContact O-N 2.72Å; C615-L618 VanDerWaalsContact O-N 3.17Å; C615-V619 WeakPolarHBondContact O-CG2 3.45Å; C615-V619 PolarHBondContact O-N 2.96Å; C615-A647 HydrophobicContact CB-CB 3.94Å; C615-L650 WeakPolarHBondContact SG-CD2 3.43Å; C615-L651 HydrophobicContact CB-CD1 3.81Å; C615-L651 HydrophobicContact CB-CD2 3.86Å; C615-L651 HydrophobicContact CB-CG 3.56Å
616	V	98.6	Very high	97.4	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-40.1	176	174.7	0	0	0	0	111.2	Y612 R614 Q620 L651 I671 L674	Y612-V616 HydrophobicContact CD1-CG2 4.14Å; Y612-V616 HydrophobicContact CE1-CG2 3.78Å; Y612-V616 WeakPolarHBondContact O-CG2 3.27Å; Y612-V616 PolarHBondContact O-N 2.96Å; Y612-V616 VanDerWaalsContact O-N 3.09Å; R614-V616 PolarHBondContact O-N 3.37Å; V616-Q620 WeakPolarHBondContact O-CB 2.98Å; V616-Q620 PolarHBondContact O-N 2.93Å; V616-L651 HydrophobicContact CG2-CD1 4.24Å; V616-L651 HydrophobicContact CG2-CD2 4.25Å; V616-I671 HydrophobicContact CG2-CD1 4.45Å; V616-L674 HydrophobicContact CG1-CD1 3.95Å
617	N	98.3	Very high	97.2	Very high	64 Å²	64	44.3 Å²	44.3	34%	0.342	23%	0.226	S	C	.	.	H	α-helix	trans	-67.1	-39.9	177.6	-71.6	-20.9	0	0	0	112.8	Q613 R614 C615 Q620 K621	Q613-N617 PolarHBondContact NE2-OD1 3.39Å; Q613-N617 VanDerWaalsContact NE2-OD1 3.15Å; Q613-N617 WeakPolarHBondContact O-CB 3.34Å; Q613-N617 PolarHBondContact O-N 2.85Å; Q613-N617 VanDerWaalsContact O-N 3.11Å; Q613-N617 PolarHBondContact O-ND2 3.41Å; R614-N617 WeakPolarHBondContact O-CB 3.49Å; R614-N617 PolarHBondContact O-N 3.45Å; R614-N617 VanDerWaalsContact O-N 3.15Å; C615-N617 VanDerWaalsContact C-N 3.25Å; C615-N617 PolarHBondContact O-N 3.5Å; N617-Q620 PolarHBondContact O-N 2.74Å; N617-K621 WeakPolarHBondContact O-CB 3.48Å; N617-K621 VanDerWaalsContact O-CG 3.3Å; N617-K621 WeakPolarHBondContact O-CG 3.27Å; N617-K621 PolarHBondContact O-N 3.27Å
618	L	98	Very high	97.1	Very high	5 Å²	5	45 Å²	45	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-52.8	176.5	-74.5	171.4	0	0	0	110.4	D581 L590 R614 C615 Q620 K621 T622 A647	D581-L618 HydrophobicContact CB-CD2 3.69Å; L590-L618 HydrophobicContact CD1-CD1 4.37Å; R614-L618 HydrophobicContact CG-CD1 4.48Å; R614-L618 WeakPolarHBondContact O-CG 3.4Å; R614-L618 PolarHBondContact O-N 2.86Å; C615-L618 PolarHBondContact O-N 2.72Å; C615-L618 VanDerWaalsContact O-N 3.17Å; L618-Q620 VanDerWaalsContact C-N 3.29Å; L618-Q620 PolarHBondContact O-N 3.18Å; L618-K621 PolarHBondContact O-N 3.06Å; L618-K621 VanDerWaalsContact O-N 3.14Å; L618-T622 PolarHBondContact O-N 3.21Å; L618-T622 PolarHBondContact O-OG1 3.15Å; L618-T622 VanDerWaalsContact O-OG1 3.08Å; L618-A647 HydrophobicContact CB-CB 4.02Å; L618-A647 HydrophobicContact CD1-CB 4.26Å
619	V	98.4	Very high	96.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-53.8	-47.4	176	176.4	0	0	0	0	110.9	C615 K621 T622 L623 M644 A647 L648 L674	C615-V619 WeakPolarHBondContact O-CG2 3.45Å; C615-V619 PolarHBondContact O-N 2.96Å; V619-K621 PolarHBondContact O-N 3.27Å; V619-T622 PolarHBondContact O-N 3.46Å; V619-L623 HydrophobicContact CG1-CD1 3.92Å; V619-L623 WeakPolarHBondContact O-CB 3.39Å; V619-L623 WeakPolarHBondContact O-CG 3.4Å; V619-L623 PolarHBondContact O-N 3.35Å; V619-L623 VanDerWaalsContact O-N 3.07Å; V619-M644 HydrophobicContact CB-CG 4.37Å; V619-M644 HydrophobicContact CG1-CG 4.1Å; V619-M644 HydrophobicContact CG1-SD 4.25Å; V619-M644 HydrophobicContact CG2-CG 4.14Å; V619-A647 HydrophobicContact CG2-CB 3.89Å; V619-L648 HydrophobicContact CG2-CD2 4.05Å; V619-L648 HydrophobicContact CG2-CG 3.99Å; V619-L674 HydrophobicContact CB-CD1 4.45Å; V619-L674 HydrophobicContact CG1-CB 4.09Å; V619-L674 HydrophobicContact CG1-CD1 4.16Å
620	Q	98.3	Very high	96.6	Very high	88 Å²	88	47.6 Å²	47.6	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-63.8	-41.4	-179.9	-176.2	173	-38.6	0	0	113	V616 N617 L618 A624 N670 L674	V616-Q620 WeakPolarHBondContact O-CB 2.98Å; V616-Q620 PolarHBondContact O-N 2.93Å; N617-Q620 PolarHBondContact O-N 2.74Å; L618-Q620 VanDerWaalsContact C-N 3.29Å; L618-Q620 PolarHBondContact O-N 3.18Å; Q620-A624 WeakPolarHBondContact O-CB 3.32Å; Q620-A624 PolarHBondContact O-N 2.84Å; Q620-A624 VanDerWaalsContact O-N 3.12Å; Q620-N670 PolarHBondContact OE1-ND2 3.47Å; Q620-L674 HydrophobicContact CB-CD1 4.07Å; Q620-L674 HydrophobicContact CB-CD2 4.23Å; Q620-L674 HydrophobicContact CG-CD2 4.32Å
621	K	97.1	Very high	96.4	Very high	93 Å²	93	47.7 Å²	47.7	40%	0.404	25%	0.246	S	C	.	.	H	α-helix	trans	-65.9	-47.2	178.3	-77.3	175.4	178.4	-178.5	0	111.2	D581 N617 L618 V619 L623 A624 Q625	D581-K621 IonicContact OD2-NZ 3.03Å; D581-K621 PolarHBondContact OD2-NZ 3.48Å; N617-K621 WeakPolarHBondContact O-CB 3.48Å; N617-K621 VanDerWaalsContact O-CG 3.3Å; N617-K621 WeakPolarHBondContact O-CG 3.27Å; N617-K621 PolarHBondContact O-N 3.27Å; L618-K621 PolarHBondContact O-N 3.06Å; L618-K621 VanDerWaalsContact O-N 3.14Å; V619-K621 PolarHBondContact O-N 3.27Å; K621-L623 PolarHBondContact O-N 2.79Å; K621-A624 PolarHBondContact O-N 3.41Å; K621-Q625 WeakPolarHBondContact O-CG 3.26Å; K621-Q625 PolarHBondContact O-N 3.02Å
622	T	97.6	Very high	96.1	Very high	7 Å²	7	51.6 Å²	51.6	4%	0.043	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-45	-179	-56.9	0	0	0	0	111.3	L618 V619 A624 Q625 A626 P639 K641 M644	L618-T622 PolarHBondContact O-N 3.21Å; L618-T622 PolarHBondContact O-OG1 3.15Å; L618-T622 VanDerWaalsContact O-OG1 3.08Å; V619-T622 PolarHBondContact O-N 3.46Å; T622-A624 PolarHBondContact O-N 2.97Å; T622-Q625 PolarHBondContact O-N 2.95Å; T622-A626 WeakPolarHBondContact O-CB 3.49Å; T622-A626 PolarHBondContact O-N 2.79Å; T622-P639 HydrophobicContact CG2-CB 4.18Å; T622-P639 HydrophobicContact CG2-CG 4.45Å; T622-K641 HydrophobicContact CG2-CG 4.33Å; T622-M644 HydrophobicContact CG2-CB 3.83Å; T622-M644 HydrophobicContact CG2-CE 4.27Å; T622-M644 HydrophobicContact CG2-SD 4.48Å
623	L	97.2	Very high	95.7	Very high	10 Å²	10	54.7 Å²	54.7	5%	0.052	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-43.3	174.8	-72.9	170.1	0	0	0	112.1	V619 K621 A626 M627 M644 L674 Q677	V619-L623 HydrophobicContact CG1-CD1 3.92Å; V619-L623 WeakPolarHBondContact O-CB 3.39Å; V619-L623 WeakPolarHBondContact O-CG 3.4Å; V619-L623 PolarHBondContact O-N 3.35Å; V619-L623 VanDerWaalsContact O-N 3.07Å; K621-L623 PolarHBondContact O-N 2.79Å; L623-A626 PolarHBondContact O-N 3.39Å; L623-M627 WeakPolarHBondContact O-CG 3.48Å; L623-M627 PolarHBondContact O-N 2.83Å; L623-M627 VanDerWaalsContact O-N 3.09Å; L623-M644 HydrophobicContact CD1-SD 4.43Å; L623-M644 HydrophobicContact CD2-CE 4.49Å; L623-M644 HydrophobicContact CD2-SD 3.8Å; L623-M644 HydrophobicContact CG-SD 3.78Å; L623-L674 HydrophobicContact CD1-CB 4.33Å; L623-L674 HydrophobicContact CD1-CD2 4.1Å; L623-Q677 HydrophobicContact CD1-CB 4.17Å; L623-Q677 HydrophobicContact CD2-CB 4.24Å
624	A	96.2	Very high	95.1	Very high	47 Å²	47	58.1 Å²	58.1	39%	0.388	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-42.4	178.1	0	0	0	0	0	112.2	Q620 K621 T622 M627 L628	Q620-A624 WeakPolarHBondContact O-CB 3.32Å; Q620-A624 PolarHBondContact O-N 2.84Å; Q620-A624 VanDerWaalsContact O-N 3.12Å; K621-A624 PolarHBondContact O-N 3.41Å; T622-A624 PolarHBondContact O-N 2.97Å; A624-M627 PolarHBondContact O-N 2.8Å; A624-L628 WeakPolarHBondContact O-CG 3.5Å; A624-L628 PolarHBondContact O-N 3.1Å
625	Q	94.9	Very high	94.6	Very high	99 Å²	99	63.3 Å²	63.3	46%	0.463	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-40.6	175.4	-73	171.8	-16.6	0	0	111.8	K621 T622 M627 L628 H629 P639	K621-Q625 WeakPolarHBondContact O-CG 3.26Å; K621-Q625 PolarHBondContact O-N 3.02Å; T622-Q625 PolarHBondContact O-N 2.95Å; Q625-M627 VanDerWaalsContact C-N 3.32Å; Q625-M627 PolarHBondContact O-N 2.97Å; Q625-L628 PolarHBondContact O-N 2.96Å; Q625-H629 PolarHBondContact O-N 2.99Å; Q625-P639 HydrophobicContact CB-CB 3.81Å; Q625-P639 HydrophobicContact CB-CG 4.09Å
626	A	94.6	Very high	94.1	Very high	23 Å²	23	67.9 Å²	67.9	19%	0.19	35%	0.35	C	S	.	.	H	α-helix	trans	-62.2	-41	177.8	0	0	0	0	0	111.5	T622 L623 Q630 P639	T622-A626 WeakPolarHBondContact O-CB 3.49Å; T622-A626 PolarHBondContact O-N 2.79Å; L623-A626 PolarHBondContact O-N 3.39Å; A626-Q630 WeakPolarHBondContact O-CB 3.21Å; A626-Q630 PolarHBondContact O-N 3.42Å; A626-P639 HydrophobicContact CB-CG 3.79Å
627	M	93.6	Very high	93.6	Very high	92 Å²	92	76.2 Å²	76.2	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-65.6	-39.8	174.8	-67.8	179.8	-169.3	0	0	112.4	L623 A624 Q625 Q630 S631 Q677	L623-M627 WeakPolarHBondContact O-CG 3.48Å; L623-M627 PolarHBondContact O-N 2.83Å; L623-M627 VanDerWaalsContact O-N 3.09Å; A624-M627 PolarHBondContact O-N 2.8Å; Q625-M627 VanDerWaalsContact C-N 3.32Å; Q625-M627 PolarHBondContact O-N 2.97Å; M627-Q630 PolarHBondContact O-N 2.97Å; M627-S631 PolarHBondContact O-N 3.46Å; M627-S631 PolarHBondContact O-OG 2.96Å; M627-Q677 VanDerWaalsContact CE-OE1 3.22Å
628	L	93.9	Very high	93.2	Very high	73 Å²	73	78.2 Å²	78.2	38%	0.382	40%	0.403	S	S	.	.	H	α-helix	trans	-63.1	-48.8	176.1	-72.9	172.2	0	0	0	111.3	A624 Q625 Q630 S631 Q632 Y636	A624-L628 WeakPolarHBondContact O-CG 3.5Å; A624-L628 PolarHBondContact O-N 3.1Å; Q625-L628 PolarHBondContact O-N 2.96Å; L628-Q630 PolarHBondContact O-N 2.74Å; L628-S631 PolarHBondContact O-N 3.44Å; L628-S631 VanDerWaalsContact O-N 3.13Å; L628-S631 PolarHBondContact O-OG 3.39Å; L628-Q632 PolarHBondContact O-N 2.98Å; L628-Y636 HydrophobicContact CB-CD1 4.23Å; L628-Y636 HydrophobicContact CB-CD2 3.95Å; L628-Y636 HydrophobicContact CB-CE2 4.25Å; L628-Y636 HydrophobicContact CB-CG 3.94Å; L628-Y636 HydrophobicContact CD1-CD1 4.39Å; L628-Y636 HydrophobicContact CD1-CE1 4.14Å; L628-Y636 HydrophobicContact CD2-CE2 4.34Å
629	H	92.9	Very high	93	Very high	50 Å²	50	78.6 Å²	78.6	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-57.4	-46.9	174.5	175.9	73.1	0	0	0	111.7	Q625 S631 Q632 P633 Y636 V638	Q625-H629 PolarHBondContact O-N 2.99Å; H629-S631 PolarHBondContact O-N 2.76Å; H629-Q632 CarbonylContact O-C 3.42Å; H629-Q632 VanDerWaalsContact O-C 3.28Å; H629-Q632 PolarHBondContact O-N 3.03Å; H629-P633 VanDerWaalsContact O-CA 3.26Å; H629-P633 WeakPolarHBondContact O-CA 3.29Å; H629-P633 VanDerWaalsContact O-CD 3.29Å; H629-P633 WeakPolarHBondContact O-CD 3.18Å; H629-P633 VanDerWaalsContact O-CG 3.31Å; H629-P633 WeakPolarHBondContact O-CG 3.43Å; H629-Y636 PolarHBondContact ND1-O 3.28Å; H629-V638 VanDerWaalsContact CE1-CG2 3.49Å; H629-V638 WeakPolarHBondContact CE1-CG2 3.49Å; H629-V638 WeakPolarHBondContact NE2-CG2 3.29Å
630	Q	91.1	Very high	92.8	Very high	140 Å²	140	81 Å²	81	65%	0.654	42%	0.419	S	S	*	.	H	α-helix	trans	-59.3	-34.2	178	-171.9	178.9	15.4	0	0	112.6	A626 M627 L628	A626-Q630 WeakPolarHBondContact O-CB 3.21Å; A626-Q630 PolarHBondContact O-N 3.42Å; M627-Q630 PolarHBondContact O-N 2.97Å; L628-Q630 PolarHBondContact O-N 2.74Å
631	S	92.7	Very high	92.6	Very high	77 Å²	77	78.6 Å²	78.6	54%	0.538	41%	0.407	S	S	.	.	H	α-helix	trans	-80.1	-33.9	178.9	75.2	0	0	0	0	113.7	M627 L628 H629	M627-S631 PolarHBondContact O-N 3.46Å; M627-S631 PolarHBondContact O-OG 2.96Å; L628-S631 PolarHBondContact O-N 3.44Å; L628-S631 VanDerWaalsContact O-N 3.13Å; L628-S631 PolarHBondContact O-OG 3.39Å; H629-S631 PolarHBondContact O-N 2.76Å
632	Q	92.4	Very high	92.5	Very high	82 Å²	82	75.1 Å²	75.1	38%	0.383	39%	0.393	S	S	.	.			trans	-143.9	74.4	-175.4	-64.3	179.6	4	0	0	110.8	L628 H629 D634 Q635 Y636	L628-Q632 PolarHBondContact O-N 2.98Å; H629-Q632 CarbonylContact O-C 3.42Å; H629-Q632 VanDerWaalsContact O-C 3.28Å; H629-Q632 PolarHBondContact O-N 3.03Å; Q632-D634 PolarHBondContact O-N 3.1Å; Q632-Q635 HydrophobicContact CB-CB 4.28Å; Q632-Q635 PolarHBondContact O-N 3.4Å; Q632-Q635 VanDerWaalsContact O-N 3.1Å; Q632-Y636 HydrophobicContact CB-CD2 4.03Å; Q632-Y636 HydrophobicContact CB-CE2 4.28Å; Q632-Y636 PolarHBondContact O-N 3.42Å
633	P	88.4	Confident	92.4	Very high	70 Å²	70	75.6 Å²	75.6	46%	0.455	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28.8	-173.5	-23.5	32.9	0	0	0	114	H629 Q635	H629-P633 VanDerWaalsContact O-CA 3.26Å; H629-P633 WeakPolarHBondContact O-CA 3.29Å; H629-P633 VanDerWaalsContact O-CD 3.29Å; H629-P633 WeakPolarHBondContact O-CD 3.18Å; H629-P633 VanDerWaalsContact O-CG 3.31Å; H629-P633 WeakPolarHBondContact O-CG 3.43Å; P633-Q635 VanDerWaalsContact C-N 3.3Å; P633-Q635 PolarHBondContact O-N 2.85Å
634	D	86.5	Confident	92.3	Very high	168 Å²	168	75.1 Å²	75.1	90%	0.898	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.4	-178.9	-56	-41.8	0	0	0	113.6	Q632	Q632-D634 PolarHBondContact O-N 3.1Å
635	Q	87.6	Confident	92.3	Very high	140 Å²	140	73 Å²	73	65%	0.654	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-28.6	-175.7	-67.8	-174.8	40.1	0	0	113.8	Q632 P633	Q632-Q635 HydrophobicContact CB-CB 4.28Å; Q632-Q635 PolarHBondContact O-N 3.4Å; Q632-Q635 VanDerWaalsContact O-N 3.1Å; P633-Q635 VanDerWaalsContact C-N 3.3Å; P633-Q635 PolarHBondContact O-N 2.85Å
636	Y	87.9	Confident	92.3	Very high	96 Å²	96	68.4 Å²	68.4	38%	0.376	35%	0.353	S	S	.	.	S	Bend	trans	-121.2	134.9	-177.6	-62.8	-80.8	0	0	0	109.5	L628 H629 Q632	L628-Y636 HydrophobicContact CB-CD1 4.23Å; L628-Y636 HydrophobicContact CB-CD2 3.95Å; L628-Y636 HydrophobicContact CB-CE2 4.25Å; L628-Y636 HydrophobicContact CB-CG 3.94Å; L628-Y636 HydrophobicContact CD1-CD1 4.39Å; L628-Y636 HydrophobicContact CD1-CE1 4.14Å; L628-Y636 HydrophobicContact CD2-CE2 4.34Å; H629-Y636 PolarHBondContact ND1-O 3.28Å; Q632-Y636 HydrophobicContact CB-CD2 4.03Å; Q632-Y636 HydrophobicContact CB-CE2 4.28Å; Q632-Y636 PolarHBondContact O-N 3.42Å
637	E	88.8	Confident	92.5	Very high	177 Å²	177	67.3 Å²	67.3	83%	0.827	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-72.9	157	175.3	-65.8	176.9	176.5	0	0	110.9
638	V	89.4	Confident	92.7	Very high	105 Å²	105	62.9 Å²	62.9	64%	0.636	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-64.7	126.2	171.8	-179.2	0	0	0	0	107.6	H629	H629-V638 VanDerWaalsContact CE1-CG2 3.49Å; H629-V638 WeakPolarHBondContact CE1-CG2 3.49Å; H629-V638 WeakPolarHBondContact NE2-CG2 3.29Å
639	P	93.6	Very high	92.8	Very high	13 Å²	13	59.8 Å²	59.8	8%	0.084	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-71.2	145.1	176.5	31.6	-36.5	0	0	0	110.6	T622 Q625 A626 K641	T622-P639 HydrophobicContact CG2-CB 4.18Å; T622-P639 HydrophobicContact CG2-CG 4.45Å; Q625-P639 HydrophobicContact CB-CB 3.81Å; Q625-P639 HydrophobicContact CB-CG 4.09Å; A626-P639 HydrophobicContact CB-CG 3.79Å; P639-K641 PolarHBondContact O-N 3.13Å
640	D	93.4	Very high	93.1	Very high	51 Å²	51	57.4 Å²	57.4	27%	0.273	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-71.1	116.4	168.8	-167.1	-21.4	0	0	0	109	K584 D642 F643	K584-D640 WeakPolarHBondContact CE-OD2 3.48Å; K584-D640 IonicContact NZ-OD2 3.17Å; K584-D640 PolarHBondContact NZ-OD2 2.95Å; D640-D642 VanDerWaalsContact C-N 3.33Å; D640-D642 WeakPolarHBondContact OD1-CB 3.32Å; D640-D642 PolarHBondContact OD1-N 3.41Å; D640-D642 VanDerWaalsContact OD1-N 3.13Å; D640-F643 HydrophobicContact CB-CD2 4.01Å; D640-F643 HydrophobicContact CB-CE2 4.16Å
641	K	95.4	Very high	93.4	Very high	38 Å²	38	50.8 Å²	50.8	17%	0.165	26%	0.264	C	S	.	.	S	Bend	trans	-83.3	-11.7	-174.2	-70.5	-167.7	-178.6	-166.6	0	112.7	T622 P639 F643 M644 I645 D681 M683 V686	T622-K641 HydrophobicContact CG2-CG 4.33Å; P639-K641 PolarHBondContact O-N 3.13Å; K641-F643 PolarHBondContact O-N 3.33Å; K641-M644 HydrophobicContact CB-CE 4.29Å; K641-M644 HydrophobicContact CD-CE 4.08Å; K641-M644 HydrophobicContact CG-CE 4.17Å; K641-M644 WeakPolarHBondContact O-CA 3.34Å; K641-M644 WeakPolarHBondContact O-CB 3.34Å; K641-M644 PolarHBondContact O-N 2.64Å; K641-I645 WeakPolarHBondContact O-CG1 3.34Å; K641-I645 PolarHBondContact O-N 2.68Å; K641-D681 IonicContact NZ-OD1 3.32Å; K641-D681 PolarHBondContact NZ-OD1 3.48Å; K641-D681 IonicContact NZ-OD2 3.95Å; K641-D681 PolarHBondContact NZ-OD2 2.88Å; K641-M683 HydrophobicContact CB-CE 4.18Å; K641-M683 HydrophobicContact CB-SD 3.53Å; K641-M683 VanDerWaalsContact CB-SD 3.53Å; K641-M683 HydrophobicContact CD-CB 4.2Å; K641-M683 HydrophobicContact CD-CE 4.13Å; K641-M683 HydrophobicContact CD-SD 3.68Å; K641-M683 HydrophobicContact CG-SD 4.17Å; K641-V686 HydrophobicContact CB-CG2 4.3Å; K641-V686 HydrophobicContact CD-CG2 4.14Å
642	D	93.4	Very high	93.7	Very high	19 Å²	19	47.1 Å²	47.1	10%	0.102	24%	0.238	C	C	.	.	H	α-helix	trans	-60.5	-36.4	177.9	-69	3.4	0	0	0	111.4	F339 H340 F587 D640 M644 I645 V646	F339-D642 WeakPolarHBondContact CA-OD2 3.41Å; F339-D642 WeakPolarHBondContact CB-OD2 3.44Å; F339-D642 VanDerWaalsContact CD1-OD2 3.32Å; F339-D642 WeakPolarHBondContact CD1-OD2 3.26Å; H340-D642 HydrophobicContact CB-CB 4.16Å; H340-D642 PolarHBondContact N-OD2 2.86Å; F587-D642 HydrophobicContact CE1-CB 3.95Å; F587-D642 HydrophobicContact CE2-CB 3.87Å; F587-D642 HydrophobicContact CZ-CB 3.5Å; D640-D642 VanDerWaalsContact C-N 3.33Å; D640-D642 WeakPolarHBondContact OD1-CB 3.32Å; D640-D642 PolarHBondContact OD1-N 3.41Å; D640-D642 VanDerWaalsContact OD1-N 3.13Å; D642-M644 PolarHBondContact O-N 3.31Å; D642-I645 PolarHBondContact O-N 2.98Å; D642-I645 VanDerWaalsContact O-N 3.13Å; D642-V646 WeakPolarHBondContact O-CG1 3.34Å; D642-V646 PolarHBondContact O-N 2.96Å
643	F	95.4	Very high	93.8	Very high	17 Å²	17	43.2 Å²	43.2	8%	0.075	22%	0.22	C	C	.	.	H	α-helix	trans	-57.8	-35.1	172.1	-72.7	-78	0	0	0	113.4	D581 E582 D583 K584 L586 F587 D640 K641 A647	D581-F643 WeakPolarHBondContact O-CD1 3.23Å; D581-F643 WeakPolarHBondContact O-CE1 3.32Å; E582-F643 VanDerWaalsContact C-CZ 3.49Å; D583-F643 WeakPolarHBondContact O-CE1 3.33Å; K584-F643 HydrophobicContact CG-CZ 4.29Å; L586-F643 HydrophobicContact CB-CE1 4.42Å; L586-F643 HydrophobicContact CD1-CD1 4.41Å; L586-F643 HydrophobicContact CD1-CE1 4.17Å; F587-F643 HydrophobicContact CD1-CD1 4.5Å; F587-F643 HydrophobicContact CD1-CE1 4.48Å; F587-F643 AromaticContact CE1-CD1 3.64Å; F587-F643 HydrophobicContact CE1-CD1 3.64Å; F587-F643 AromaticContact CE1-CD2 3.97Å; F587-F643 HydrophobicContact CE1-CD2 3.97Å; F587-F643 AromaticContact CE1-CE1 3.65Å; F587-F643 HydrophobicContact CE1-CE1 3.65Å; F587-F643 AromaticContact CE1-CE2 4Å; F587-F643 HydrophobicContact CE1-CE2 4Å; F587-F643 AromaticContact CE1-CG 3.8Å; F587-F643 HydrophobicContact CE1-CG 3.8Å; F587-F643 AromaticContact CE1-CZ 3.83Å; F587-F643 HydrophobicContact CE1-CZ 3.83Å; F587-F643 HydrophobicContact CZ-CD1 4.44Å; F587-F643 HydrophobicContact CZ-CD2 4.04Å; F587-F643 HydrophobicContact CZ-CE1 4.24Å; F587-F643 AromaticContact CZ-CE2 3.84Å; F587-F643 HydrophobicContact CZ-CE2 3.84Å; F587-F643 HydrophobicContact CZ-CG 4.34Å; F587-F643 AromaticContact CZ-CZ 3.94Å; F587-F643 HydrophobicContact CZ-CZ 3.94Å; D640-F643 HydrophobicContact CB-CD2 4.01Å; D640-F643 HydrophobicContact CB-CE2 4.16Å; K641-F643 PolarHBondContact O-N 3.33Å; F643-A647 WeakPolarHBondContact O-CB 3.5Å; F643-A647 PolarHBondContact O-N 3.27Å
644	M	96.8	Very high	94.3	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-76.2	-41.2	176.9	173.1	171.6	58.4	0	0	110.7	V619 T622 L623 K641 D642 A647 L648 V686	V619-M644 HydrophobicContact CB-CG 4.37Å; V619-M644 HydrophobicContact CG1-CG 4.1Å; V619-M644 HydrophobicContact CG1-SD 4.25Å; V619-M644 HydrophobicContact CG2-CG 4.14Å; T622-M644 HydrophobicContact CG2-CB 3.83Å; T622-M644 HydrophobicContact CG2-CE 4.27Å; T622-M644 HydrophobicContact CG2-SD 4.48Å; L623-M644 HydrophobicContact CD1-SD 4.43Å; L623-M644 HydrophobicContact CD2-CE 4.49Å; L623-M644 HydrophobicContact CD2-SD 3.8Å; L623-M644 HydrophobicContact CG-SD 3.78Å; K641-M644 HydrophobicContact CB-CE 4.29Å; K641-M644 HydrophobicContact CD-CE 4.08Å; K641-M644 HydrophobicContact CG-CE 4.17Å; K641-M644 WeakPolarHBondContact O-CA 3.34Å; K641-M644 WeakPolarHBondContact O-CB 3.34Å; K641-M644 PolarHBondContact O-N 2.64Å; D642-M644 PolarHBondContact O-N 3.31Å; M644-A647 PolarHBondContact O-N 3.36Å; M644-L648 HydrophobicContact CG-CD1 4.01Å; M644-L648 HydrophobicContact CG-CG 4.49Å; M644-L648 VanDerWaalsContact O-CG 3.23Å; M644-L648 WeakPolarHBondContact O-CG 3.45Å; M644-L648 PolarHBondContact O-N 2.89Å; M644-V686 HydrophobicContact CE-CB 4.11Å; M644-V686 HydrophobicContact CE-CG1 3.43Å; M644-V686 VanDerWaalsContact CE-CG1 3.43Å; M644-V686 HydrophobicContact CE-CG2 3.47Å; M644-V686 VanDerWaalsContact CE-CG2 3.47Å; M644-V686 HydrophobicContact SD-CG1 4.06Å
645	I	96.3	Very high	94.8	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-63.3	-52.9	-179.6	-60.6	165.2	0	0	0	110	H340 S342 K641 D642 A647 L648 D649 M683 E685 V686 S689	H340-I645 WeakPolarHBondContact CD2-CG2 3.36Å; H340-I645 WeakPolarHBondContact NE2-CG2 3.25Å; S342-I645 WeakPolarHBondContact OG-CG2 3.26Å; K641-I645 WeakPolarHBondContact O-CG1 3.34Å; K641-I645 PolarHBondContact O-N 2.68Å; D642-I645 PolarHBondContact O-N 2.98Å; D642-I645 VanDerWaalsContact O-N 3.13Å; I645-A647 VanDerWaalsContact C-N 3.25Å; I645-A647 PolarHBondContact O-N 3.4Å; I645-L648 WeakPolarHBondContact O-CB 3.4Å; I645-L648 PolarHBondContact O-N 3.06Å; I645-D649 PolarHBondContact O-N 3.03Å; I645-M683 HydrophobicContact CD1-SD 4.05Å; I645-E685 HydrophobicContact CD1-CB 3.6Å; I645-E685 HydrophobicContact CG1-CB 4.42Å; I645-V686 HydrophobicContact CD1-CG2 4.07Å; I645-V686 HydrophobicContact CG1-CG2 3.73Å; I645-S689 VanDerWaalsContact CG2-OG 3.27Å; I645-S689 WeakPolarHBondContact CG2-OG 3.27Å
646	V	94.9	Very high	95.2	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-33.4	-179.4	75.9	0	0	0	0	112.4	H340 F587 L590 E591 D642 D649 L650	H340-V646 HydrophobicContact CB-CB 4.3Å; H340-V646 VanDerWaalsContact CD2-CA 3.48Å; H340-V646 WeakPolarHBondContact CD2-CA 3.47Å; H340-V646 PolarHBondContact CD2-N 3.31Å; H340-V646 VanDerWaalsContact NE2-CA 3.32Å; H340-V646 WeakPolarHBondContact NE2-CA 3.41Å; H340-V646 PolarHBondContact NE2-N 2.96Å; F587-V646 HydrophobicContact CD1-CG1 4.04Å; L590-V646 HydrophobicContact CB-CG1 4.44Å; L590-V646 HydrophobicContact CB-CG2 3.46Å; L590-V646 VanDerWaalsContact CB-CG2 3.46Å; L590-V646 HydrophobicContact CD1-CG1 3.74Å; L590-V646 HydrophobicContact CD1-CG2 4.32Å; E591-V646 HydrophobicContact CG-CG2 4.11Å; D642-V646 WeakPolarHBondContact O-CG1 3.34Å; D642-V646 PolarHBondContact O-N 2.96Å; V646-D649 PolarHBondContact O-N 3.2Å; V646-L650 WeakPolarHBondContact O-CB 3.26Å; V646-L650 PolarHBondContact O-N 3.36Å
647	A	98.1	Very high	95.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.1	-38	175.1	0	0	0	0	0	112.1	C615 L618 V619 F643 M644 I645 L651	C615-A647 HydrophobicContact CB-CB 3.94Å; L618-A647 HydrophobicContact CB-CB 4.02Å; L618-A647 HydrophobicContact CD1-CB 4.26Å; V619-A647 HydrophobicContact CG2-CB 3.89Å; F643-A647 WeakPolarHBondContact O-CB 3.5Å; F643-A647 PolarHBondContact O-N 3.27Å; M644-A647 PolarHBondContact O-N 3.36Å; I645-A647 VanDerWaalsContact C-N 3.25Å; I645-A647 PolarHBondContact O-N 3.4Å; A647-L651 WeakPolarHBondContact O-CB 3.25Å; A647-L651 WeakPolarHBondContact O-CD1 3.45Å; A647-L651 WeakPolarHBondContact O-CG 3.47Å; A647-L651 PolarHBondContact O-N 3.28Å; A647-L651 VanDerWaalsContact O-N 3.09Å
648	L	98.4	Very high	95.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.4	-42.1	174.4	-72	167.7	0	0	0	111.1	V619 M644 I645 L651 S652 C678 V686 L693	V619-L648 HydrophobicContact CG2-CD2 4.05Å; V619-L648 HydrophobicContact CG2-CG 3.99Å; M644-L648 HydrophobicContact CG-CD1 4.01Å; M644-L648 HydrophobicContact CG-CG 4.49Å; M644-L648 VanDerWaalsContact O-CG 3.23Å; M644-L648 WeakPolarHBondContact O-CG 3.45Å; M644-L648 PolarHBondContact O-N 2.89Å; I645-L648 WeakPolarHBondContact O-CB 3.4Å; I645-L648 PolarHBondContact O-N 3.06Å; L648-L651 WeakPolarHBondContact O-CB 3.43Å; L648-L651 PolarHBondContact O-N 3.29Å; L648-S652 PolarHBondContact O-N 2.91Å; L648-C678 HydrophobicContact CD1-CB 4.28Å; L648-V686 HydrophobicContact CD1-CG1 4.47Å; L648-L693 HydrophobicContact CD2-CD2 3.75Å
649	D	96.4	Very high	96.1	Very high	7 Å²	7	12.9 Å²	12.9	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-67.7	-41.3	-178.9	-74.8	-5.9	0	0	0	112	H340 R343 S594 I645 V646 L651 S652 G653 S689	H340-D649 IonicContact CE1-OD2 2.92Å; H340-D649 IonicContact NE2-OD2 2.82Å; H340-D649 PolarHBondContact NE2-OD2 2.99Å; R343-D649 HydrophobicContact CB-CB 4.47Å; R343-D649 WeakPolarHBondContact CB-OD2 3.4Å; R343-D649 PolarHBondContact N-OD2 3.36Å; S594-D649 PolarHBondContact OG-O 3.03Å; I645-D649 PolarHBondContact O-N 3.03Å; V646-D649 PolarHBondContact O-N 3.2Å; D649-L651 PolarHBondContact O-N 2.78Å; D649-S652 WeakPolarHBondContact O-CA 3.37Å; D649-S652 WeakPolarHBondContact O-CB 3.34Å; D649-S652 PolarHBondContact O-N 3.4Å; D649-S652 VanDerWaalsContact O-N 3.09Å; D649-G653 PolarHBondContact O-N 2.9Å; D649-S689 VanDerWaalsContact CG-OG 3.26Å; D649-S689 WeakPolarHBondContact OD1-CA 3.28Å; D649-S689 WeakPolarHBondContact OD1-CB 3.3Å; D649-S689 PolarHBondContact OD1-OG 3.37Å; D649-S689 PolarHBondContact OD2-OG 2.98Å
650	L	97.7	Very high	96.2	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-37.9	171.1	174.6	61.9	0	0	0	112.5	L590 L593 V611 C615 V646 S652 G653 L654	L590-L650 HydrophobicContact CD2-CD2 3.29Å; L590-L650 HydrophobicContact CG-CD2 4.42Å; L593-L650 HydrophobicContact CB-CD1 4.02Å; V611-L650 HydrophobicContact CG1-CD1 4.29Å; V611-L650 HydrophobicContact CG1-CD2 3.41Å; V611-L650 VanDerWaalsContact CG1-CD2 3.41Å; V611-L650 HydrophobicContact CG1-CG 4.08Å; C615-L650 WeakPolarHBondContact SG-CD2 3.43Å; V646-L650 WeakPolarHBondContact O-CB 3.26Å; V646-L650 PolarHBondContact O-N 3.36Å; L650-S652 PolarHBondContact O-N 2.84Å; L650-G653 PolarHBondContact O-N 3.26Å; L650-L654 HydrophobicContact CD1-CG 4.37Å; L650-L654 WeakPolarHBondContact O-CB 3.49Å; L650-L654 WeakPolarHBondContact O-CG 3.44Å; L650-L654 PolarHBondContact O-N 3.3Å
651	L	98.6	Very high	96.3	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-61.9	-35.3	173	-74.3	166.8	0	0	0	111.1	Y612 C615 V616 A647 L648 D649 L654 A655 I671 L693	Y612-L651 HydrophobicContact CD2-CD2 3.28Å; Y612-L651 HydrophobicContact CE2-CD2 3.5Å; Y612-L651 VanDerWaalsContact CE2-CD2 3.5Å; Y612-L651 HydrophobicContact CG-CD2 3.97Å; C615-L651 HydrophobicContact CB-CD1 3.81Å; C615-L651 HydrophobicContact CB-CD2 3.86Å; C615-L651 HydrophobicContact CB-CG 3.56Å; V616-L651 HydrophobicContact CG2-CD1 4.24Å; V616-L651 HydrophobicContact CG2-CD2 4.25Å; A647-L651 WeakPolarHBondContact O-CB 3.25Å; A647-L651 WeakPolarHBondContact O-CD1 3.45Å; A647-L651 WeakPolarHBondContact O-CG 3.47Å; A647-L651 PolarHBondContact O-N 3.28Å; A647-L651 VanDerWaalsContact O-N 3.09Å; L648-L651 WeakPolarHBondContact O-CB 3.43Å; L648-L651 PolarHBondContact O-N 3.29Å; D649-L651 PolarHBondContact O-N 2.78Å; L651-L654 HydrophobicContact CD2-CD1 4.5Å; L651-A655 WeakPolarHBondContact O-CB 3.21Å; L651-A655 PolarHBondContact O-N 3.37Å; L651-I671 HydrophobicContact CD1-CD1 3.86Å; L651-L693 HydrophobicContact CB-CD1 3.79Å; L651-L693 HydrophobicContact CB-CD2 4.03Å; L651-L693 HydrophobicContact CD1-CD2 4.34Å
652	S	97.7	Very high	96.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.8	-51.1	173.8	-142.8	0	0	0	0	110.2	L648 D649 L650 L654 A655 E656 A692 L693 D696	L648-S652 PolarHBondContact O-N 2.91Å; D649-S652 WeakPolarHBondContact O-CA 3.37Å; D649-S652 WeakPolarHBondContact O-CB 3.34Å; D649-S652 PolarHBondContact O-N 3.4Å; D649-S652 VanDerWaalsContact O-N 3.09Å; L650-S652 PolarHBondContact O-N 2.84Å; S652-L654 VanDerWaalsContact C-N 3.31Å; S652-L654 PolarHBondContact O-N 3.24Å; S652-A655 WeakPolarHBondContact O-CB 3.19Å; S652-A655 PolarHBondContact O-N 2.98Å; S652-E656 WeakPolarHBondContact O-CB 3.24Å; S652-E656 PolarHBondContact O-N 2.98Å; S652-A692 VanDerWaalsContact OG-C 3.28Å; S652-A692 PolarHBondContact OG-O 3.43Å; S652-L693 WeakPolarHBondContact OG-CA 3.42Å; S652-L693 PolarHBondContact OG-N 2.88Å; S652-D696 PolarHBondContact OG-OD2 2.93Å
653	G	96.1	Very high	96.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.2	-37.9	176.4	0	0	0	0	0	113.4	T598 D649 L650 E656 G657	T598-G653 WeakPolarHBondContact OG1-CA 3.47Å; T598-G653 PolarHBondContact OG1-O 3.1Å; D649-G653 PolarHBondContact O-N 2.9Å; L650-G653 PolarHBondContact O-N 3.26Å; G653-E656 PolarHBondContact O-N 3.21Å; G653-G657 PolarHBondContact O-N 3.37Å
654	L	98	Very high	96.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.1	-43.7	171.8	-74.5	175.8	0	0	0	112.4	A597 F604 C608 V611 Y612 L650 L651 S652 E656 L658 I662	A597-L654 HydrophobicContact CB-CD2 3.93Å; F604-L654 HydrophobicContact CD1-CD2 3.66Å; F604-L654 HydrophobicContact CE1-CD2 3.6Å; C608-L654 HydrophobicContact CB-CD2 4.25Å; V611-L654 HydrophobicContact CG1-CD1 3.96Å; Y612-L654 HydrophobicContact CD2-CD1 4.32Å; L650-L654 HydrophobicContact CD1-CG 4.37Å; L650-L654 WeakPolarHBondContact O-CB 3.49Å; L650-L654 WeakPolarHBondContact O-CG 3.44Å; L650-L654 PolarHBondContact O-N 3.3Å; L651-L654 HydrophobicContact CD2-CD1 4.5Å; S652-L654 VanDerWaalsContact C-N 3.31Å; S652-L654 PolarHBondContact O-N 3.24Å; L654-E656 VanDerWaalsContact C-N 3.33Å; L654-L658 HydrophobicContact CD2-CD1 4.25Å; L654-L658 WeakPolarHBondContact O-CB 3.36Å; L654-L658 VanDerWaalsContact O-CG 3.27Å; L654-L658 WeakPolarHBondContact O-CG 3.32Å; L654-L658 PolarHBondContact O-N 3.06Å; L654-I662 HydrophobicContact CB-CD1 3.96Å
655	A	97.8	Very high	96.7	Very high	1 Å²	1	22 Å²	22	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-66.2	-38.6	179.5	0	0	0	0	0	111.4	L651 S652 G659 I662 D696 L697	L651-A655 WeakPolarHBondContact O-CB 3.21Å; L651-A655 PolarHBondContact O-N 3.37Å; S652-A655 WeakPolarHBondContact O-CB 3.19Å; S652-A655 PolarHBondContact O-N 2.98Å; A655-G659 VanDerWaalsContact O-CA 3.29Å; A655-G659 WeakPolarHBondContact O-CA 3.49Å; A655-G659 PolarHBondContact O-N 3.31Å; A655-G659 VanDerWaalsContact O-N 3.08Å; A655-I662 HydrophobicContact CB-CD1 3.97Å; A655-D696 HydrophobicContact CB-CB 3.8Å; A655-L697 HydrophobicContact CB-CD2 3.95Å; A655-L697 HydrophobicContact CB-CG 4.5Å
656	E	95.1	Very high	96.8	Very high	74 Å²	74	22.3 Å²	22.3	35%	0.346	13%	0.134	S	C	.	.	H	α-helix	trans	-66	-53.8	174.9	-172.6	175.5	-179.2	0	0	111.9	R343 T598 S652 G653 L654	R343-E656 IonicContact CZ-OE2 2.76Å; R343-E656 VanDerWaalsContact CZ-OE2 3.26Å; R343-E656 IonicContact NH1-OE2 3.5Å; R343-E656 PolarHBondContact NH1-OE2 3.12Å; R343-E656 IonicContact NH2-OE1 3.73Å; R343-E656 IonicContact NH2-OE2 2.81Å; R343-E656 PolarHBondContact NH2-OE2 3.31Å; T598-E656 HydrophobicContact CG2-CG 4.05Å; S652-E656 WeakPolarHBondContact O-CB 3.24Å; S652-E656 PolarHBondContact O-N 2.98Å; G653-E656 PolarHBondContact O-N 3.21Å; L654-E656 VanDerWaalsContact C-N 3.33Å
657	G	94.1	Very high	96.9	Very high	10 Å²	10	24.8 Å²	24.8	10%	0.103	16%	0.155	C	C	.	.	H	α-helix	trans	-67.9	-45.1	-177.1	0	0	0	0	0	113.9	Q601 G653	Q601-G657 CarbonylContact C-O 3.35Å; Q601-G657 WeakPolarHBondContact CA-O 3.24Å; Q601-G657 WeakPolarHBondContact CB-O 3.01Å; G653-G657 PolarHBondContact O-N 3.37Å
658	L	96.4	Very high	96.8	Very high	9 Å²	9	34 Å²	34	5%	0.047	19%	0.19	C	C	.	.	H	α-helix	trans	-81	-20.3	-177.8	-58.6	178.3	0	0	0	113	Q601 F604 L605 C608 L654 G660 T661 I662	Q601-L658 WeakPolarHBondContact O-CD2 3.42Å; F604-L658 HydrophobicContact CB-CD2 4.3Å; L605-L658 HydrophobicContact CD2-CD2 3.72Å; L605-L658 HydrophobicContact CG-CD2 4.01Å; C608-L658 HydrophobicContact CB-CD1 3.57Å; L654-L658 HydrophobicContact CD2-CD1 4.25Å; L654-L658 WeakPolarHBondContact O-CB 3.36Å; L654-L658 VanDerWaalsContact O-CG 3.27Å; L654-L658 WeakPolarHBondContact O-CG 3.32Å; L654-L658 PolarHBondContact O-N 3.06Å; L658-G660 PolarHBondContact O-N 2.79Å; L658-T661 WeakPolarHBondContact O-CB 3.36Å; L658-T661 PolarHBondContact O-N 3.09Å; L658-T661 VanDerWaalsContact O-N 3.11Å; L658-T661 PolarHBondContact O-OG1 3.2Å; L658-I662 HydrophobicContact CB-CB 4.28Å; L658-I662 HydrophobicContact CD1-CB 4.46Å; L658-I662 HydrophobicContact CD1-CG1 4.41Å
659	G	95.3	Very high	96.8	Very high	24 Å²	24	35.5 Å²	35.5	25%	0.247	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	49.9	-134.4	-173.2	0	0	0	0	0	111.3	A655 T661 I662	A655-G659 VanDerWaalsContact O-CA 3.29Å; A655-G659 WeakPolarHBondContact O-CA 3.49Å; A655-G659 PolarHBondContact O-N 3.31Å; A655-G659 VanDerWaalsContact O-N 3.08Å; G659-T661 PolarHBondContact O-N 3.15Å; G659-I662 VanDerWaalsContact O-CG2 3.24Å; G659-I662 WeakPolarHBondContact O-CG2 3.24Å; G659-I662 PolarHBondContact O-N 3.31Å; G659-I662 VanDerWaalsContact O-N 3.09Å
660	G	94.5	Very high	96.8	Very high	51 Å²	51	38.1 Å²	38.1	53%	0.526	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-59.2	-12	-179.2	0	0	0	0	0	116.1	L658 I662 E663 A700	L658-G660 PolarHBondContact O-N 2.79Å; G660-I662 VanDerWaalsContact C-N 3.26Å; G660-I662 PolarHBondContact O-N 3.19Å; G660-E663 VanDerWaalsContact O-CB 3.23Å; G660-E663 WeakPolarHBondContact O-CB 3.48Å; G660-E663 PolarHBondContact O-N 3.12Å; G660-A700 WeakPolarHBondContact CA-O 3.23Å
661	T	96.4	Very high	96.8	Very high	77 Å²	77	38.2 Å²	38.2	47%	0.472	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-71.2	-22.7	176.1	-35.3	0	0	0	0	112.7	L605 L658 G659 E663	L605-T661 HydrophobicContact CD1-CG2 4.08Å; L605-T661 HydrophobicContact CD2-CG2 3.33Å; L605-T661 HydrophobicContact CG-CG2 4.35Å; L658-T661 WeakPolarHBondContact O-CB 3.36Å; L658-T661 PolarHBondContact O-N 3.09Å; L658-T661 VanDerWaalsContact O-N 3.11Å; L658-T661 PolarHBondContact O-OG1 3.2Å; G659-T661 PolarHBondContact O-N 3.15Å; T661-E663 PolarHBondContact O-N 2.92Å
662	I	97.4	Very high	96.8	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-68.6	-16.2	178	-156	171.9	0	0	0	112.9	Y612 L654 A655 L658 G659 G660 Q664 L665 V666 A700	Y612-I662 HydrophobicContact CD2-CD1 4.08Å; Y612-I662 HydrophobicContact CD2-CG1 4.37Å; Y612-I662 HydrophobicContact CE2-CD1 4.02Å; Y612-I662 HydrophobicContact CE2-CG1 4.28Å; L654-I662 HydrophobicContact CB-CD1 3.96Å; A655-I662 HydrophobicContact CB-CD1 3.97Å; L658-I662 HydrophobicContact CB-CB 4.28Å; L658-I662 HydrophobicContact CD1-CB 4.46Å; L658-I662 HydrophobicContact CD1-CG1 4.41Å; G659-I662 VanDerWaalsContact O-CG2 3.24Å; G659-I662 WeakPolarHBondContact O-CG2 3.24Å; G659-I662 PolarHBondContact O-N 3.31Å; G659-I662 VanDerWaalsContact O-N 3.09Å; G660-I662 VanDerWaalsContact C-N 3.26Å; G660-I662 PolarHBondContact O-N 3.19Å; I662-Q664 VanDerWaalsContact C-N 3.25Å; I662-Q664 PolarHBondContact O-N 3.42Å; I662-Q664 VanDerWaalsContact O-N 3.08Å; I662-L665 HydrophobicContact CG1-CB 4.43Å; I662-L665 HydrophobicContact CG1-CD1 4.27Å; I662-L665 WeakPolarHBondContact O-CB 3.47Å; I662-L665 PolarHBondContact O-N 2.87Å; I662-V666 HydrophobicContact CG1-CG2 4.3Å; I662-V666 HydrophobicContact CG2-CG2 4.2Å; I662-V666 PolarHBondContact O-N 3.44Å; I662-V666 VanDerWaalsContact O-N 3.16Å; I662-A700 HydrophobicContact CG2-CB 3.93Å
663	E	97.6	Very high	96.8	Very high	55 Å²	55	44 Å²	44	26%	0.257	25%	0.249	S	C	.	.	H	α-helix	trans	-47.7	-43.6	-173.9	-175.5	-77.3	151.5	0	0	113.7	G660 T661 L665 V666 A667 C701 H704	G660-E663 VanDerWaalsContact O-CB 3.23Å; G660-E663 WeakPolarHBondContact O-CB 3.48Å; G660-E663 PolarHBondContact O-N 3.12Å; T661-E663 PolarHBondContact O-N 2.92Å; E663-L665 VanDerWaalsContact C-N 3.29Å; E663-L665 PolarHBondContact O-N 3.14Å; E663-V666 PolarHBondContact O-N 3.21Å; E663-A667 WeakPolarHBondContact O-CB 3.25Å; E663-A667 PolarHBondContact O-N 3.49Å; E663-C701 HydrophobicContact CB-CB 4.11Å; E663-C701 HydrophobicContact CG-CB 4.12Å; E663-H704 IonicContact OE1-CD2 2.88Å; E663-H704 IonicContact OE1-CE1 3.07Å; E663-H704 PolarHBondContact OE1-CE1 2.73Å; E663-H704 IonicContact OE1-NE2 3.44Å; E663-H704 PolarHBondContact OE1-NE2 3.39Å
664	Q	96.1	Very high	96.9	Very high	120 Å²	120	44.5 Å²	44.5	56%	0.561	25%	0.252	S	S	*	.	H	α-helix	trans	-68.3	-30	-177	-65	-173.3	12	0	0	112.8	I662 R668	I662-Q664 VanDerWaalsContact C-N 3.25Å; I662-Q664 PolarHBondContact O-N 3.42Å; I662-Q664 VanDerWaalsContact O-N 3.08Å; Q664-R668 WeakPolarHBondContact O-CG 3.43Å
665	L	97.8	Very high	96.9	Very high	28 Å²	28	44.5 Å²	44.5	15%	0.147	25%	0.252	C	S	.	.	H	α-helix	trans	-74.6	-42.3	176.8	-62.8	171.7	0	0	0	110	E609 Y612 I662 E663 R668 S669	E609-L665 HydrophobicContact CB-CD2 4.18Å; E609-L665 HydrophobicContact CG-CD2 3.99Å; Y612-L665 HydrophobicContact CD1-CB 3.88Å; Y612-L665 HydrophobicContact CD2-CB 4.3Å; Y612-L665 HydrophobicContact CD2-CD1 4.4Å; Y612-L665 HydrophobicContact CE1-CB 3.84Å; Y612-L665 HydrophobicContact CE2-CB 4.29Å; Y612-L665 HydrophobicContact CG-CB 4.11Å; Y612-L665 HydrophobicContact CG-CD1 4.12Å; I662-L665 HydrophobicContact CG1-CB 4.43Å; I662-L665 HydrophobicContact CG1-CD1 4.27Å; I662-L665 WeakPolarHBondContact O-CB 3.47Å; I662-L665 PolarHBondContact O-N 2.87Å; E663-L665 VanDerWaalsContact C-N 3.29Å; E663-L665 PolarHBondContact O-N 3.14Å; L665-R668 PolarHBondContact O-N 3Å; L665-S669 PolarHBondContact O-N 3.37Å
666	V	98	Very high	96.9	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-45.2	175.4	178.8	0	0	0	0	111.2	Y612 I662 E663 R668 S669 I671 L697 H704	Y612-V666 HydrophobicContact CE2-CG2 4.41Å; Y612-V666 WeakPolarHBondContact OH-CA 3.4Å; I662-V666 HydrophobicContact CG1-CG2 4.3Å; I662-V666 HydrophobicContact CG2-CG2 4.2Å; I662-V666 PolarHBondContact O-N 3.44Å; I662-V666 VanDerWaalsContact O-N 3.16Å; E663-V666 PolarHBondContact O-N 3.21Å; V666-R668 PolarHBondContact O-N 2.99Å; V666-R668 VanDerWaalsContact O-N 3.1Å; V666-S669 PolarHBondContact O-N 3.4Å; V666-S669 VanDerWaalsContact O-N 3.1Å; V666-S669 PolarHBondContact O-OG 3.04Å; V666-I671 HydrophobicContact CG1-CG2 4.12Å; V666-L697 HydrophobicContact CG2-CD2 3.75Å; V666-H704 HydrophobicContact CG1-CB 4.19Å
667	A	97.1	Very high	97	Very high	54 Å²	54	49.2 Å²	49.2	45%	0.446	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.2	-180	0	0	0	0	0	113.8	E663	E663-A667 WeakPolarHBondContact O-CB 3.25Å; E663-A667 PolarHBondContact O-N 3.49Å
668	R	96.6	Very high	97.2	Very high	193 Å²	193	48.7 Å²	48.7	73%	0.728	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	1.3	-178.7	-64.8	177.1	-171.8	171.1	8.4	113.4	Q664 L665 V666	Q664-R668 WeakPolarHBondContact O-CG 3.43Å; L665-R668 PolarHBondContact O-N 3Å; V666-R668 PolarHBondContact O-N 2.99Å; V666-R668 VanDerWaalsContact O-N 3.1Å
669	S	97.1	Very high	97.3	Very high	33 Å²	33	48.3 Å²	48.3	23%	0.231	26%	0.263	C	S	.	.	S	Bend	trans	-114.6	170.8	-178.3	84.8	0	0	0	0	112.6	Y612 L665 V666 I671	Y612-S669 PolarHBondContact OH-OG 2.9Å; L665-S669 PolarHBondContact O-N 3.37Å; V666-S669 PolarHBondContact O-N 3.4Å; V666-S669 VanDerWaalsContact O-N 3.1Å; V666-S669 PolarHBondContact O-OG 3.04Å; S669-I671 VanDerWaalsContact OG-CG2 3.29Å; S669-I671 WeakPolarHBondContact OG-CG2 3.47Å; S669-I671 PolarHBondContact OG-N 3.26Å
670	N	97.3	Very high	97.4	Very high	62 Å²	62	52 Å²	52	33%	0.332	27%	0.274	S	S	.	.			trans	-100.6	19.1	174.4	60.7	-28	0	0	0	112.4	Q620 L672 T673 L674	Q620-N670 PolarHBondContact OE1-ND2 3.47Å; N670-L672 VanDerWaalsContact C-N 3.3Å; N670-L672 PolarHBondContact O-N 3.18Å; N670-T673 WeakPolarHBondContact O-CB 3.37Å; N670-T673 PolarHBondContact O-N 3.46Å; N670-L674 PolarHBondContact O-N 3.06Å; N670-L674 VanDerWaalsContact O-N 3.16Å
671	I	98.2	Very high	97.6	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-56	-41.8	-171.5	-174.1	54.9	0	0	0	112.6	Y612 V616 L651 V666 S669 T673 L674 M675 L693	Y612-I671 WeakPolarHBondContact OH-CG2 3.42Å; V616-I671 HydrophobicContact CG2-CD1 4.45Å; L651-I671 HydrophobicContact CD1-CD1 3.86Å; V666-I671 HydrophobicContact CG1-CG2 4.12Å; S669-I671 VanDerWaalsContact OG-CG2 3.29Å; S669-I671 WeakPolarHBondContact OG-CG2 3.47Å; S669-I671 PolarHBondContact OG-N 3.26Å; I671-T673 VanDerWaalsContact C-N 3.27Å; I671-T673 PolarHBondContact O-N 2.81Å; I671-L674 CarbonylContact O-C 3.44Å; I671-L674 WeakPolarHBondContact O-CB 3.4Å; I671-L674 PolarHBondContact O-N 2.99Å; I671-M675 HydrophobicContact CD1-CG 4.33Å; I671-M675 HydrophobicContact CG1-CG 4.27Å; I671-M675 HydrophobicContact CG1-SD 4.46Å; I671-M675 WeakPolarHBondContact O-CG 3.33Å; I671-M675 PolarHBondContact O-N 3.32Å; I671-L693 HydrophobicContact CD1-CD2 4.07Å; I671-L693 HydrophobicContact CG1-CD2 4.16Å
672	L	97.7	Very high	97.5	Very high	28 Å²	28	55.4 Å²	55.4	15%	0.147	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-33.9	179.6	-61.7	177	0	0	0	112.8	N670 M675 Y676 L697 H704 V705	N670-L672 VanDerWaalsContact C-N 3.3Å; N670-L672 PolarHBondContact O-N 3.18Å; L672-M675 HydrophobicContact CD2-CE 3.35Å; L672-M675 HydrophobicContact CD2-SD 4.35Å; L672-Y676 PolarHBondContact O-N 2.69Å; L672-L697 HydrophobicContact CD2-CD1 4.31Å; L672-H704 HydrophobicContact CD1-CB 4.04Å; L672-H704 WeakPolarHBondContact CD1-O 3.34Å; L672-V705 HydrophobicContact CD2-CG2 4.29Å
673	T	97.7	Very high	97.4	Very high	94 Å²	94	58.5 Å²	58.5	58%	0.577	28%	0.284	S	S	*	.	H	α-helix	trans	-69.1	-39	174.3	-54.2	0	0	0	0	111.2	N670 I671	N670-T673 WeakPolarHBondContact O-CB 3.37Å; N670-T673 PolarHBondContact O-N 3.46Å; I671-T673 VanDerWaalsContact C-N 3.27Å; I671-T673 PolarHBondContact O-N 2.81Å
674	L	98.4	Very high	97.3	Very high	11 Å²	11	57.6 Å²	57.6	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-67.6	-42.7	175.8	-58.8	176.6	0	0	0	110.7	V616 V619 Q620 L623 N670 I671 Y676 Q677 C678	V616-L674 HydrophobicContact CG1-CD1 3.95Å; V619-L674 HydrophobicContact CB-CD1 4.45Å; V619-L674 HydrophobicContact CG1-CB 4.09Å; V619-L674 HydrophobicContact CG1-CD1 4.16Å; Q620-L674 HydrophobicContact CB-CD1 4.07Å; Q620-L674 HydrophobicContact CB-CD2 4.23Å; Q620-L674 HydrophobicContact CG-CD2 4.32Å; L623-L674 HydrophobicContact CD1-CB 4.33Å; L623-L674 HydrophobicContact CD1-CD2 4.1Å; N670-L674 PolarHBondContact O-N 3.06Å; N670-L674 VanDerWaalsContact O-N 3.16Å; I671-L674 CarbonylContact O-C 3.44Å; I671-L674 WeakPolarHBondContact O-CB 3.4Å; I671-L674 PolarHBondContact O-N 2.99Å; L674-Y676 VanDerWaalsContact C-N 3.28Å; L674-Y676 PolarHBondContact O-N 2.9Å; L674-Q677 WeakPolarHBondContact O-CA 3.46Å; L674-Q677 WeakPolarHBondContact O-CB 3.41Å; L674-Q677 PolarHBondContact O-N 3.2Å; L674-C678 PolarHBondContact O-N 2.91Å; L674-C678 PolarHBondContact O-SG 2.98Å; L674-C678 VanDerWaalsContact O-SG 3.36Å
675	M	97.4	Very high	97.3	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57	-40.3	176.3	-70	-172.2	-19.3	0	0	112.1	I671 L672 Q677 C678 M679 L693 L694 L697 F712	I671-M675 HydrophobicContact CD1-CG 4.33Å; I671-M675 HydrophobicContact CG1-CG 4.27Å; I671-M675 HydrophobicContact CG1-SD 4.46Å; I671-M675 WeakPolarHBondContact O-CG 3.33Å; I671-M675 PolarHBondContact O-N 3.32Å; L672-M675 HydrophobicContact CD2-CE 3.35Å; L672-M675 HydrophobicContact CD2-SD 4.35Å; M675-Q677 PolarHBondContact O-N 2.84Å; M675-C678 PolarHBondContact O-N 3.23Å; M675-C678 VanDerWaalsContact O-N 3.14Å; M675-M679 WeakPolarHBondContact O-CB 3.36Å; M675-M679 WeakPolarHBondContact O-CG 3.42Å; M675-M679 PolarHBondContact O-N 2.95Å; M675-L693 HydrophobicContact CG-CD2 4.2Å; M675-L693 HydrophobicContact SD-CD2 3.86Å; M675-L693 HydrophobicContact SD-CG 3.89Å; M675-L694 HydrophobicContact CE-CB 4.43Å; M675-L694 HydrophobicContact CE-CD1 3.87Å; M675-L697 HydrophobicContact CE-CD1 4.35Å; M675-L697 HydrophobicContact SD-CD1 3.74Å; M675-F712 HydrophobicContact CE-CE2 3.75Å; M675-F712 HydrophobicContact CE-CZ 4.06Å
676	Y	98.1	Very high	97.3	Very high	102 Å²	102	54.4 Å²	54.4	40%	0.4	27%	0.267	S	S	.	.	H	α-helix	trans	-54.8	-36.7	175.1	-177.7	-106.2	0	0	0	112.2	L672 L674 Q680 D711 F712 I715	L672-Y676 PolarHBondContact O-N 2.69Å; L674-Y676 VanDerWaalsContact C-N 3.28Å; L674-Y676 PolarHBondContact O-N 2.9Å; Y676-Q680 PolarHBondContact O-NE2 3.44Å; Y676-D711 HydrophobicContact CE2-CB 4.13Å; Y676-F712 HydrophobicContact CD2-CD1 4.24Å; Y676-F712 AromaticContact CD2-CE1 3.94Å; Y676-F712 HydrophobicContact CD2-CE1 3.94Å; Y676-F712 HydrophobicContact CG-CE1 4.49Å; Y676-I715 HydrophobicContact CD2-CD1 3.98Å; Y676-I715 HydrophobicContact CE2-CD1 3.79Å
677	Q	98.1	Very high	97.3	Very high	71 Å²	71	55.4 Å²	55.4	33%	0.332	27%	0.27	S	S	.	.	H	α-helix	trans	-76.6	-45.1	175.7	-61.4	-175.9	-10.3	0	0	111.7	L623 M627 L674 M675 M679 Q680 D681	L623-Q677 HydrophobicContact CD1-CB 4.17Å; L623-Q677 HydrophobicContact CD2-CB 4.24Å; M627-Q677 VanDerWaalsContact CE-OE1 3.22Å; L674-Q677 WeakPolarHBondContact O-CA 3.46Å; L674-Q677 WeakPolarHBondContact O-CB 3.41Å; L674-Q677 PolarHBondContact O-N 3.2Å; M675-Q677 PolarHBondContact O-N 2.84Å; Q677-M679 PolarHBondContact O-N 2.95Å; Q677-Q680 CarbonylContact O-C 3.54Å; Q677-Q680 PolarHBondContact O-N 3.31Å; Q677-Q680 VanDerWaalsContact O-N 3.09Å; Q677-D681 PolarHBondContact O-N 2.93Å
678	C	98.4	Very high	97.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.4	-42.5	179.4	-61.3	0	0	0	0	112.5	L648 L674 M675 Q680 D681 V686	L648-C678 HydrophobicContact CD1-CB 4.28Å; L674-C678 PolarHBondContact O-N 2.91Å; L674-C678 PolarHBondContact O-SG 2.98Å; L674-C678 VanDerWaalsContact O-SG 3.36Å; M675-C678 PolarHBondContact O-N 3.23Å; M675-C678 VanDerWaalsContact O-N 3.14Å; C678-Q680 PolarHBondContact O-N 3.05Å; C678-Q680 VanDerWaalsContact O-N 3.09Å; C678-D681 VanDerWaalsContact O-CB 3.32Å; C678-D681 WeakPolarHBondContact O-CB 3.47Å; C678-D681 PolarHBondContact O-N 3.37Å; C678-V686 HydrophobicContact CB-CG1 3.97Å
679	M	98.3	Very high	97.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.3	178.4	-66.9	167.8	67.8	0	0	113.4	M675 Q677 R687 S690 F691 L694 F712 I715 L716	M675-M679 WeakPolarHBondContact O-CB 3.36Å; M675-M679 WeakPolarHBondContact O-CG 3.42Å; M675-M679 PolarHBondContact O-N 2.95Å; Q677-M679 PolarHBondContact O-N 2.95Å; M679-R687 WeakPolarHBondContact O-CD 3.47Å; M679-S690 WeakPolarHBondContact CA-OG 3.46Å; M679-S690 VanDerWaalsContact CG-OG 3.3Å; M679-S690 WeakPolarHBondContact CG-OG 3.27Å; M679-F691 HydrophobicContact CB-CE1 3.79Å; M679-F691 HydrophobicContact CB-CZ 4.39Å; M679-F691 HydrophobicContact CE-CD1 4.04Å; M679-F691 HydrophobicContact CE-CE1 3.62Å; M679-F691 HydrophobicContact CG-CD1 3.95Å; M679-F691 HydrophobicContact CG-CE1 3.62Å; M679-F691 HydrophobicContact SD-CE1 4.41Å; M679-L694 HydrophobicContact CE-CD2 3.83Å; M679-L694 HydrophobicContact SD-CD2 4.23Å; M679-F712 HydrophobicContact CE-CB 3.91Å; M679-F712 HydrophobicContact CE-CD1 4.04Å; M679-F712 HydrophobicContact CE-CD2 4.49Å; M679-F712 HydrophobicContact CE-CG 3.91Å; M679-F712 HydrophobicContact SD-CD1 3.93Å; M679-F712 HydrophobicContact SD-CD2 4.37Å; M679-F712 HydrophobicContact SD-CE1 4.04Å; M679-F712 HydrophobicContact SD-CE2 4.46Å; M679-F712 HydrophobicContact SD-CG 4.11Å; M679-F712 HydrophobicContact SD-CZ 4.3Å; M679-I715 HydrophobicContact CB-CG2 3.91Å; M679-I715 HydrophobicContact CE-CB 4.18Å; M679-I715 HydrophobicContact CE-CG2 4.16Å; M679-I715 WeakPolarHBondContact O-CG2 3.38Å; M679-L716 HydrophobicContact CE-CG 4.31Å
680	Q	97.6	Very high	97.4	Very high	102 Å²	102	42.7 Å²	42.7	48%	0.477	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	5.7	178.3	-67.1	175.8	91	0	0	112.6	Y676 Q677 C678 I715	Y676-Q680 PolarHBondContact O-NE2 3.44Å; Q677-Q680 CarbonylContact O-C 3.54Å; Q677-Q680 PolarHBondContact O-N 3.31Å; Q677-Q680 VanDerWaalsContact O-N 3.09Å; C678-Q680 PolarHBondContact O-N 3.05Å; C678-Q680 VanDerWaalsContact O-N 3.09Å; Q680-I715 HydrophobicContact CG-CD1 3.91Å; Q680-I715 HydrophobicContact CG-CG1 4.37Å; Q680-I715 HydrophobicContact CG-CG2 4.43Å
681	D	97.9	Very high	97.5	Very high	20 Å²	20	39.7 Å²	39.7	11%	0.107	19%	0.19	C	C	.	.			trans	-63.1	151.6	178.8	-162.3	-69.1	0	0	0	110.5	K641 Q677 C678 M683 V686 R687	K641-D681 IonicContact NZ-OD1 3.32Å; K641-D681 PolarHBondContact NZ-OD1 3.48Å; K641-D681 IonicContact NZ-OD2 3.95Å; K641-D681 PolarHBondContact NZ-OD2 2.88Å; Q677-D681 PolarHBondContact O-N 2.93Å; C678-D681 VanDerWaalsContact O-CB 3.32Å; C678-D681 WeakPolarHBondContact O-CB 3.47Å; C678-D681 PolarHBondContact O-N 3.37Å; D681-M683 VanDerWaalsContact C-N 3.34Å; D681-M683 WeakPolarHBondContact OD1-CB 3.06Å; D681-M683 PolarHBondContact OD1-N 3.06Å; D681-V686 HydrophobicContact CB-CB 3.97Å; D681-V686 HydrophobicContact CB-CG1 3.65Å; D681-R687 VanDerWaalsContact O-CD 3.27Å; D681-R687 WeakPolarHBondContact O-CD 3.43Å; D681-R687 WeakPolarHBondContact O-CG 3.38Å; D681-R687 PolarHBondContact O-NH1 3.29Å
682	K	95.3	Very high	97.5	Very high	179 Å²	179	39.6 Å²	39.6	78%	0.778	19%	0.19	S	C	*	.	S	Bend	trans	-71	-30.9	178.1	-63.3	-178.4	-178.8	178.8	0	112.3	P684 R687	K682-P684 WeakPolarHBondContact O-CD 3.48Å; K682-R687 PolarHBondContact O-NH1 3.48Å
683	M	95.3	Very high	97.5	Very high	65 Å²	65	38.3 Å²	38.3	32%	0.32	18%	0.183	S	C	.	.	S	Bend	trans	-76	119.5	-179.6	-175.9	171.8	-89.8	0	0	110.2	K641 I645 D681 E685 V686 R687	K641-M683 HydrophobicContact CB-CE 4.18Å; K641-M683 HydrophobicContact CB-SD 3.53Å; K641-M683 VanDerWaalsContact CB-SD 3.53Å; K641-M683 HydrophobicContact CD-CB 4.2Å; K641-M683 HydrophobicContact CD-CE 4.13Å; K641-M683 HydrophobicContact CD-SD 3.68Å; K641-M683 HydrophobicContact CG-SD 4.17Å; I645-M683 HydrophobicContact CD1-SD 4.05Å; D681-M683 VanDerWaalsContact C-N 3.34Å; D681-M683 WeakPolarHBondContact OD1-CB 3.06Å; D681-M683 PolarHBondContact OD1-N 3.06Å; M683-E685 VanDerWaalsContact C-N 3.34Å; M683-E685 HydrophobicContact CG-CB 4.29Å; M683-E685 WeakPolarHBondContact CG-OE2 3.26Å; M683-E685 PolarHBondContact O-N 3.36Å; M683-V686 HydrophobicContact CB-CB 4.4Å; M683-V686 HydrophobicContact CB-CG2 3.87Å; M683-V686 HydrophobicContact CG-CG2 3.97Å; M683-V686 PolarHBondContact O-N 2.89Å; M683-V686 HydrophobicContact SD-CG2 3.85Å; M683-R687 PolarHBondContact O-N 3.13Å; M683-R687 PolarHBondContact O-NH1 3.41Å
684	P	95.9	Very high	97.6	Very high	37 Å²	37	33.9 Å²	33.9	24%	0.24	16%	0.156	C	C	.	.	H	α-helix	trans	-51.5	-46	179.7	-28.8	36.1	0	0	0	114.6	K682 V686 R687 Q688 L724 V727	K682-P684 WeakPolarHBondContact O-CD 3.48Å; P684-V686 VanDerWaalsContact C-N 3.33Å; P684-V686 PolarHBondContact O-N 3.06Å; P684-R687 CarbonylContact O-C 3.16Å; P684-R687 WeakPolarHBondContact O-CA 3.27Å; P684-R687 WeakPolarHBondContact O-CB 3.47Å; P684-R687 PolarHBondContact O-N 2.91Å; P684-Q688 PolarHBondContact O-N 3.43Å; P684-L724 HydrophobicContact CB-CD1 4.37Å; P684-L724 HydrophobicContact CB-CD2 4.38Å; P684-L724 HydrophobicContact CG-CD1 4.25Å; P684-L724 HydrophobicContact CG-CD2 4.12Å; P684-V727 HydrophobicContact CB-CG2 3.75Å; P684-V727 VanDerWaalsContact O-CG2 3.31Å; P684-V727 WeakPolarHBondContact O-CG2 3.12Å
685	E	94.9	Very high	97.5	Very high	81 Å²	81	33.3 Å²	33.3	38%	0.379	15%	0.153	S	C	.	.	H	α-helix	trans	-59.5	-42.1	-175.6	-62.3	82.6	-177.3	0	0	111	S342 I645 M683 R687 Q688 S689	S342-E685 VanDerWaalsContact OG-C 3.31Å; S342-E685 WeakPolarHBondContact OG-CA 3.31Å; S342-E685 VanDerWaalsContact OG-CB 3.27Å; S342-E685 WeakPolarHBondContact OG-CB 3.48Å; S342-E685 PolarHBondContact OG-O 2.72Å; I645-E685 HydrophobicContact CD1-CB 3.6Å; I645-E685 HydrophobicContact CG1-CB 4.42Å; M683-E685 VanDerWaalsContact C-N 3.34Å; M683-E685 HydrophobicContact CG-CB 4.29Å; M683-E685 WeakPolarHBondContact CG-OE2 3.26Å; M683-E685 PolarHBondContact O-N 3.36Å; E685-R687 VanDerWaalsContact C-N 3.33Å; E685-R687 PolarHBondContact O-N 3.04Å; E685-Q688 WeakPolarHBondContact O-CB 3.31Å; E685-Q688 PolarHBondContact O-N 3.21Å; E685-S689 PolarHBondContact O-N 3.29Å; E685-S689 PolarHBondContact O-OG 3.32Å
686	V	97.8	Very high	97.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-42.2	173.2	179.6	0	0	0	0	111.7	K641 M644 I645 L648 C678 D681 M683 P684 S690	K641-V686 HydrophobicContact CB-CG2 4.3Å; K641-V686 HydrophobicContact CD-CG2 4.14Å; M644-V686 HydrophobicContact CE-CB 4.11Å; M644-V686 HydrophobicContact CE-CG1 3.43Å; M644-V686 VanDerWaalsContact CE-CG1 3.43Å; M644-V686 HydrophobicContact CE-CG2 3.47Å; M644-V686 VanDerWaalsContact CE-CG2 3.47Å; M644-V686 HydrophobicContact SD-CG1 4.06Å; I645-V686 HydrophobicContact CD1-CG2 4.07Å; I645-V686 HydrophobicContact CG1-CG2 3.73Å; L648-V686 HydrophobicContact CD1-CG1 4.47Å; C678-V686 HydrophobicContact CB-CG1 3.97Å; D681-V686 HydrophobicContact CB-CB 3.97Å; D681-V686 HydrophobicContact CB-CG1 3.65Å; M683-V686 HydrophobicContact CB-CB 4.4Å; M683-V686 HydrophobicContact CB-CG2 3.87Å; M683-V686 HydrophobicContact CG-CG2 3.97Å; M683-V686 PolarHBondContact O-N 2.89Å; M683-V686 HydrophobicContact SD-CG2 3.85Å; P684-V686 VanDerWaalsContact C-N 3.33Å; P684-V686 PolarHBondContact O-N 3.06Å; V686-S690 WeakPolarHBondContact O-CB 3.44Å; V686-S690 PolarHBondContact O-N 3.44Å; V686-S690 VanDerWaalsContact O-N 3.09Å; V686-S690 PolarHBondContact O-OG 2.97Å
687	R	98.3	Very high	97.6	Very high	27 Å²	27	28.8 Å²	28.8	10%	0.102	14%	0.135	C	C	.	.	H	α-helix	trans	-66.6	-46	177.8	-61.7	-164.7	-61.8	-76.8	-3.5	110.2	M679 D681 K682 M683 P684 E685 S689 S690 F691 N719 V727	M679-R687 WeakPolarHBondContact O-CD 3.47Å; D681-R687 VanDerWaalsContact O-CD 3.27Å; D681-R687 WeakPolarHBondContact O-CD 3.43Å; D681-R687 WeakPolarHBondContact O-CG 3.38Å; D681-R687 PolarHBondContact O-NH1 3.29Å; K682-R687 PolarHBondContact O-NH1 3.48Å; M683-R687 PolarHBondContact O-N 3.13Å; M683-R687 PolarHBondContact O-NH1 3.41Å; P684-R687 CarbonylContact O-C 3.16Å; P684-R687 WeakPolarHBondContact O-CA 3.27Å; P684-R687 WeakPolarHBondContact O-CB 3.47Å; P684-R687 PolarHBondContact O-N 2.91Å; E685-R687 VanDerWaalsContact C-N 3.33Å; E685-R687 PolarHBondContact O-N 3.04Å; R687-S689 PolarHBondContact O-N 2.91Å; R687-S690 PolarHBondContact O-N 3.24Å; R687-S690 PolarHBondContact O-OG 3.15Å; R687-F691 HydrophobicContact CB-CE2 3.88Å; R687-F691 HydrophobicContact CB-CZ 4.26Å; R687-F691 WeakPolarHBondContact O-CD2 3.32Å; R687-F691 VanDerWaalsContact O-CG 3.28Å; R687-F691 WeakPolarHBondContact O-CG 3.43Å; R687-F691 PolarHBondContact O-N 2.99Å; R687-N719 WeakPolarHBondContact CD-OD1 3.25Å; R687-N719 PolarHBondContact NE-OD1 3.32Å; R687-V727 HydrophobicContact CB-CG1 4.11Å
688	Q	97.4	Very high	97.6	Very high	13 Å²	13	25.4 Å²	25.4	6%	0.061	12%	0.12	C	C	.	.	H	α-helix	trans	-52.5	-55.2	177.2	175.1	-176.7	-16	0	0	112.2	S342 R343 T344 P684 E685 S690 F691 A692 S726 V727 N730	S342-Q688 PolarHBondContact O-NE2 2.95Å; R343-Q688 VanDerWaalsContact C-NE2 3.26Å; R343-Q688 PolarHBondContact O-NE2 3.12Å; T344-Q688 PolarHBondContact OG1-NE2 3.26Å; T344-Q688 VanDerWaalsContact OG1-NE2 3.1Å; P684-Q688 PolarHBondContact O-N 3.43Å; E685-Q688 WeakPolarHBondContact O-CB 3.31Å; E685-Q688 PolarHBondContact O-N 3.21Å; Q688-S690 VanDerWaalsContact C-N 3.33Å; Q688-S690 PolarHBondContact O-N 3.4Å; Q688-F691 PolarHBondContact O-N 2.95Å; Q688-A692 PolarHBondContact O-N 2.96Å; Q688-A692 VanDerWaalsContact O-N 3.13Å; Q688-S726 VanDerWaalsContact OE1-CB 3.28Å; Q688-V727 HydrophobicContact CB-CG2 4.08Å; Q688-N730 WeakPolarHBondContact CG-ND2 3.14Å; Q688-N730 PolarHBondContact O-ND2 3.01Å
689	S	97.6	Very high	97.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.7	-36.9	179.1	-67.4	0	0	0	0	112.4	S342 I645 D649 E685 R687 F691 A692 L693	S342-S689 PolarHBondContact OG-OG 3.33Å; S342-S689 VanDerWaalsContact OG-OG 3.1Å; I645-S689 VanDerWaalsContact CG2-OG 3.27Å; I645-S689 WeakPolarHBondContact CG2-OG 3.27Å; D649-S689 VanDerWaalsContact CG-OG 3.26Å; D649-S689 WeakPolarHBondContact OD1-CA 3.28Å; D649-S689 WeakPolarHBondContact OD1-CB 3.3Å; D649-S689 PolarHBondContact OD1-OG 3.37Å; D649-S689 PolarHBondContact OD2-OG 2.98Å; E685-S689 PolarHBondContact O-N 3.29Å; E685-S689 PolarHBondContact O-OG 3.32Å; R687-S689 PolarHBondContact O-N 2.91Å; S689-F691 VanDerWaalsContact C-N 3.33Å; S689-F691 PolarHBondContact O-N 3.41Å; S689-A692 PolarHBondContact O-N 3.48Å; S689-L693 PolarHBondContact O-N 3.15Å
690	S	98.6	Very high	97.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.2	-32.7	176	77.9	0	0	0	0	113.4	M679 V686 R687 Q688 L694	M679-S690 WeakPolarHBondContact CA-OG 3.46Å; M679-S690 VanDerWaalsContact CG-OG 3.3Å; M679-S690 WeakPolarHBondContact CG-OG 3.27Å; V686-S690 WeakPolarHBondContact O-CB 3.44Å; V686-S690 PolarHBondContact O-N 3.44Å; V686-S690 VanDerWaalsContact O-N 3.09Å; V686-S690 PolarHBondContact O-OG 2.97Å; R687-S690 PolarHBondContact O-N 3.24Å; R687-S690 PolarHBondContact O-OG 3.15Å; Q688-S690 VanDerWaalsContact C-N 3.33Å; Q688-S690 PolarHBondContact O-N 3.4Å; S690-L694 WeakPolarHBondContact O-CB 3.37Å; S690-L694 PolarHBondContact O-N 3.45Å
691	F	98.6	Very high	97.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-74.8	-36.3	176.4	-61.8	-38.2	0	0	0	112.2	M679 R687 Q688 S689 L694 G695 I715 L716 N719 V727 N730 A731	M679-F691 HydrophobicContact CB-CE1 3.79Å; M679-F691 HydrophobicContact CB-CZ 4.39Å; M679-F691 HydrophobicContact CE-CD1 4.04Å; M679-F691 HydrophobicContact CE-CE1 3.62Å; M679-F691 HydrophobicContact CG-CD1 3.95Å; M679-F691 HydrophobicContact CG-CE1 3.62Å; M679-F691 HydrophobicContact SD-CE1 4.41Å; R687-F691 HydrophobicContact CB-CE2 3.88Å; R687-F691 HydrophobicContact CB-CZ 4.26Å; R687-F691 WeakPolarHBondContact O-CD2 3.32Å; R687-F691 VanDerWaalsContact O-CG 3.28Å; R687-F691 WeakPolarHBondContact O-CG 3.43Å; R687-F691 PolarHBondContact O-N 2.99Å; Q688-F691 PolarHBondContact O-N 2.95Å; S689-F691 VanDerWaalsContact C-N 3.33Å; S689-F691 PolarHBondContact O-N 3.41Å; F691-L694 PolarHBondContact O-N 2.99Å; F691-G695 PolarHBondContact O-N 3.18Å; F691-G695 VanDerWaalsContact O-N 3.08Å; F691-I715 HydrophobicContact CE1-CG2 4.38Å; F691-I715 HydrophobicContact CZ-CG2 4.38Å; F691-L716 HydrophobicContact CD1-CD2 3.51Å; F691-L716 HydrophobicContact CE1-CD2 3.76Å; F691-L716 HydrophobicContact CE1-CG 4.49Å; F691-L716 HydrophobicContact CG-CD2 4.07Å; F691-L716 HydrophobicContact CZ-CD2 4.49Å; F691-N719 HydrophobicContact CE2-CB 3.67Å; F691-N719 HydrophobicContact CZ-CB 3.83Å; F691-V727 HydrophobicContact CD2-CG1 4.05Å; F691-V727 HydrophobicContact CE2-CG1 3.63Å; F691-N730 HydrophobicContact CB-CB 3.89Å; F691-A731 HydrophobicContact CD2-CB 3.8Å; F691-A731 HydrophobicContact CE2-CB 4.07Å; F691-A731 HydrophobicContact CG-CB 4.24Å
692	A	97.7	Very high	97.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-58.6	-52.1	170.2	0	0	0	0	0	110.7	V345 S652 Q688 S689 L694 G695 D696 W733	V345-A692 HydrophobicContact CG2-CB 4.25Å; S652-A692 VanDerWaalsContact OG-C 3.28Å; S652-A692 PolarHBondContact OG-O 3.43Å; Q688-A692 PolarHBondContact O-N 2.96Å; Q688-A692 VanDerWaalsContact O-N 3.13Å; S689-A692 PolarHBondContact O-N 3.48Å; A692-L694 VanDerWaalsContact C-N 3.29Å; A692-L694 PolarHBondContact O-N 2.89Å; A692-G695 PolarHBondContact O-N 2.89Å; A692-G695 VanDerWaalsContact O-N 3.1Å; A692-D696 PolarHBondContact O-N 3Å; A692-W733 WeakPolarHBondContact O-CZ3 3.41Å
693	L	98.5	Very high	97.6	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-58.6	-40.1	177.3	178	60.4	0	0	0	112.4	L648 L651 S652 I671 M675 S689 G695 D696 L697	L648-L693 HydrophobicContact CD2-CD2 3.75Å; L651-L693 HydrophobicContact CB-CD1 3.79Å; L651-L693 HydrophobicContact CB-CD2 4.03Å; L651-L693 HydrophobicContact CD1-CD2 4.34Å; S652-L693 WeakPolarHBondContact OG-CA 3.42Å; S652-L693 PolarHBondContact OG-N 2.88Å; I671-L693 HydrophobicContact CD1-CD2 4.07Å; I671-L693 HydrophobicContact CG1-CD2 4.16Å; M675-L693 HydrophobicContact CG-CD2 4.2Å; M675-L693 HydrophobicContact SD-CD2 3.86Å; M675-L693 HydrophobicContact SD-CG 3.89Å; S689-L693 PolarHBondContact O-N 3.15Å; L693-G695 PolarHBondContact O-N 3.42Å; L693-D696 PolarHBondContact O-N 3.34Å; L693-L697 HydrophobicContact CD1-CD1 3.95Å; L693-L697 HydrophobicContact CD1-CD2 4.42Å; L693-L697 HydrophobicContact CD1-CG 3.83Å; L693-L697 HydrophobicContact CG-CD1 3.96Å; L693-L697 HydrophobicContact CG-CG 4.25Å; L693-L697 WeakPolarHBondContact O-CB 3.4Å; L693-L697 WeakPolarHBondContact O-CG 3.29Å; L693-L697 PolarHBondContact O-N 3.27Å
694	L	98.7	Very high	97.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.4	-44.4	177	174.8	60.6	0	0	0	111.9	M675 M679 S690 F691 A692 T698 V705 F712 L716 I738	M675-L694 HydrophobicContact CE-CB 4.43Å; M675-L694 HydrophobicContact CE-CD1 3.87Å; M679-L694 HydrophobicContact CE-CD2 3.83Å; M679-L694 HydrophobicContact SD-CD2 4.23Å; S690-L694 WeakPolarHBondContact O-CB 3.37Å; S690-L694 PolarHBondContact O-N 3.45Å; F691-L694 PolarHBondContact O-N 2.99Å; A692-L694 VanDerWaalsContact C-N 3.29Å; A692-L694 PolarHBondContact O-N 2.89Å; L694-T698 VanDerWaalsContact O-CB 3.26Å; L694-T698 WeakPolarHBondContact O-CB 3.34Å; L694-T698 PolarHBondContact O-N 3.27Å; L694-T698 PolarHBondContact O-OG1 2.69Å; L694-V705 HydrophobicContact CD1-CG1 3.68Å; L694-F712 HydrophobicContact CD1-CD2 3.65Å; L694-F712 HydrophobicContact CD1-CE2 3.82Å; L694-F712 HydrophobicContact CD2-CD2 4.08Å; L694-L716 HydrophobicContact CD2-CD1 3.98Å; L694-L716 HydrophobicContact CD2-CD2 4.34Å; L694-L716 HydrophobicContact CD2-CG 4.44Å; L694-I738 HydrophobicContact CD2-CD1 4.17Å; L694-I738 HydrophobicContact CG-CD1 4.37Å
695	G	97.9	Very high	97.8	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-66.6	-40.4	177.7	0	0	0	0	0	112.4	F691 A692 L693 T698 K699 W733	F691-G695 PolarHBondContact O-N 3.18Å; F691-G695 VanDerWaalsContact O-N 3.08Å; A692-G695 PolarHBondContact O-N 2.89Å; A692-G695 VanDerWaalsContact O-N 3.1Å; L693-G695 PolarHBondContact O-N 3.42Å; G695-T698 WeakPolarHBondContact O-CB 3.46Å; G695-T698 PolarHBondContact O-N 2.97Å; G695-K699 PolarHBondContact O-N 3.42Å; G695-W733 VanDerWaalsContact CA-CZ3 3.42Å
696	D	98.1	Very high	98	Very high	4 Å²	4	19.1 Å²	19.1	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-67.3	-42.9	176.8	-75.4	-37.2	0	0	0	112.9	R343 S652 A655 A692 L693 T698 K699 A700 W733	R343-D696 IonicContact NH1-OD2 3.68Å; S652-D696 PolarHBondContact OG-OD2 2.93Å; A655-D696 HydrophobicContact CB-CB 3.8Å; A692-D696 PolarHBondContact O-N 3Å; L693-D696 PolarHBondContact O-N 3.34Å; D696-T698 PolarHBondContact O-N 3.46Å; D696-K699 PolarHBondContact O-N 3.42Å; D696-K699 WeakPolarHBondContact OD1-CE 2.96Å; D696-K699 IonicContact OD1-NZ 3.77Å; D696-K699 PolarHBondContact OD1-NZ 2.94Å; D696-A700 WeakPolarHBondContact O-CB 3.41Å; D696-A700 PolarHBondContact O-N 3.48Å; D696-W733 WeakPolarHBondContact OD1-CH2 3.41Å
697	L	98.4	Very high	98	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-30.5	173.3	-70.7	-179.9	0	0	0	112.5	A655 V666 L672 M675 L693 A700 C701 V705	A655-L697 HydrophobicContact CB-CD2 3.95Å; A655-L697 HydrophobicContact CB-CG 4.5Å; V666-L697 HydrophobicContact CG2-CD2 3.75Å; L672-L697 HydrophobicContact CD2-CD1 4.31Å; M675-L697 HydrophobicContact CE-CD1 4.35Å; M675-L697 HydrophobicContact SD-CD1 3.74Å; L693-L697 HydrophobicContact CD1-CD1 3.95Å; L693-L697 HydrophobicContact CD1-CD2 4.42Å; L693-L697 HydrophobicContact CD1-CG 3.83Å; L693-L697 HydrophobicContact CG-CD1 3.96Å; L693-L697 HydrophobicContact CG-CG 4.25Å; L693-L697 WeakPolarHBondContact O-CB 3.4Å; L693-L697 WeakPolarHBondContact O-CG 3.29Å; L693-L697 PolarHBondContact O-N 3.27Å; L697-A700 PolarHBondContact O-N 2.97Å; L697-C701 CarbonylContact O-C 3.6Å; L697-C701 PolarHBondContact O-N 3.41Å; L697-V705 HydrophobicContact CB-CG2 4.07Å
698	T	98.4	Very high	98	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65	-43	173.9	-66.4	0	0	0	0	111	L694 G695 D696 F702 E737 I738 Q741	L694-T698 VanDerWaalsContact O-CB 3.26Å; L694-T698 WeakPolarHBondContact O-CB 3.34Å; L694-T698 PolarHBondContact O-N 3.27Å; L694-T698 PolarHBondContact O-OG1 2.69Å; G695-T698 WeakPolarHBondContact O-CB 3.46Å; G695-T698 PolarHBondContact O-N 2.97Å; D696-T698 PolarHBondContact O-N 3.46Å; T698-F702 HydrophobicContact CG2-CD2 3.89Å; T698-F702 HydrophobicContact CG2-CE2 4.3Å; T698-F702 WeakPolarHBondContact O-CB 3.46Å; T698-E737 HydrophobicContact CG2-CB 4.15Å; T698-I738 HydrophobicContact CG2-CB 4.4Å; T698-I738 HydrophobicContact CG2-CG1 3.83Å; T698-Q741 HydrophobicContact CG2-CB 4.33Å; T698-Q741 HydrophobicContact CG2-CG 3.73Å
699	K	96.3	Very high	98	Very high	80 Å²	80	23.4 Å²	23.4	35%	0.348	12%	0.121	S	C	.	.	H	α-helix	trans	-65.8	-44	172.7	-71.5	-179	-67.8	174.9	0	112	G695 D696 W733 E737	G695-K699 PolarHBondContact O-N 3.42Å; D696-K699 PolarHBondContact O-N 3.42Å; D696-K699 WeakPolarHBondContact OD1-CE 2.96Å; D696-K699 IonicContact OD1-NZ 3.77Å; D696-K699 PolarHBondContact OD1-NZ 2.94Å; K699-W733 HydrophobicContact CD-CZ2 4.49Å; K699-E737 HydrophobicContact CD-CG 4.36Å; K699-E737 HydrophobicContact CG-CG 4.21Å; K699-E737 WeakPolarHBondContact CG-OE2 3.24Å
700	A	97.1	Very high	98	Very high	16 Å²	16	25.2 Å²	25.2	13%	0.132	14%	0.14	C	C	.	.	H	α-helix	trans	-77.2	-47.4	-170.5	0	0	0	0	0	114	G660 I662 D696 L697	G660-A700 WeakPolarHBondContact CA-O 3.23Å; I662-A700 HydrophobicContact CG2-CB 3.93Å; D696-A700 WeakPolarHBondContact O-CB 3.41Å; D696-A700 PolarHBondContact O-N 3.48Å; L697-A700 PolarHBondContact O-N 2.97Å
701	C	97.6	Very high	98	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-150.4	57.7	-170.6	56.6	0	0	0	0	112.9	E663 L697 Q703 H704	E663-C701 HydrophobicContact CB-CB 4.11Å; E663-C701 HydrophobicContact CG-CB 4.12Å; L697-C701 CarbonylContact O-C 3.6Å; L697-C701 PolarHBondContact O-N 3.41Å; C701-Q703 PolarHBondContact O-N 3.03Å; C701-H704 PolarHBondContact O-N 3.21Å
702	F	98.3	Very high	98	Very high	20 Å²	20	30 Å²	30	9%	0.088	17%	0.165	C	C	.	.	H	α-helix	trans	-52	-27.9	-177.1	-172.8	-120.8	0	0	0	115.2	T698 H704 V705 K706 I709 Q741 M742	T698-F702 HydrophobicContact CG2-CD2 3.89Å; T698-F702 HydrophobicContact CG2-CE2 4.3Å; T698-F702 WeakPolarHBondContact O-CB 3.46Å; F702-H704 PolarHBondContact O-N 3.42Å; F702-H704 VanDerWaalsContact O-N 3.09Å; F702-V705 HydrophobicContact CD2-CB 4.1Å; F702-V705 HydrophobicContact CE2-CB 4.5Å; F702-V705 PolarHBondContact O-N 2.99Å; F702-K706 HydrophobicContact CD1-CB 4.19Å; F702-K706 HydrophobicContact CE1-CB 3.78Å; F702-K706 HydrophobicContact CE1-CD 3.83Å; F702-K706 HydrophobicContact CE1-CG 3.94Å; F702-K706 HydrophobicContact CE2-CB 4.3Å; F702-K706 HydrophobicContact CZ-CB 3.82Å; F702-K706 HydrophobicContact CZ-CD 4.4Å; F702-K706 HydrophobicContact CZ-CG 4.03Å; F702-K706 WeakPolarHBondContact O-CB 3.49Å; F702-K706 PolarHBondContact O-N 3.22Å; F702-I709 HydrophobicContact CE2-CD1 4.26Å; F702-I709 HydrophobicContact CE2-CG1 4.23Å; F702-I709 HydrophobicContact CZ-CG1 4.41Å; F702-Q741 HydrophobicContact CB-CB 4.3Å; F702-Q741 HydrophobicContact CB-CG 4.21Å; F702-Q741 HydrophobicContact CD1-CB 3.6Å; F702-Q741 HydrophobicContact CD1-CG 4.43Å; F702-Q741 HydrophobicContact CD2-CB 3.73Å; F702-Q741 HydrophobicContact CD2-CG 4.14Å; F702-Q741 HydrophobicContact CE1-CB 3.72Å; F702-Q741 HydrophobicContact CE2-CB 3.88Å; F702-Q741 HydrophobicContact CG-CB 3.6Å; F702-Q741 HydrophobicContact CG-CG 4.01Å; F702-Q741 HydrophobicContact CZ-CB 3.87Å; F702-M742 HydrophobicContact CE1-SD 4.24Å; F702-M742 HydrophobicContact CZ-CG 3.77Å; F702-M742 HydrophobicContact CZ-SD 3.64Å
703	Q	97.7	Very high	98	Very high	107 Å²	107	30 Å²	30	50%	0.5	17%	0.165	S	C	.	.	H	α-helix	trans	-55.2	-28.9	177.6	65.9	-83.2	13.5	0	0	113.5	C701	C701-Q703 PolarHBondContact O-N 3.03Å
704	H	98.1	Very high	98	Very high	46 Å²	46	32.4 Å²	32.4	21%	0.213	18%	0.181	C	C	.	.	H	α-helix	trans	-87.8	-30.2	177.2	-61.2	-50.6	0	0	0	112.2	E663 V666 L672 C701 F702 P707	E663-H704 IonicContact OE1-CD2 2.88Å; E663-H704 IonicContact OE1-CE1 3.07Å; E663-H704 PolarHBondContact OE1-CE1 2.73Å; E663-H704 IonicContact OE1-NE2 3.44Å; E663-H704 PolarHBondContact OE1-NE2 3.39Å; V666-H704 HydrophobicContact CG1-CB 4.19Å; L672-H704 HydrophobicContact CD1-CB 4.04Å; L672-H704 WeakPolarHBondContact CD1-O 3.34Å; C701-H704 PolarHBondContact O-N 3.21Å; F702-H704 PolarHBondContact O-N 3.42Å; F702-H704 VanDerWaalsContact O-N 3.09Å; H704-P707 WeakPolarHBondContact O-CD 3.44Å
705	V	98.3	Very high	98	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-78.7	-37.5	179.5	-175.3	0	0	0	0	111.8	L672 L694 L697 F702 P707 C708 I709	L672-V705 HydrophobicContact CD2-CG2 4.29Å; L694-V705 HydrophobicContact CD1-CG1 3.68Å; L697-V705 HydrophobicContact CB-CG2 4.07Å; F702-V705 HydrophobicContact CD2-CB 4.1Å; F702-V705 HydrophobicContact CE2-CB 4.5Å; F702-V705 PolarHBondContact O-N 2.99Å; V705-P707 VanDerWaalsContact C-N 3.33Å; V705-P707 VanDerWaalsContact O-N 3.15Å; V705-C708 WeakPolarHBondContact O-CB 3.18Å; V705-C708 PolarHBondContact O-N 3.03Å; V705-I709 HydrophobicContact CG1-CD1 3.87Å
706	K	98.1	Very high	98	Very high	83 Å²	83	33.2 Å²	33.2	36%	0.361	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-48	-43.8	-175.6	-174.8	170.3	-175.1	164.1	0	114.1	F702 C708 I709 E745	F702-K706 HydrophobicContact CD1-CB 4.19Å; F702-K706 HydrophobicContact CE1-CB 3.78Å; F702-K706 HydrophobicContact CE1-CD 3.83Å; F702-K706 HydrophobicContact CE1-CG 3.94Å; F702-K706 HydrophobicContact CE2-CB 4.3Å; F702-K706 HydrophobicContact CZ-CB 3.82Å; F702-K706 HydrophobicContact CZ-CD 4.4Å; F702-K706 HydrophobicContact CZ-CG 4.03Å; F702-K706 WeakPolarHBondContact O-CB 3.49Å; F702-K706 PolarHBondContact O-N 3.22Å; K706-C708 PolarHBondContact O-N 3.49Å; K706-I709 PolarHBondContact O-N 3.2Å; K706-E745 VanDerWaalsContact CE-OE2 3.27Å; K706-E745 WeakPolarHBondContact CE-OE2 3.49Å; K706-E745 IonicContact NZ-OE1 3.41Å; K706-E745 PolarHBondContact NZ-OE1 3.07Å; K706-E745 IonicContact NZ-OE2 3.9Å; K706-E745 PolarHBondContact NZ-OE2 3.27Å
707	P	98.3	Very high	98	Very high	101 Å²	101	33.3 Å²	33.3	66%	0.656	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-60.6	-24.2	177.2	-24.3	35.8	0	0	0	115.1	H704 V705	H704-P707 WeakPolarHBondContact O-CD 3.44Å; V705-P707 VanDerWaalsContact C-N 3.33Å; V705-P707 VanDerWaalsContact O-N 3.15Å
708	C	98.2	Very high	97.9	Very high	28 Å²	28	38.2 Å²	38.2	19%	0.189	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-94.8	-9.2	-175.8	-59	0	0	0	0	113.6	V705 K706 G710 D711 F712	V705-C708 WeakPolarHBondContact O-CB 3.18Å; V705-C708 PolarHBondContact O-N 3.03Å; K706-C708 PolarHBondContact O-N 3.49Å; C708-G710 PolarHBondContact O-N 3.09Å; C708-D711 PolarHBondContact O-N 2.74Å; C708-F712 HydrophobicContact CB-CD1 4.32Å; C708-F712 HydrophobicContact CB-CD2 3.83Å; C708-F712 HydrophobicContact CB-CE1 4.03Å; C708-F712 HydrophobicContact CB-CE2 3.52Å; C708-F712 HydrophobicContact CB-CG 4.23Å; C708-F712 HydrophobicContact CB-CZ 3.64Å; C708-F712 WeakPolarHBondContact O-CG 3.39Å; C708-F712 PolarHBondContact O-N 2.95Å
709	I	97.8	Very high	97.9	Very high	2 Å²	2	39 Å²	39	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-58.7	-34.7	-173.8	-66.8	-57.8	0	0	0	112.8	F702 V705 K706 D711 F712 M713 I738 M742 Y749	F702-I709 HydrophobicContact CE2-CD1 4.26Å; F702-I709 HydrophobicContact CE2-CG1 4.23Å; F702-I709 HydrophobicContact CZ-CG1 4.41Å; V705-I709 HydrophobicContact CG1-CD1 3.87Å; K706-I709 PolarHBondContact O-N 3.2Å; I709-D711 PolarHBondContact O-N 2.65Å; I709-F712 PolarHBondContact O-N 3.09Å; I709-M713 HydrophobicContact CG2-CG 3.71Å; I709-M713 WeakPolarHBondContact O-CB 3.48Å; I709-M713 WeakPolarHBondContact O-CG 3.35Å; I709-M713 PolarHBondContact O-N 3.44Å; I709-I738 HydrophobicContact CD1-CD1 3.93Å; I709-I738 HydrophobicContact CD1-CG1 4.04Å; I709-I738 HydrophobicContact CD1-CG2 3.74Å; I709-I738 HydrophobicContact CG1-CG2 4.48Å; I709-I738 HydrophobicContact CG2-CG2 4.43Å; I709-M742 HydrophobicContact CG2-CE 4.16Å; I709-M742 HydrophobicContact CG2-SD 4.37Å; I709-Y749 HydrophobicContact CG2-CE2 4.08Å
710	G	97.4	Very high	98	Very high	38 Å²	38	35.4 Å²	35.4	39%	0.392	21%	0.206	S	C	.	.	H	α-helix	trans	-60.1	-31.9	176.6	0	0	0	0	0	113.5	C708 P714	C708-G710 PolarHBondContact O-N 3.09Å; G710-P714 WeakPolarHBondContact O-CD 3.16Å
711	D	97.8	Very high	97.9	Very high	98 Å²	98	37.4 Å²	37.4	52%	0.524	21%	0.214	S	C	.	.	H	α-helix	trans	-91	-34.8	178.4	-60	-42.2	0	0	0	111.8	Y676 C708 I709 P714	Y676-D711 HydrophobicContact CE2-CB 4.13Å; C708-D711 PolarHBondContact O-N 2.74Å; I709-D711 PolarHBondContact O-N 2.65Å; D711-P714 WeakPolarHBondContact O-CD 3.2Å
712	F	98.5	Very high	97.6	Very high	3 Å²	3	38.5 Å²	38.5	1%	0.013	22%	0.221	C	C	.	.	H	α-helix	trans	-77.4	-37.8	-175.5	-70.2	-4.1	0	0	0	113.8	M675 Y676 M679 L694 C708 I709 I715 L716	M675-F712 HydrophobicContact CE-CE2 3.75Å; M675-F712 HydrophobicContact CE-CZ 4.06Å; Y676-F712 HydrophobicContact CD2-CD1 4.24Å; Y676-F712 AromaticContact CD2-CE1 3.94Å; Y676-F712 HydrophobicContact CD2-CE1 3.94Å; Y676-F712 HydrophobicContact CG-CE1 4.49Å; M679-F712 HydrophobicContact CE-CB 3.91Å; M679-F712 HydrophobicContact CE-CD1 4.04Å; M679-F712 HydrophobicContact CE-CD2 4.49Å; M679-F712 HydrophobicContact CE-CG 3.91Å; M679-F712 HydrophobicContact SD-CD1 3.93Å; M679-F712 HydrophobicContact SD-CD2 4.37Å; M679-F712 HydrophobicContact SD-CE1 4.04Å; M679-F712 HydrophobicContact SD-CE2 4.46Å; M679-F712 HydrophobicContact SD-CG 4.11Å; M679-F712 HydrophobicContact SD-CZ 4.3Å; L694-F712 HydrophobicContact CD1-CD2 3.65Å; L694-F712 HydrophobicContact CD1-CE2 3.82Å; L694-F712 HydrophobicContact CD2-CD2 4.08Å; C708-F712 HydrophobicContact CB-CD1 4.32Å; C708-F712 HydrophobicContact CB-CD2 3.83Å; C708-F712 HydrophobicContact CB-CE1 4.03Å; C708-F712 HydrophobicContact CB-CE2 3.52Å; C708-F712 HydrophobicContact CB-CG 4.23Å; C708-F712 HydrophobicContact CB-CZ 3.64Å; C708-F712 WeakPolarHBondContact O-CG 3.39Å; C708-F712 PolarHBondContact O-N 2.95Å; I709-F712 PolarHBondContact O-N 3.09Å; F712-I715 PolarHBondContact O-N 2.9Å; F712-I715 VanDerWaalsContact O-N 3.09Å; F712-L716 PolarHBondContact O-N 3.21Å
713	M	98.2	Very high	97.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-41.7	-178.5	-78.3	-57.7	-52.6	0	0	114.1	I709 I715 L716 G717 I735 I738 M746 Y749 V753	I709-M713 HydrophobicContact CG2-CG 3.71Å; I709-M713 WeakPolarHBondContact O-CB 3.48Å; I709-M713 WeakPolarHBondContact O-CG 3.35Å; I709-M713 PolarHBondContact O-N 3.44Å; M713-I715 VanDerWaalsContact C-N 3.33Å; M713-I715 PolarHBondContact O-N 3.45Å; M713-L716 PolarHBondContact O-N 3.27Å; M713-L716 HydrophobicContact SD-CD1 4.02Å; M713-G717 PolarHBondContact O-N 3.1Å; M713-I735 HydrophobicContact CE-CG1 4.25Å; M713-I735 HydrophobicContact CE-CG2 4.27Å; M713-I738 HydrophobicContact SD-CD1 4.44Å; M713-I738 HydrophobicContact SD-CG2 4.32Å; M713-M746 HydrophobicContact CE-CE 3.4Å; M713-M746 HydrophobicContact SD-CE 3.82Å; M713-Y749 HydrophobicContact CB-CD1 3.55Å; M713-Y749 HydrophobicContact CB-CE1 3.98Å; M713-Y749 HydrophobicContact CB-CG 4.05Å; M713-Y749 HydrophobicContact CG-CD1 3.85Å; M713-Y749 HydrophobicContact CG-CD2 4.34Å; M713-Y749 HydrophobicContact CG-CE1 4.25Å; M713-Y749 HydrophobicContact CG-CG 3.9Å; M713-V753 HydrophobicContact CE-CG1 3.87Å
714	P	98.3	Very high	97	Very high	52 Å²	52	42.7 Å²	42.7	34%	0.338	24%	0.243	S	C	.	.	H	α-helix	trans	-56.9	-43	170.6	-24.4	31.9	0	0	0	114	G710 D711 G717 T718 M752	G710-P714 WeakPolarHBondContact O-CD 3.16Å; D711-P714 WeakPolarHBondContact O-CD 3.2Å; P714-G717 PolarHBondContact O-N 3.23Å; P714-T718 PolarHBondContact O-N 2.77Å; P714-T718 PolarHBondContact O-OG1 3.01Å; P714-M752 VanDerWaalsContact CA-CE 3.47Å; P714-M752 HydrophobicContact CB-CE 3.94Å; P714-M752 HydrophobicContact CG-CE 3.98Å
715	I	98.5	Very high	96.8	Very high	17 Å²	17	43.8 Å²	43.8	9%	0.087	25%	0.249	C	C	.	.	H	α-helix	trans	-66.6	-45.1	-178.8	-59.7	167.1	0	0	0	110.5	Y676 M679 Q680 F691 F712 M713 G717 T718 N719	Y676-I715 HydrophobicContact CD2-CD1 3.98Å; Y676-I715 HydrophobicContact CE2-CD1 3.79Å; M679-I715 HydrophobicContact CB-CG2 3.91Å; M679-I715 HydrophobicContact CE-CB 4.18Å; M679-I715 HydrophobicContact CE-CG2 4.16Å; M679-I715 WeakPolarHBondContact O-CG2 3.38Å; Q680-I715 HydrophobicContact CG-CD1 3.91Å; Q680-I715 HydrophobicContact CG-CG1 4.37Å; Q680-I715 HydrophobicContact CG-CG2 4.43Å; F691-I715 HydrophobicContact CE1-CG2 4.38Å; F691-I715 HydrophobicContact CZ-CG2 4.38Å; F712-I715 PolarHBondContact O-N 2.9Å; F712-I715 VanDerWaalsContact O-N 3.09Å; M713-I715 VanDerWaalsContact C-N 3.33Å; M713-I715 PolarHBondContact O-N 3.45Å; I715-G717 VanDerWaalsContact C-N 3.33Å; I715-G717 PolarHBondContact O-N 3.06Å; I715-T718 PolarHBondContact O-N 3.37Å; I715-T718 PolarHBondContact O-OG1 3.44Å; I715-N719 PolarHBondContact O-N 3.44Å; I715-N719 PolarHBondContact O-ND2 2.82Å
716	L	98.4	Very high	96.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.1	-46.2	174.1	-72	166.3	0	0	0	111.1	M679 F691 L694 F712 M713 T718 N719 L720 A731 A734 I735 I738	M679-L716 HydrophobicContact CE-CG 4.31Å; F691-L716 HydrophobicContact CD1-CD2 3.51Å; F691-L716 HydrophobicContact CE1-CD2 3.76Å; F691-L716 HydrophobicContact CE1-CG 4.49Å; F691-L716 HydrophobicContact CG-CD2 4.07Å; F691-L716 HydrophobicContact CZ-CD2 4.49Å; L694-L716 HydrophobicContact CD2-CD1 3.98Å; L694-L716 HydrophobicContact CD2-CD2 4.34Å; L694-L716 HydrophobicContact CD2-CG 4.44Å; F712-L716 PolarHBondContact O-N 3.21Å; M713-L716 PolarHBondContact O-N 3.27Å; M713-L716 HydrophobicContact SD-CD1 4.02Å; L716-T718 VanDerWaalsContact C-N 3.28Å; L716-T718 PolarHBondContact O-N 2.83Å; L716-N719 CarbonylContact O-C 3.37Å; L716-N719 PolarHBondContact O-N 3.13Å; L716-L720 PolarHBondContact O-N 2.8Å; L716-A731 HydrophobicContact CD2-CB 3.92Å; L716-A734 HydrophobicContact CD2-CB 4.24Å; L716-I735 HydrophobicContact CB-CD1 4.02Å; L716-I735 HydrophobicContact CB-CG1 3.9Å; L716-I735 HydrophobicContact CD1-CG1 3.94Å; L716-I735 HydrophobicContact CG-CG1 4.36Å; L716-I738 HydrophobicContact CD1-CD1 3.75Å
717	G	97.6	Very high	96.5	Very high	5 Å²	5	42 Å²	42	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-32.7	177.6	0	0	0	0	0	114	M713 P714 I715 N719 Q756	M713-G717 PolarHBondContact O-N 3.1Å; P714-G717 PolarHBondContact O-N 3.23Å; I715-G717 VanDerWaalsContact C-N 3.33Å; I715-G717 PolarHBondContact O-N 3.06Å; G717-N719 VanDerWaalsContact C-N 3.34Å; G717-Q756 PolarHBondContact O-NE2 3.4Å; G717-Q756 PolarHBondContact O-OE1 3.15Å
718	T	97.4	Very high	96.4	Very high	105 Å²	105	37.1 Å²	37.1	64%	0.644	22%	0.216	S	C	*	.	H	α-helix	trans	-77	-18.5	173.7	54.1	0	0	0	0	114.2	P714 I715 L716	P714-T718 PolarHBondContact O-N 2.77Å; P714-T718 PolarHBondContact O-OG1 3.01Å; I715-T718 PolarHBondContact O-N 3.37Å; I715-T718 PolarHBondContact O-OG1 3.44Å; L716-T718 VanDerWaalsContact C-N 3.28Å; L716-T718 PolarHBondContact O-N 2.83Å
719	N	98	Very high	96.4	Very high	18 Å²	18	35.9 Å²	35.9	10%	0.096	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	6.8	179.3	-78.1	-87.5	0	0	0	113.1	R687 F691 I715 L716 G717 N721 V727 C728 A731	R687-N719 WeakPolarHBondContact CD-OD1 3.25Å; R687-N719 PolarHBondContact NE-OD1 3.32Å; F691-N719 HydrophobicContact CE2-CB 3.67Å; F691-N719 HydrophobicContact CZ-CB 3.83Å; I715-N719 PolarHBondContact O-N 3.44Å; I715-N719 PolarHBondContact O-ND2 2.82Å; L716-N719 CarbonylContact O-C 3.37Å; L716-N719 PolarHBondContact O-N 3.13Å; G717-N719 VanDerWaalsContact C-N 3.34Å; N719-N721 PolarHBondContact O-N 2.87Å; N719-V727 HydrophobicContact CB-CG1 4.2Å; N719-C728 WeakPolarHBondContact O-CA 3.35Å; N719-A731 HydrophobicContact CB-CB 4.26Å
720	L	98	Very high	96.4	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	21%	0.207	C	C	.	.			trans	-75.7	48.8	165.3	-64.2	179.4	0	0	0	111.2	L716 T732 I735 V753 Q756 L757 I760	L716-L720 PolarHBondContact O-N 2.8Å; L720-T732 WeakPolarHBondContact CD2-OG1 3.37Å; L720-I735 HydrophobicContact CD1-CD1 4.02Å; L720-I735 HydrophobicContact CD2-CD1 3.97Å; L720-I735 HydrophobicContact CG-CD1 4.21Å; L720-V753 HydrophobicContact CD1-CB 3.92Å; L720-V753 HydrophobicContact CD1-CG1 4.13Å; L720-Q756 HydrophobicContact CB-CB 4.06Å; L720-Q756 HydrophobicContact CD1-CB 3.99Å; L720-Q756 PolarHBondContact O-OE1 3.16Å; L720-L757 HydrophobicContact CD1-CD2 4.19Å; L720-L757 HydrophobicContact CD1-CG 4.16Å; L720-L757 HydrophobicContact CD2-CD2 4.07Å; L720-I760 HydrophobicContact CB-CD1 4.19Å
721	N	94.9	Very high	96.5	Very high	57 Å²	57	34 Å²	34	31%	0.305	19%	0.188	S	C	.	.			trans	-103.9	109.6	177	-179.9	7.3	0	0	0	109.7	N719 E723 L724 C728	N719-N721 PolarHBondContact O-N 2.87Å; N721-E723 PolarHBondContact ND2-OE2 3.42Å; N721-E723 VanDerWaalsContact ND2-OE2 3.14Å; N721-E723 PolarHBondContact O-N 3.38Å; N721-E723 VanDerWaalsContact O-N 3.12Å; N721-E723 WeakPolarHBondContact OD1-CB 3.42Å; N721-E723 WeakPolarHBondContact OD1-CG 3.42Å; N721-E723 PolarHBondContact OD1-N 3.13Å; N721-E723 VanDerWaalsContact OD1-N 3.11Å; N721-L724 PolarHBondContact O-N 3.04Å; N721-C728 WeakPolarHBondContact O-CB 3.23Å
722	P	91.4	Very high	96.5	Very high	25 Å²	25	29.3 Å²	29.3	16%	0.162	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	5.5	-175.9	36.3	-39.5	0	0	0	113.9	L724 I760 R763	P722-L724 VanDerWaalsContact C-N 3.3Å; P722-I760 HydrophobicContact CB-CG1 4.34Å; P722-I760 HydrophobicContact CG-CG1 4.36Å; P722-R763 PolarHBondContact O-NH1 3.38Å
723	E	91.8	Very high	96.5	Very high	153 Å²	153	29.4 Å²	29.4	72%	0.715	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-27	162.5	-65.2	176.1	161.9	0	0	112.1	N721	N721-E723 PolarHBondContact ND2-OE2 3.42Å; N721-E723 VanDerWaalsContact ND2-OE2 3.14Å; N721-E723 PolarHBondContact O-N 3.38Å; N721-E723 VanDerWaalsContact O-N 3.12Å; N721-E723 WeakPolarHBondContact OD1-CB 3.42Å; N721-E723 WeakPolarHBondContact OD1-CG 3.42Å; N721-E723 PolarHBondContact OD1-N 3.13Å; N721-E723 VanDerWaalsContact OD1-N 3.11Å
724	L	93.1	Very high	96.5	Very high	61 Å²	61	29.4 Å²	29.4	32%	0.319	16%	0.164	S	C	.	.	S	Bend	trans	-112.2	78.5	175.4	-61.5	177.8	0	0	0	108.5	P684 N721 P722 S726 V727 C728	P684-L724 HydrophobicContact CB-CD1 4.37Å; P684-L724 HydrophobicContact CB-CD2 4.38Å; P684-L724 HydrophobicContact CG-CD1 4.25Å; P684-L724 HydrophobicContact CG-CD2 4.12Å; N721-L724 PolarHBondContact O-N 3.04Å; P722-L724 VanDerWaalsContact C-N 3.3Å; L724-S726 PolarHBondContact O-N 3.33Å; L724-V727 HydrophobicContact CB-CB 4.01Å; L724-V727 HydrophobicContact CB-CG2 4.06Å; L724-V727 PolarHBondContact O-N 3.21Å; L724-C728 VanDerWaalsContact O-CB 3.3Å; L724-C728 WeakPolarHBondContact O-CB 3.45Å; L724-C728 PolarHBondContact O-N 3.44Å
725	I	92.5	Very high	96.5	Very high	69 Å²	69	27 Å²	27	35%	0.354	15%	0.147	S	C	.	.	H	α-helix	trans	-52.1	-55.3	-167.9	-68	159.7	0	0	0	111.8	V727 C728 N729 P767 L770	I725-V727 PolarHBondContact O-N 3.09Å; I725-C728 WeakPolarHBondContact O-CB 3.41Å; I725-C728 PolarHBondContact O-N 3.04Å; I725-N729 VanDerWaalsContact O-CB 3.29Å; I725-N729 WeakPolarHBondContact O-CB 3.25Å; I725-N729 PolarHBondContact O-N 2.91Å; I725-P767 HydrophobicContact CD1-CG 3.9Å; I725-P767 HydrophobicContact CG1-CG 4.46Å; I725-P767 HydrophobicContact CG2-CB 4.41Å; I725-P767 HydrophobicContact CG2-CG 3.9Å; I725-L770 HydrophobicContact CG2-CD2 4.31Å
726	S	92.5	Very high	96.5	Very high	41 Å²	41	26.1 Å²	26.1	29%	0.287	14%	0.143	S	C	.	.	H	α-helix	trans	-67.8	-35.5	-174.5	-44.5	0	0	0	0	112.9	Q688 L724 N729 N730	Q688-S726 VanDerWaalsContact OE1-CB 3.28Å; L724-S726 PolarHBondContact O-N 3.33Å; S726-N729 PolarHBondContact O-N 3.11Å; S726-N730 PolarHBondContact O-N 3.41Å; S726-N730 VanDerWaalsContact O-N 3.09Å
727	V	96.9	Very high	96.5	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.024	15%	0.146	C	C	.	.	H	α-helix	trans	-64.1	-48.7	172.2	-176.4	0	0	0	0	110.6	P684 R687 Q688 F691 N719 L724 I725 N729 N730 A731	P684-V727 HydrophobicContact CB-CG2 3.75Å; P684-V727 VanDerWaalsContact O-CG2 3.31Å; P684-V727 WeakPolarHBondContact O-CG2 3.12Å; R687-V727 HydrophobicContact CB-CG1 4.11Å; Q688-V727 HydrophobicContact CB-CG2 4.08Å; F691-V727 HydrophobicContact CD2-CG1 4.05Å; F691-V727 HydrophobicContact CE2-CG1 3.63Å; N719-V727 HydrophobicContact CB-CG1 4.2Å; L724-V727 HydrophobicContact CB-CB 4.01Å; L724-V727 HydrophobicContact CB-CG2 4.06Å; L724-V727 PolarHBondContact O-N 3.21Å; I725-V727 PolarHBondContact O-N 3.09Å; V727-N729 VanDerWaalsContact C-N 3.28Å; V727-N729 PolarHBondContact O-N 3.21Å; V727-N730 PolarHBondContact O-N 3.23Å; V727-A731 VanDerWaalsContact O-CB 3.3Å; V727-A731 WeakPolarHBondContact O-CB 3.13Å; V727-A731 PolarHBondContact O-N 2.94Å
728	C	98.1	Very high	96.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.9	-38.9	179.2	-174	0	0	0	0	111.2	N719 N721 L724 I725 T732 L770	N719-C728 WeakPolarHBondContact O-CA 3.35Å; N721-C728 WeakPolarHBondContact O-CB 3.23Å; L724-C728 VanDerWaalsContact O-CB 3.3Å; L724-C728 WeakPolarHBondContact O-CB 3.45Å; L724-C728 PolarHBondContact O-N 3.44Å; I725-C728 WeakPolarHBondContact O-CB 3.41Å; I725-C728 PolarHBondContact O-N 3.04Å; C728-T732 WeakPolarHBondContact O-CB 3.42Å; C728-T732 PolarHBondContact O-N 3.05Å; C728-T732 PolarHBondContact O-OG1 3.46Å; C728-L770 HydrophobicContact CB-CD1 4.42Å
729	N	97.4	Very high	96.6	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.011	11%	0.113	C	C	.	.	H	α-helix	trans	-60.9	-56	177.1	-178.9	72.6	0	0	0	111.7	V345 I725 S726 V727 A731 T732 W733 T769 L770 N773	V345-N729 PolarHBondContact O-ND2 2.94Å; I725-N729 VanDerWaalsContact O-CB 3.29Å; I725-N729 WeakPolarHBondContact O-CB 3.25Å; I725-N729 PolarHBondContact O-N 2.91Å; S726-N729 PolarHBondContact O-N 3.11Å; V727-N729 VanDerWaalsContact C-N 3.28Å; V727-N729 PolarHBondContact O-N 3.21Å; N729-A731 VanDerWaalsContact C-N 3.34Å; N729-A731 PolarHBondContact O-N 2.69Å; N729-T732 WeakPolarHBondContact O-CB 3.29Å; N729-T732 PolarHBondContact O-N 3.18Å; N729-W733 PolarHBondContact O-N 3.49Å; N729-T769 PolarHBondContact OD1-O 3.18Å; N729-L770 HydrophobicContact CB-CD1 4.05Å; N729-L770 WeakPolarHBondContact OD1-CA 3.32Å; N729-N773 PolarHBondContact ND2-ND2 3.03Å; N729-N773 PolarHBondContact OD1-ND2 3.18Å
730	N	97.9	Very high	96.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.9	-35.9	-178.3	-69.8	7.2	0	0	0	111.8	R343 V345 Q688 F691 S726 V727 W733 A734	R343-N730 PolarHBondContact O-ND2 2.87Å; V345-N730 PolarHBondContact N-OD1 3.24Å; Q688-N730 WeakPolarHBondContact CG-ND2 3.14Å; Q688-N730 PolarHBondContact O-ND2 3.01Å; F691-N730 HydrophobicContact CB-CB 3.89Å; S726-N730 PolarHBondContact O-N 3.41Å; S726-N730 VanDerWaalsContact O-N 3.09Å; V727-N730 PolarHBondContact O-N 3.23Å; N730-W733 PolarHBondContact O-N 2.9Å; N730-A734 VanDerWaalsContact O-CB 3.31Å; N730-A734 WeakPolarHBondContact O-CB 3.12Å; N730-A734 PolarHBondContact O-N 3.25Å
731	A	98.6	Very high	96.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.2	-44.5	173	0	0	0	0	0	111.6	F691 L716 N719 V727 N729 A734 I735	F691-A731 HydrophobicContact CD2-CB 3.8Å; F691-A731 HydrophobicContact CE2-CB 4.07Å; F691-A731 HydrophobicContact CG-CB 4.24Å; L716-A731 HydrophobicContact CD2-CB 3.92Å; N719-A731 HydrophobicContact CB-CB 4.26Å; V727-A731 VanDerWaalsContact O-CB 3.3Å; V727-A731 WeakPolarHBondContact O-CB 3.13Å; V727-A731 PolarHBondContact O-N 2.94Å; N729-A731 VanDerWaalsContact C-N 3.34Å; N729-A731 PolarHBondContact O-N 2.69Å; A731-A734 PolarHBondContact O-N 3.28Å; A731-I735 WeakPolarHBondContact O-CD1 3.18Å; A731-I735 VanDerWaalsContact O-CG1 3.26Å; A731-I735 WeakPolarHBondContact O-CG1 3.47Å; A731-I735 PolarHBondContact O-N 3.13Å
732	T	98.6	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-47.1	177.6	-64.4	0	0	0	0	111.4	L720 C728 N729 I735 G736 L757 N773 T777	L720-T732 WeakPolarHBondContact CD2-OG1 3.37Å; C728-T732 WeakPolarHBondContact O-CB 3.42Å; C728-T732 PolarHBondContact O-N 3.05Å; C728-T732 PolarHBondContact O-OG1 3.46Å; N729-T732 WeakPolarHBondContact O-CB 3.29Å; N729-T732 PolarHBondContact O-N 3.18Å; T732-I735 PolarHBondContact O-N 3.04Å; T732-G736 PolarHBondContact O-N 2.98Å; T732-L757 HydrophobicContact CG2-CD2 3.63Å; T732-N773 HydrophobicContact CG2-CB 4.46Å; T732-T777 HydrophobicContact CG2-CG2 4.35Å; T732-T777 WeakPolarHBondContact O-CG2 3.47Å; T732-T777 PolarHBondContact O-OG1 2.98Å
733	W	98.3	Very high	97	Very high	5 Å²	5	24.4 Å²	24.4	2%	0.019	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-45.7	177.5	174.7	84.6	0	0	0	111.9	V345 A692 G695 D696 K699 N729 N730 I735 G736 E737	V345-W733 HydrophobicContact CB-CD2 4.38Å; V345-W733 HydrophobicContact CB-CG 4.41Å; V345-W733 HydrophobicContact CG1-CD2 3.82Å; V345-W733 HydrophobicContact CG1-CE3 4.39Å; V345-W733 HydrophobicContact CG1-CG 3.86Å; V345-W733 HydrophobicContact CG1-CZ2 4.42Å; V345-W733 HydrophobicContact CG2-CD2 4.28Å; V345-W733 HydrophobicContact CG2-CE3 4.01Å; V345-W733 HydrophobicContact CG2-CZ3 4.23Å; A692-W733 WeakPolarHBondContact O-CZ3 3.41Å; G695-W733 VanDerWaalsContact CA-CZ3 3.42Å; D696-W733 WeakPolarHBondContact OD1-CH2 3.41Å; K699-W733 HydrophobicContact CD-CZ2 4.49Å; N729-W733 PolarHBondContact O-N 3.49Å; N730-W733 PolarHBondContact O-N 2.9Å; W733-I735 VanDerWaalsContact C-N 3.34Å; W733-I735 PolarHBondContact O-N 3.08Å; W733-G736 WeakPolarHBondContact O-CA 3.5Å; W733-G736 PolarHBondContact O-N 3.31Å; W733-E737 HydrophobicContact CD2-CG 4.29Å; W733-E737 HydrophobicContact CH2-CG 4.37Å; W733-E737 HydrophobicContact CZ2-CG 3.86Å; W733-E737 PolarHBondContact O-N 3.3Å
734	A	98.6	Very high	97.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.7	-40.5	177.6	0	0	0	0	0	112.7	L716 N730 A731 G736 E737 I738	L716-A734 HydrophobicContact CD2-CB 4.24Å; N730-A734 VanDerWaalsContact O-CB 3.31Å; N730-A734 WeakPolarHBondContact O-CB 3.12Å; N730-A734 PolarHBondContact O-N 3.25Å; A731-A734 PolarHBondContact O-N 3.28Å; A734-G736 VanDerWaalsContact C-N 3.27Å; A734-G736 PolarHBondContact O-N 3.36Å; A734-E737 PolarHBondContact O-N 3.33Å; A734-I738 WeakPolarHBondContact O-CB 3.46Å; A734-I738 WeakPolarHBondContact O-CD1 3.32Å; A734-I738 VanDerWaalsContact O-CG1 3.24Å; A734-I738 WeakPolarHBondContact O-CG1 3.44Å; A734-I738 PolarHBondContact O-N 2.97Å
735	I	98.8	Very high	97.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.8	-41.8	173.1	-67.5	160.9	0	0	0	110.6	M713 L716 L720 A731 T732 W733 I738 S739 M746 V753 T777	M713-I735 HydrophobicContact CE-CG1 4.25Å; M713-I735 HydrophobicContact CE-CG2 4.27Å; L716-I735 HydrophobicContact CB-CD1 4.02Å; L716-I735 HydrophobicContact CB-CG1 3.9Å; L716-I735 HydrophobicContact CD1-CG1 3.94Å; L716-I735 HydrophobicContact CG-CG1 4.36Å; L720-I735 HydrophobicContact CD1-CD1 4.02Å; L720-I735 HydrophobicContact CD2-CD1 3.97Å; L720-I735 HydrophobicContact CG-CD1 4.21Å; A731-I735 WeakPolarHBondContact O-CD1 3.18Å; A731-I735 VanDerWaalsContact O-CG1 3.26Å; A731-I735 WeakPolarHBondContact O-CG1 3.47Å; A731-I735 PolarHBondContact O-N 3.13Å; T732-I735 PolarHBondContact O-N 3.04Å; W733-I735 VanDerWaalsContact C-N 3.34Å; W733-I735 PolarHBondContact O-N 3.08Å; I735-I738 PolarHBondContact O-N 2.72Å; I735-S739 WeakPolarHBondContact O-CB 3.28Å; I735-S739 PolarHBondContact O-N 2.85Å; I735-S739 PolarHBondContact O-OG 3.2Å; I735-M746 HydrophobicContact CG2-CE 4.07Å; I735-V753 HydrophobicContact CD1-CB 4.4Å; I735-V753 HydrophobicContact CD1-CG1 3.93Å; I735-V753 HydrophobicContact CG2-CG2 4.36Å; I735-T777 HydrophobicContact CB-CG2 4.15Å; I735-T777 HydrophobicContact CG2-CG2 3.89Å
736	G	98.3	Very high	97.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.5	-49.1	177.2	0	0	0	0	0	112.4	T732 W733 A734 S739 I740 T777 R780	T732-G736 PolarHBondContact O-N 2.98Å; W733-G736 WeakPolarHBondContact O-CA 3.5Å; W733-G736 PolarHBondContact O-N 3.31Å; A734-G736 VanDerWaalsContact C-N 3.27Å; A734-G736 PolarHBondContact O-N 3.36Å; G736-S739 WeakPolarHBondContact O-CB 3.38Å; G736-S739 PolarHBondContact O-N 2.96Å; G736-I740 PolarHBondContact O-N 3.01Å; G736-T777 WeakPolarHBondContact CA-OG1 3.43Å; G736-R780 WeakPolarHBondContact O-CD 3.21Å
737	E	98.1	Very high	98	Very high	11 Å²	11	23.7 Å²	23.7	5%	0.051	13%	0.125	C	C	.	.	H	α-helix	trans	-62.8	-44.1	177.6	-68.7	-58.2	150.5	0	0	112.2	T698 K699 W733 A734 S739 I740 Q741 R780	T698-E737 HydrophobicContact CG2-CB 4.15Å; K699-E737 HydrophobicContact CD-CG 4.36Å; K699-E737 HydrophobicContact CG-CG 4.21Å; K699-E737 WeakPolarHBondContact CG-OE2 3.24Å; W733-E737 HydrophobicContact CD2-CG 4.29Å; W733-E737 HydrophobicContact CH2-CG 4.37Å; W733-E737 HydrophobicContact CZ2-CG 3.86Å; W733-E737 PolarHBondContact O-N 3.3Å; A734-E737 PolarHBondContact O-N 3.33Å; E737-S739 VanDerWaalsContact C-N 3.26Å; E737-S739 PolarHBondContact O-N 3.22Å; E737-I740 PolarHBondContact O-N 3.33Å; E737-Q741 PolarHBondContact O-N 2.92Å; E737-R780 IonicContact OE1-CZ 3.36Å; E737-R780 IonicContact OE1-NH1 2.65Å; E737-R780 PolarHBondContact OE1-NH1 3.05Å; E737-R780 IonicContact OE1-NH2 2.7Å; E737-R780 PolarHBondContact OE1-NH2 3.18Å; E737-R780 IonicContact OE2-NH1 3.64Å; E737-R780 IonicContact OE2-NH2 3.14Å
738	I	98.6	Very high	98	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.7	-40.5	176.1	-69.5	164.8	0	0	0	110.7	L694 T698 I709 M713 L716 A734 I735 I740 Q741 M742 M746	L694-I738 HydrophobicContact CD2-CD1 4.17Å; L694-I738 HydrophobicContact CG-CD1 4.37Å; T698-I738 HydrophobicContact CG2-CB 4.4Å; T698-I738 HydrophobicContact CG2-CG1 3.83Å; I709-I738 HydrophobicContact CD1-CD1 3.93Å; I709-I738 HydrophobicContact CD1-CG1 4.04Å; I709-I738 HydrophobicContact CD1-CG2 3.74Å; I709-I738 HydrophobicContact CG1-CG2 4.48Å; I709-I738 HydrophobicContact CG2-CG2 4.43Å; M713-I738 HydrophobicContact SD-CD1 4.44Å; M713-I738 HydrophobicContact SD-CG2 4.32Å; L716-I738 HydrophobicContact CD1-CD1 3.75Å; A734-I738 WeakPolarHBondContact O-CB 3.46Å; A734-I738 WeakPolarHBondContact O-CD1 3.32Å; A734-I738 VanDerWaalsContact O-CG1 3.24Å; A734-I738 WeakPolarHBondContact O-CG1 3.44Å; A734-I738 PolarHBondContact O-N 2.97Å; I735-I738 PolarHBondContact O-N 2.72Å; I738-I740 VanDerWaalsContact C-N 3.33Å; I738-I740 PolarHBondContact O-N 2.97Å; I738-Q741 PolarHBondContact O-N 3.34Å; I738-M742 HydrophobicContact CG2-CG 3.89Å; I738-M742 WeakPolarHBondContact O-CB 3.22Å; I738-M742 WeakPolarHBondContact O-CG 3.21Å; I738-M742 PolarHBondContact O-N 3.33Å; I738-M746 HydrophobicContact CG2-SD 4.42Å
739	S	98.3	Very high	98	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.3	-45.1	-178.6	-60	0	0	0	0	111.5	I735 G736 E737 Q741 M742 G743 L781 V784	I735-S739 WeakPolarHBondContact O-CB 3.28Å; I735-S739 PolarHBondContact O-N 2.85Å; I735-S739 PolarHBondContact O-OG 3.2Å; G736-S739 WeakPolarHBondContact O-CB 3.38Å; G736-S739 PolarHBondContact O-N 2.96Å; E737-S739 VanDerWaalsContact C-N 3.26Å; E737-S739 PolarHBondContact O-N 3.22Å; S739-Q741 VanDerWaalsContact C-N 3.34Å; S739-Q741 PolarHBondContact O-N 3.41Å; S739-M742 PolarHBondContact O-N 2.91Å; S739-G743 PolarHBondContact O-N 3.42Å; S739-L781 WeakPolarHBondContact OG-CD2 3.48Å; S739-V784 WeakPolarHBondContact O-CG1 3.34Å
740	I	97.9	Very high	98	Very high	56 Å²	56	30 Å²	30	29%	0.287	16%	0.16	S	C	.	.	H	α-helix	trans	-62.8	-40.4	179.1	-66.9	-58.8	0	0	0	111.7	G736 E737 I738 R780 Y783 V784	G736-I740 PolarHBondContact O-N 3.01Å; E737-I740 PolarHBondContact O-N 3.33Å; I738-I740 VanDerWaalsContact C-N 3.33Å; I738-I740 PolarHBondContact O-N 2.97Å; I740-R780 HydrophobicContact CD1-CB 3.96Å; I740-R780 HydrophobicContact CD1-CG 3.87Å; I740-R780 HydrophobicContact CG1-CB 4.15Å; I740-R780 HydrophobicContact CG1-CG 3.95Å; I740-Y783 HydrophobicContact CD1-CD1 3.91Å; I740-V784 HydrophobicContact CD1-CG1 4.4Å
741	Q	97.8	Very high	97.9	Very high	83 Å²	83	34.4 Å²	34.4	39%	0.388	20%	0.197	S	C	.	.	H	α-helix	trans	-74.7	-34.3	179.7	-61.9	-63.1	-22.6	0	0	113.3	T698 F702 E737 I738 S739	T698-Q741 HydrophobicContact CG2-CB 4.33Å; T698-Q741 HydrophobicContact CG2-CG 3.73Å; F702-Q741 HydrophobicContact CB-CB 4.3Å; F702-Q741 HydrophobicContact CB-CG 4.21Å; F702-Q741 HydrophobicContact CD1-CB 3.6Å; F702-Q741 HydrophobicContact CD1-CG 4.43Å; F702-Q741 HydrophobicContact CD2-CB 3.73Å; F702-Q741 HydrophobicContact CD2-CG 4.14Å; F702-Q741 HydrophobicContact CE1-CB 3.72Å; F702-Q741 HydrophobicContact CE2-CB 3.88Å; F702-Q741 HydrophobicContact CG-CB 3.6Å; F702-Q741 HydrophobicContact CG-CG 4.01Å; F702-Q741 HydrophobicContact CZ-CB 3.87Å; E737-Q741 PolarHBondContact O-N 2.92Å; I738-Q741 PolarHBondContact O-N 3.34Å; S739-Q741 VanDerWaalsContact C-N 3.34Å; S739-Q741 PolarHBondContact O-N 3.41Å
742	M	97.6	Very high	97.8	Very high	14 Å²	14	38.1 Å²	38.1	7%	0.069	22%	0.215	C	C	.	.	H	α-helix	trans	-75.1	-32.9	178.2	-76.8	-70.7	-75.6	0	0	113	F702 I709 I738 S739 E745 M746 Y749	F702-M742 HydrophobicContact CE1-SD 4.24Å; F702-M742 HydrophobicContact CZ-CG 3.77Å; F702-M742 HydrophobicContact CZ-SD 3.64Å; I709-M742 HydrophobicContact CG2-CE 4.16Å; I709-M742 HydrophobicContact CG2-SD 4.37Å; I738-M742 HydrophobicContact CG2-CG 3.89Å; I738-M742 WeakPolarHBondContact O-CB 3.22Å; I738-M742 WeakPolarHBondContact O-CG 3.21Å; I738-M742 PolarHBondContact O-N 3.33Å; S739-M742 PolarHBondContact O-N 2.91Å; M742-E745 HydrophobicContact CE-CB 3.63Å; M742-E745 WeakPolarHBondContact CE-O 3.39Å; M742-E745 WeakPolarHBondContact O-CB 3Å; M742-E745 PolarHBondContact O-N 3Å; M742-E745 HydrophobicContact SD-CB 4.41Å; M742-M746 HydrophobicContact CB-CB 4.05Å; M742-Y749 HydrophobicContact CE-CE2 4.07Å
743	G	97.4	Very high	97.7	Very high	14 Å²	14	38.1 Å²	38.1	14%	0.144	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	57.6	-136.4	-173.6	0	0	0	0	0	111.5	S739 E745 M746	S739-G743 PolarHBondContact O-N 3.42Å; G743-E745 PolarHBondContact O-N 2.88Å; G743-E745 VanDerWaalsContact O-N 3.11Å; G743-M746 VanDerWaalsContact O-CB 3.26Å; G743-M746 WeakPolarHBondContact O-CB 3.27Å; G743-M746 PolarHBondContact O-N 3.31Å
744	P	96.9	Very high	97.7	Very high	107 Å²	107	38.4 Å²	38.4	70%	0.695	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-61	-19.2	-179.9	-24.4	34.9	0	0	0	115.1	M746 Q747	P744-M746 PolarHBondContact O-N 2.84Å; P744-Q747 WeakPolarHBondContact O-CB 3.18Å; P744-Q747 PolarHBondContact O-N 3.04Å
745	E	97.9	Very high	97.7	Very high	111 Å²	111	44.2 Å²	44.2	52%	0.519	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-67.2	-10.6	175.7	-63.6	179.6	-129.7	0	0	112.3	K706 M742 G743 Q747 P748	K706-E745 VanDerWaalsContact CE-OE2 3.27Å; K706-E745 WeakPolarHBondContact CE-OE2 3.49Å; K706-E745 IonicContact NZ-OE1 3.41Å; K706-E745 PolarHBondContact NZ-OE1 3.07Å; K706-E745 IonicContact NZ-OE2 3.9Å; K706-E745 PolarHBondContact NZ-OE2 3.27Å; M742-E745 HydrophobicContact CE-CB 3.63Å; M742-E745 WeakPolarHBondContact CE-O 3.39Å; M742-E745 WeakPolarHBondContact O-CB 3Å; M742-E745 PolarHBondContact O-N 3Å; M742-E745 HydrophobicContact SD-CB 4.41Å; G743-E745 PolarHBondContact O-N 2.88Å; G743-E745 VanDerWaalsContact O-N 3.11Å; E745-Q747 VanDerWaalsContact C-N 3.26Å; E745-Q747 PolarHBondContact O-N 2.94Å; E745-P748 VanDerWaalsContact O-CD 3.23Å; E745-P748 WeakPolarHBondContact O-CD 3.45Å
746	M	98.1	Very high	97.6	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-71.5	-18.9	176.3	-167.8	57.8	178.5	0	0	113.5	M713 I735 I738 M742 G743 P744 P748 Y749 I750 L781 V784	M713-M746 HydrophobicContact CE-CE 3.4Å; M713-M746 HydrophobicContact SD-CE 3.82Å; I735-M746 HydrophobicContact CG2-CE 4.07Å; I738-M746 HydrophobicContact CG2-SD 4.42Å; M742-M746 HydrophobicContact CB-CB 4.05Å; G743-M746 VanDerWaalsContact O-CB 3.26Å; G743-M746 WeakPolarHBondContact O-CB 3.27Å; G743-M746 PolarHBondContact O-N 3.31Å; P744-M746 PolarHBondContact O-N 2.84Å; M746-P748 VanDerWaalsContact C-N 3.33Å; M746-P748 WeakPolarHBondContact O-CD 3.42Å; M746-P748 VanDerWaalsContact O-N 3.1Å; M746-Y749 PolarHBondContact O-N 3.47Å; M746-Y749 HydrophobicContact SD-CD2 4.03Å; M746-I750 HydrophobicContact CG-CG1 4.45Å; M746-L781 HydrophobicContact CE-CD2 3.92Å; M746-L781 HydrophobicContact CG-CD2 4.04Å; M746-V784 HydrophobicContact CB-CG2 4.19Å
747	Q	97.9	Very high	97.7	Very high	91 Å²	91	47 Å²	47	43%	0.425	26%	0.256	S	S	.	.	H	α-helix	trans	-46.1	-43.5	-173	-170.4	-82.7	-22.3	0	0	115.1	P744 E745 Y749 I750 E788	P744-Q747 WeakPolarHBondContact O-CB 3.18Å; P744-Q747 PolarHBondContact O-N 3.04Å; E745-Q747 VanDerWaalsContact C-N 3.26Å; E745-Q747 PolarHBondContact O-N 2.94Å; Q747-Y749 PolarHBondContact O-N 2.9Å; Q747-I750 PolarHBondContact O-N 3.29Å; Q747-E788 HydrophobicContact CG-CG 4.13Å; Q747-E788 PolarHBondContact NE2-OE1 2.97Å
748	P	98	Very high	97.7	Very high	84 Å²	84	46.8 Å²	46.8	55%	0.545	26%	0.256	S	S	.	.	H	α-helix	trans	-64.3	-23.1	-178.1	-22.7	35.3	0	0	0	114.5	E745 M746	E745-P748 VanDerWaalsContact O-CD 3.23Å; E745-P748 WeakPolarHBondContact O-CD 3.45Å; M746-P748 VanDerWaalsContact C-N 3.33Å; M746-P748 WeakPolarHBondContact O-CD 3.42Å; M746-P748 VanDerWaalsContact O-N 3.1Å
749	Y	98.1	Very high	97.6	Very high	49 Å²	49	52.7 Å²	52.7	19%	0.192	28%	0.283	C	S	.	.	H	α-helix	trans	-96.9	-13	-172.9	-52.2	-75.8	0	0	0	113.3	I709 M713 M742 M746 Q747 A751 M752	I709-Y749 HydrophobicContact CG2-CE2 4.08Å; M713-Y749 HydrophobicContact CB-CD1 3.55Å; M713-Y749 HydrophobicContact CB-CE1 3.98Å; M713-Y749 HydrophobicContact CB-CG 4.05Å; M713-Y749 HydrophobicContact CG-CD1 3.85Å; M713-Y749 HydrophobicContact CG-CD2 4.34Å; M713-Y749 HydrophobicContact CG-CE1 4.25Å; M713-Y749 HydrophobicContact CG-CG 3.9Å; M742-Y749 HydrophobicContact CE-CE2 4.07Å; M746-Y749 PolarHBondContact O-N 3.47Å; M746-Y749 HydrophobicContact SD-CD2 4.03Å; Q747-Y749 PolarHBondContact O-N 2.9Å; Y749-A751 VanDerWaalsContact C-N 3.34Å; Y749-A751 PolarHBondContact O-N 3.06Å; Y749-M752 HydrophobicContact CD1-SD 4.4Å; Y749-M752 WeakPolarHBondContact O-CB 3.34Å; Y749-M752 PolarHBondContact O-N 3.4Å; Y749-M752 VanDerWaalsContact O-N 3.1Å
750	I	97.1	Very high	97.6	Very high	5 Å²	5	52.9 Å²	52.9	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-44.5	-174.1	-65.6	179.5	0	0	0	111.7	M746 Q747 M752 V753 L754 L781 C785 E788 V789	M746-I750 HydrophobicContact CG-CG1 4.45Å; Q747-I750 PolarHBondContact O-N 3.29Å; I750-M752 PolarHBondContact O-N 3.2Å; I750-M752 VanDerWaalsContact O-N 3.1Å; I750-V753 PolarHBondContact O-N 2.93Å; I750-V753 VanDerWaalsContact O-N 3.13Å; I750-L754 HydrophobicContact CG2-CB 3.93Å; I750-L754 HydrophobicContact CG2-CD2 3.91Å; I750-L754 VanDerWaalsContact O-CB 3.25Å; I750-L754 WeakPolarHBondContact O-CB 3.39Å; I750-L754 PolarHBondContact O-N 3.42Å; I750-L781 HydrophobicContact CG1-CD2 4.32Å; I750-C785 HydrophobicContact CD1-CB 3.08Å; I750-E788 HydrophobicContact CD1-CB 3.97Å; I750-E788 HydrophobicContact CD1-CG 4.12Å; I750-E788 HydrophobicContact CG2-CB 4.02Å; I750-V789 HydrophobicContact CG2-CG2 4.24Å
751	A	94.9	Very high	97.6	Very high	93 Å²	93	50.4 Å²	50.4	77%	0.769	27%	0.272	S	S	*	.	H	α-helix	trans	-60.3	-24	-178.9	0	0	0	0	0	113.2	Y749	Y749-A751 VanDerWaalsContact C-N 3.34Å; Y749-A751 PolarHBondContact O-N 3.06Å
752	M	96.3	Very high	97.6	Very high	78 Å²	78	50.5 Å²	50.5	38%	0.384	28%	0.275	S	S	.	.	H	α-helix	trans	-78.3	-30	-179.9	-60.8	175.2	52.1	0	0	112.9	P714 Y749 I750 Q756	P714-M752 VanDerWaalsContact CA-CE 3.47Å; P714-M752 HydrophobicContact CB-CE 3.94Å; P714-M752 HydrophobicContact CG-CE 3.98Å; Y749-M752 HydrophobicContact CD1-SD 4.4Å; Y749-M752 WeakPolarHBondContact O-CB 3.34Å; Y749-M752 PolarHBondContact O-N 3.4Å; Y749-M752 VanDerWaalsContact O-N 3.1Å; I750-M752 PolarHBondContact O-N 3.2Å; I750-M752 VanDerWaalsContact O-N 3.1Å; M752-Q756 PolarHBondContact O-NE2 3.43Å
753	V	97.9	Very high	97.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-111.6	-34.2	-170.3	-60.4	0	0	0	0	113	M713 L720 I735 I750 H755 Q756 L757 L781	M713-V753 HydrophobicContact CE-CG1 3.87Å; L720-V753 HydrophobicContact CD1-CB 3.92Å; L720-V753 HydrophobicContact CD1-CG1 4.13Å; I735-V753 HydrophobicContact CD1-CB 4.4Å; I735-V753 HydrophobicContact CD1-CG1 3.93Å; I735-V753 HydrophobicContact CG2-CG2 4.36Å; I750-V753 PolarHBondContact O-N 2.93Å; I750-V753 VanDerWaalsContact O-N 3.13Å; V753-H755 PolarHBondContact O-N 3.25Å; V753-Q756 PolarHBondContact O-N 3.12Å; V753-L757 HydrophobicContact CB-CD1 4.36Å; V753-L757 HydrophobicContact CG2-CD1 4.37Å; V753-L757 WeakPolarHBondContact O-CG 3.45Å; V753-L757 PolarHBondContact O-N 3.1Å; V753-L757 VanDerWaalsContact O-N 3.07Å; V753-L781 HydrophobicContact CG2-CD1 4.06Å
754	L	98.1	Very high	97.3	Very high	10 Å²	10	58.6 Å²	58.6	5%	0.052	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-42.2	-167.8	178.8	61.2	0	0	0	113.3	I750 Q756 L757 V758 V789 M792	I750-L754 HydrophobicContact CG2-CB 3.93Å; I750-L754 HydrophobicContact CG2-CD2 3.91Å; I750-L754 VanDerWaalsContact O-CB 3.25Å; I750-L754 WeakPolarHBondContact O-CB 3.39Å; I750-L754 PolarHBondContact O-N 3.42Å; L754-Q756 VanDerWaalsContact C-N 3.34Å; L754-Q756 PolarHBondContact O-N 2.84Å; L754-L757 PolarHBondContact O-N 3.04Å; L754-V758 HydrophobicContact CD1-CG2 4.1Å; L754-V758 WeakPolarHBondContact O-CG2 3.35Å; L754-V758 PolarHBondContact O-N 3.35Å; L754-V789 HydrophobicContact CD1-CG1 3.84Å; L754-V789 HydrophobicContact CD1-CG2 4.49Å; L754-V789 HydrophobicContact CD2-CB 4.41Å; L754-V789 HydrophobicContact CD2-CG1 4.32Å; L754-V789 HydrophobicContact CD2-CG2 4.21Å; L754-M792 HydrophobicContact CD2-CG 4.47Å; L754-M792 HydrophobicContact CD2-SD 3.58Å; L754-M792 VanDerWaalsContact CD2-SD 3.58Å; L754-M792 HydrophobicContact CG-SD 3.71Å
755	H	97.4	Very high	96.9	Very high	122 Å²	122	61.4 Å²	61.4	57%	0.565	32%	0.323	S	S	*	.	H	α-helix	trans	-61.1	-44.7	179.7	-176.4	-75.6	0	0	0	111.7	V753 V758 E759	V753-H755 PolarHBondContact O-N 3.25Å; H755-V758 PolarHBondContact O-N 3.24Å; H755-E759 IonicContact CE1-OE2 2.72Å; H755-E759 IonicContact ND1-OE2 3.84Å; H755-E759 PolarHBondContact O-N 3.2Å
756	Q	98.1	Very high	96.6	Very high	58 Å²	58	56.8 Å²	56.8	27%	0.271	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-42	-179.7	-62.5	-178.6	75.7	0	0	111	G717 L720 M752 V753 L754 V758 E759 I760	G717-Q756 PolarHBondContact O-NE2 3.4Å; G717-Q756 PolarHBondContact O-OE1 3.15Å; L720-Q756 HydrophobicContact CB-CB 4.06Å; L720-Q756 HydrophobicContact CD1-CB 3.99Å; L720-Q756 PolarHBondContact O-OE1 3.16Å; M752-Q756 PolarHBondContact O-NE2 3.43Å; V753-Q756 PolarHBondContact O-N 3.12Å; L754-Q756 VanDerWaalsContact C-N 3.34Å; L754-Q756 PolarHBondContact O-N 2.84Å; Q756-V758 VanDerWaalsContact C-N 3.34Å; Q756-V758 PolarHBondContact O-N 2.65Å; Q756-E759 WeakPolarHBondContact O-CB 3.13Å; Q756-E759 PolarHBondContact O-N 3.05Å; Q756-E759 VanDerWaalsContact O-N 3.15Å; Q756-I760 WeakPolarHBondContact O-CD1 3.38Å; Q756-I760 VanDerWaalsContact O-CG1 3.26Å; Q756-I760 WeakPolarHBondContact O-CG1 3.4Å; Q756-I760 PolarHBondContact O-N 3.37Å
757	L	98.6	Very high	96.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-40.5	175.9	-65.8	170.6	0	0	0	112.4	L720 T732 V753 L754 E759 I760 I761 T774 T777 I778 L781	L720-L757 HydrophobicContact CD1-CD2 4.19Å; L720-L757 HydrophobicContact CD1-CG 4.16Å; L720-L757 HydrophobicContact CD2-CD2 4.07Å; T732-L757 HydrophobicContact CG2-CD2 3.63Å; V753-L757 HydrophobicContact CB-CD1 4.36Å; V753-L757 HydrophobicContact CG2-CD1 4.37Å; V753-L757 WeakPolarHBondContact O-CG 3.45Å; V753-L757 PolarHBondContact O-N 3.1Å; V753-L757 VanDerWaalsContact O-N 3.07Å; L754-L757 PolarHBondContact O-N 3.04Å; L757-E759 VanDerWaalsContact C-N 3.3Å; L757-E759 PolarHBondContact O-N 2.89Å; L757-I760 PolarHBondContact O-N 3.43Å; L757-I761 PolarHBondContact O-N 3.1Å; L757-T774 HydrophobicContact CB-CG2 4.14Å; L757-T774 HydrophobicContact CD2-CG2 4.05Å; L757-T774 VanDerWaalsContact O-CG2 3.24Å; L757-T774 WeakPolarHBondContact O-CG2 3.4Å; L757-T777 HydrophobicContact CD1-CG2 3.84Å; L757-I778 HydrophobicContact CB-CD1 3.97Å; L757-I778 HydrophobicContact CB-CG1 3.81Å; L757-I778 HydrophobicContact CD1-CG1 4.31Å; L757-L781 HydrophobicContact CD1-CD1 3.59Å
758	V	98.3	Very high	95.9	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-69.1	-29.6	176.4	174.3	0	0	0	0	111.9	L754 H755 Q756 I761 N762 I778 M792 Q795 F796	L754-V758 HydrophobicContact CD1-CG2 4.1Å; L754-V758 WeakPolarHBondContact O-CG2 3.35Å; L754-V758 PolarHBondContact O-N 3.35Å; H755-V758 PolarHBondContact O-N 3.24Å; Q756-V758 VanDerWaalsContact C-N 3.34Å; Q756-V758 PolarHBondContact O-N 2.65Å; V758-I761 WeakPolarHBondContact O-CG2 3.24Å; V758-N762 PolarHBondContact O-ND2 3.46Å; V758-I778 HydrophobicContact CG2-CD1 4.3Å; V758-M792 HydrophobicContact CB-CE 3.92Å; V758-M792 HydrophobicContact CG1-CE 3.89Å; V758-M792 HydrophobicContact CG2-CE 3.78Å; V758-M792 HydrophobicContact CG2-SD 4.34Å; V758-Q795 HydrophobicContact CG1-CB 3.93Å; V758-F796 HydrophobicContact CG2-CD1 3.94Å
759	E	98	Very high	95.5	Very high	124 Å²	124	54.8 Å²	54.8	58%	0.579	29%	0.29	S	S	*	.	H	α-helix	trans	-70	-47.8	172.3	-172.4	173.8	167.7	0	0	111.3	H755 Q756 L757 I761 N762 R763	H755-E759 IonicContact CE1-OE2 2.72Å; H755-E759 IonicContact ND1-OE2 3.84Å; H755-E759 PolarHBondContact O-N 3.2Å; Q756-E759 WeakPolarHBondContact O-CB 3.13Å; Q756-E759 PolarHBondContact O-N 3.05Å; Q756-E759 VanDerWaalsContact O-N 3.15Å; L757-E759 VanDerWaalsContact C-N 3.3Å; L757-E759 PolarHBondContact O-N 2.89Å; E759-I761 PolarHBondContact O-N 3.3Å; E759-N762 PolarHBondContact O-N 2.95Å; E759-R763 PolarHBondContact O-N 2.92Å; E759-R763 VanDerWaalsContact O-N 3.13Å
760	I	98.1	Very high	95.3	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-48.2	179.6	-68.1	161.1	0	0	0	111.1	L720 P722 Q756 L757 N762 R763 L770 T774	L720-I760 HydrophobicContact CB-CD1 4.19Å; P722-I760 HydrophobicContact CB-CG1 4.34Å; P722-I760 HydrophobicContact CG-CG1 4.36Å; Q756-I760 WeakPolarHBondContact O-CD1 3.38Å; Q756-I760 VanDerWaalsContact O-CG1 3.26Å; Q756-I760 WeakPolarHBondContact O-CG1 3.4Å; Q756-I760 PolarHBondContact O-N 3.37Å; L757-I760 PolarHBondContact O-N 3.43Å; I760-N762 PolarHBondContact O-N 3.47Å; I760-N762 VanDerWaalsContact O-N 3.1Å; I760-R763 WeakPolarHBondContact O-CB 3.37Å; I760-R763 PolarHBondContact O-N 3.09Å; I760-L770 HydrophobicContact CG2-CD1 4.31Å; I760-L770 HydrophobicContact CG2-CD2 4.15Å; I760-L770 HydrophobicContact CG2-CG 4.02Å; I760-T774 HydrophobicContact CB-CG2 4.32Å; I760-T774 HydrophobicContact CG2-CG2 4.21Å
761	I	98.1	Very high	95.3	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.8	-177.8	-158.6	170.6	0	0	0	113.5	L757 V758 E759 T774 A775 I778 F796 P799 W800	L757-I761 PolarHBondContact O-N 3.1Å; V758-I761 WeakPolarHBondContact O-CG2 3.24Å; E759-I761 PolarHBondContact O-N 3.3Å; I761-T774 HydrophobicContact CB-CG2 3.83Å; I761-T774 HydrophobicContact CG1-CG2 4.45Å; I761-A775 HydrophobicContact CD1-CB 3.82Å; I761-I778 HydrophobicContact CB-CD1 4.42Å; I761-I778 HydrophobicContact CD1-CD1 4.1Å; I761-I778 HydrophobicContact CG2-CD1 4.15Å; I761-F796 HydrophobicContact CG2-CB 3.82Å; I761-P799 HydrophobicContact CG1-CB 4.03Å; I761-P799 HydrophobicContact CG1-CG 4.1Å; I761-P799 HydrophobicContact CG2-CG 4.29Å; I761-P799 VanDerWaalsContact O-CB 3.24Å; I761-P799 WeakPolarHBondContact O-CB 3.39Å; I761-W800 HydrophobicContact CD1-CB 3.94Å
762	N	97.8	Very high	95.4	Very high	84 Å²	84	49.5 Å²	49.5	45%	0.449	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-0.8	176.9	-76.4	-71.8	0	0	0	113.1	V758 E759 I760 Q795	V758-N762 PolarHBondContact O-ND2 3.46Å; E759-N762 PolarHBondContact O-N 2.95Å; I760-N762 PolarHBondContact O-N 3.47Å; I760-N762 VanDerWaalsContact O-N 3.1Å; N762-Q795 PolarHBondContact ND2-O 3.37Å; N762-Q795 PolarHBondContact OD1-O 3.03Å
763	R	95.8	Very high	95.4	Very high	96 Å²	96	45.8 Å²	45.8	36%	0.362	23%	0.234	S	C	.	.			trans	-75.4	125.8	-176.9	-176.8	-177.3	-176.5	-131.1	10.3	110	P722 E759 I760 T766	P722-R763 PolarHBondContact O-NH1 3.38Å; E759-R763 PolarHBondContact O-N 2.92Å; E759-R763 VanDerWaalsContact O-N 3.13Å; I760-R763 WeakPolarHBondContact O-CB 3.37Å; I760-R763 PolarHBondContact O-N 3.09Å; R763-T766 WeakPolarHBondContact CB-OG1 3.41Å; R763-T766 WeakPolarHBondContact CG-OG1 3.26Å; R763-T766 PolarHBondContact O-OG1 3.01Å
764	P	91.9	Very high	95.5	Very high	103 Å²	103	45.8 Å²	45.8	67%	0.669	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	154.3	176.2	30.3	-35.4	0	0	0	110.7	T766	P764-T766 VanDerWaalsContact C-N 3.25Å; P764-T766 PolarHBondContact O-N 3.25Å
765	N	89.3	Confident	95.5	Very high	166 Å²	166	45.3 Å²	45.3	89%	0.888	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	41.2	178.5	-50.3	-13.7	0	0	0	112.5
766	T	90.1	Very high	95.5	Very high	13 Å²	13	39.5 Å²	39.5	8%	0.08	20%	0.204	C	C	.	.			trans	-100.2	131.6	174	-57.3	0	0	0	0	108.1	R763 P764 L770 L771	R763-T766 WeakPolarHBondContact CB-OG1 3.41Å; R763-T766 WeakPolarHBondContact CG-OG1 3.26Å; R763-T766 PolarHBondContact O-OG1 3.01Å; P764-T766 VanDerWaalsContact C-N 3.25Å; P764-T766 PolarHBondContact O-N 3.25Å; T766-L770 HydrophobicContact CG2-CB 4.13Å; T766-L770 HydrophobicContact CG2-CD2 3.69Å; T766-L770 HydrophobicContact CG2-CG 3.94Å; T766-L771 HydrophobicContact CG2-CD2 3.87Å; T766-L771 HydrophobicContact CG2-CG 3.95Å; T766-L771 WeakPolarHBondContact O-CD1 3.5Å
767	P	90.6	Very high	95.6	Very high	35 Å²	35	36.8 Å²	36.8	23%	0.227	19%	0.192	C	C	.	.			trans	-56.1	147.1	-179.2	-30.4	38.9	0	0	0	112.8	I725 T769 L770 L771	I725-P767 HydrophobicContact CD1-CG 3.9Å; I725-P767 HydrophobicContact CG1-CG 4.46Å; I725-P767 HydrophobicContact CG2-CB 4.41Å; I725-P767 HydrophobicContact CG2-CG 3.9Å; P767-T769 VanDerWaalsContact C-N 3.32Å; P767-T769 PolarHBondContact O-N 3.46Å; P767-L770 PolarHBondContact O-N 3.18Å; P767-L771 PolarHBondContact O-N 3.47Å
768	K	90.6	Very high	95.6	Very high	65 Å²	65	36.8 Å²	36.8	28%	0.283	19%	0.192	S	C	.	.	H	α-helix	trans	-57.5	-45.9	-173	-175.2	-173.8	-179.5	-165.3	0	111.9	H349 D357 L770 L771 E772	H349-K768 PolarHBondContact CD2-NZ 2.98Å; H349-K768 WeakPolarHBondContact CE1-CE 3.5Å; H349-K768 PolarHBondContact CE1-NZ 3.43Å; H349-K768 PolarHBondContact ND1-NZ 2.71Å; H349-K768 VanDerWaalsContact NE2-CE 3.34Å; H349-K768 WeakPolarHBondContact NE2-CE 3.48Å; H349-K768 PolarHBondContact NE2-NZ 3.14Å; D357-K768 VanDerWaalsContact OD2-CB 3.26Å; D357-K768 WeakPolarHBondContact OD2-CB 3.48Å; D357-K768 PolarHBondContact OD2-N 3.18Å; K768-L770 VanDerWaalsContact C-N 3.33Å; K768-L770 PolarHBondContact O-N 2.84Å; K768-L771 WeakPolarHBondContact O-CB 3.41Å; K768-L771 PolarHBondContact O-N 3.17Å; K768-L771 VanDerWaalsContact O-N 3.08Å; K768-E772 VanDerWaalsContact CE-OE1 3.22Å; K768-E772 WeakPolarHBondContact CE-OE1 3.36Å; K768-E772 VanDerWaalsContact CG-OE1 3.31Å; K768-E772 WeakPolarHBondContact CG-OE1 3.47Å; K768-E772 WeakPolarHBondContact O-CG 3.24Å; K768-E772 PolarHBondContact O-N 3.16Å
769	T	90.2	Very high	95.6	Very high	34 Å²	34	36.4 Å²	36.4	21%	0.209	19%	0.19	C	C	.	.	H	α-helix	trans	-56.1	-43.6	179.5	-59.6	0	0	0	0	112.8	V345 A346 N729 P767 E772 N773	V345-T769 WeakPolarHBondContact O-CG2 3.46Å; A346-T769 HydrophobicContact CB-CG2 3.68Å; N729-T769 PolarHBondContact OD1-O 3.18Å; P767-T769 VanDerWaalsContact C-N 3.32Å; P767-T769 PolarHBondContact O-N 3.46Å; T769-E772 PolarHBondContact O-N 2.86Å; T769-N773 PolarHBondContact O-N 3.46Å
770	L	95.1	Very high	95.6	Very high	1 Å²	1	31 Å²	31	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-67.6	-40.1	177.7	175.8	57	0	0	0	111.5	I725 C728 N729 I760 T766 P767 K768 E772 T774	I725-L770 HydrophobicContact CG2-CD2 4.31Å; C728-L770 HydrophobicContact CB-CD1 4.42Å; N729-L770 HydrophobicContact CB-CD1 4.05Å; N729-L770 WeakPolarHBondContact OD1-CA 3.32Å; I760-L770 HydrophobicContact CG2-CD1 4.31Å; I760-L770 HydrophobicContact CG2-CD2 4.15Å; I760-L770 HydrophobicContact CG2-CG 4.02Å; T766-L770 HydrophobicContact CG2-CB 4.13Å; T766-L770 HydrophobicContact CG2-CD2 3.69Å; T766-L770 HydrophobicContact CG2-CG 3.94Å; P767-L770 PolarHBondContact O-N 3.18Å; K768-L770 VanDerWaalsContact C-N 3.33Å; K768-L770 PolarHBondContact O-N 2.84Å; L770-E772 VanDerWaalsContact C-N 3.31Å; L770-E772 PolarHBondContact O-N 3.47Å; L770-T774 VanDerWaalsContact O-CB 3.23Å; L770-T774 WeakPolarHBondContact O-CB 3.4Å; L770-T774 PolarHBondContact O-N 3.32Å; L770-T774 PolarHBondContact O-OG1 3.29Å
771	L	96.3	Very high	95.6	Very high	33 Å²	33	30.8 Å²	30.8	17%	0.173	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-39.1	176.4	-67.8	175.8	0	0	0	111.9	T766 P767 K768 T774 A775	T766-L771 HydrophobicContact CG2-CD2 3.87Å; T766-L771 HydrophobicContact CG2-CG 3.95Å; T766-L771 WeakPolarHBondContact O-CD1 3.5Å; P767-L771 PolarHBondContact O-N 3.47Å; K768-L771 WeakPolarHBondContact O-CB 3.41Å; K768-L771 PolarHBondContact O-N 3.17Å; K768-L771 VanDerWaalsContact O-N 3.08Å; L771-T774 PolarHBondContact O-N 3.31Å; L771-A775 VanDerWaalsContact O-CB 3.31Å; L771-A775 WeakPolarHBondContact O-CB 3.19Å; L771-A775 PolarHBondContact O-N 2.78Å
772	E	96.3	Very high	95.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-67.6	-49.9	179.1	-71.8	171.8	176.6	0	0	112.3	Q347 H349 K768 T769 L770 T774 A775 I776 L804 I807	Q347-E772 WeakPolarHBondContact CB-OE2 3.46Å; Q347-E772 HydrophobicContact CG-CB 4.28Å; H349-E772 IonicContact CE1-OE1 3.26Å; H349-E772 PolarHBondContact CE1-OE1 2.66Å; H349-E772 IonicContact CE1-OE2 3.34Å; H349-E772 PolarHBondContact CE1-OE2 2.93Å; H349-E772 IonicContact NE2-OE1 2.85Å; H349-E772 IonicContact NE2-OE2 2.74Å; K768-E772 VanDerWaalsContact CE-OE1 3.22Å; K768-E772 WeakPolarHBondContact CE-OE1 3.36Å; K768-E772 VanDerWaalsContact CG-OE1 3.31Å; K768-E772 WeakPolarHBondContact CG-OE1 3.47Å; K768-E772 WeakPolarHBondContact O-CG 3.24Å; K768-E772 PolarHBondContact O-N 3.16Å; T769-E772 PolarHBondContact O-N 2.86Å; L770-E772 VanDerWaalsContact C-N 3.31Å; L770-E772 PolarHBondContact O-N 3.47Å; E772-T774 VanDerWaalsContact C-N 3.28Å; E772-T774 PolarHBondContact O-N 2.96Å; E772-A775 PolarHBondContact O-N 2.88Å; E772-I776 WeakPolarHBondContact O-CG1 3.39Å; E772-I776 PolarHBondContact O-N 2.96Å; E772-L804 HydrophobicContact CB-CD2 4.45Å; E772-I807 HydrophobicContact CB-CG2 4.48Å; E772-I807 VanDerWaalsContact CD-CG2 3.48Å; E772-I807 HydrophobicContact CG-CG2 3.98Å
773	N	97.6	Very high	95.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-38	174.9	-81.4	-38.8	0	0	0	111.7	V345 N729 T732 T769 I776 T777	V345-N773 PolarHBondContact O-ND2 2.78Å; N729-N773 PolarHBondContact ND2-ND2 3.03Å; N729-N773 PolarHBondContact OD1-ND2 3.18Å; T732-N773 HydrophobicContact CG2-CB 4.46Å; T769-N773 PolarHBondContact O-N 3.46Å; N773-I776 PolarHBondContact O-N 3.33Å; N773-T777 WeakPolarHBondContact O-CB 3.41Å; N773-T777 PolarHBondContact O-N 3Å; N773-T777 PolarHBondContact O-OG1 2.98Å
774	T	98.6	Very high	95.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-46	173.8	-57.9	0	0	0	0	111.5	L757 I760 I761 L770 L771 E772 T777 I778	L757-T774 HydrophobicContact CB-CG2 4.14Å; L757-T774 HydrophobicContact CD2-CG2 4.05Å; L757-T774 VanDerWaalsContact O-CG2 3.24Å; L757-T774 WeakPolarHBondContact O-CG2 3.4Å; I760-T774 HydrophobicContact CB-CG2 4.32Å; I760-T774 HydrophobicContact CG2-CG2 4.21Å; I761-T774 HydrophobicContact CB-CG2 3.83Å; I761-T774 HydrophobicContact CG1-CG2 4.45Å; L770-T774 VanDerWaalsContact O-CB 3.23Å; L770-T774 WeakPolarHBondContact O-CB 3.4Å; L770-T774 PolarHBondContact O-N 3.32Å; L770-T774 PolarHBondContact O-OG1 3.29Å; L771-T774 PolarHBondContact O-N 3.31Å; E772-T774 VanDerWaalsContact C-N 3.28Å; E772-T774 PolarHBondContact O-N 2.96Å; T774-T777 PolarHBondContact O-N 2.95Å; T774-I778 HydrophobicContact CG2-CD1 4.01Å; T774-I778 VanDerWaalsContact O-CG1 3.32Å; T774-I778 WeakPolarHBondContact O-CG1 3.31Å; T774-I778 PolarHBondContact O-N 3.48Å
775	A	98.4	Very high	96.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.3	-45.5	177.5	0	0	0	0	0	111.7	I761 L771 E772 T777 I778 G779 W800 L804	I761-A775 HydrophobicContact CD1-CB 3.82Å; L771-A775 VanDerWaalsContact O-CB 3.31Å; L771-A775 WeakPolarHBondContact O-CB 3.19Å; L771-A775 PolarHBondContact O-N 2.78Å; E772-A775 PolarHBondContact O-N 2.88Å; A775-T777 PolarHBondContact O-N 3.33Å; A775-I778 PolarHBondContact O-N 3.36Å; A775-G779 PolarHBondContact O-N 3.14Å; A775-W800 HydrophobicContact CB-CG 4.06Å; A775-W800 VanDerWaalsContact O-CD1 3.3Å; A775-W800 PolarHBondContact O-NE1 3.21Å; A775-L804 HydrophobicContact CB-CD1 3.93Å; A775-L804 HydrophobicContact CB-CD2 3.84Å; A775-L804 HydrophobicContact CB-CG 3.69Å
776	I	98.6	Very high	96.5	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.6	-49.3	175.9	-71.1	160.3	0	0	0	110.3	Q347 E772 N773 G779 R780 L804 I807 E812 A816	Q347-I776 HydrophobicContact CG-CD1 3.91Å; E772-I776 WeakPolarHBondContact O-CG1 3.39Å; E772-I776 PolarHBondContact O-N 2.96Å; N773-I776 PolarHBondContact O-N 3.33Å; I776-G779 WeakPolarHBondContact O-CA 3.49Å; I776-G779 PolarHBondContact O-N 2.97Å; I776-G779 VanDerWaalsContact O-N 3.15Å; I776-R780 HydrophobicContact CG2-CG 4.35Å; I776-R780 WeakPolarHBondContact O-CG 3.42Å; I776-R780 PolarHBondContact O-N 3.3Å; I776-L804 HydrophobicContact CD1-CD2 4.29Å; I776-L804 HydrophobicContact CG1-CD1 4.37Å; I776-L804 HydrophobicContact CG1-CD2 3.8Å; I776-I807 HydrophobicContact CD1-CD1 4.33Å; I776-E812 HydrophobicContact CD1-CB 4.13Å; I776-E812 HydrophobicContact CG2-CB 4.32Å; I776-A816 HydrophobicContact CB-CB 4.4Å; I776-A816 HydrophobicContact CG1-CB 4.29Å; I776-A816 HydrophobicContact CG2-CB 4.45Å
777	T	98.8	Very high	96.8	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-64.7	-42.6	-178.4	-69.1	0	0	0	0	112.6	T732 I735 G736 L757 N773 T774 A775 G779 R780 L781	T732-T777 HydrophobicContact CG2-CG2 4.35Å; T732-T777 WeakPolarHBondContact O-CG2 3.47Å; T732-T777 PolarHBondContact O-OG1 2.98Å; I735-T777 HydrophobicContact CB-CG2 4.15Å; I735-T777 HydrophobicContact CG2-CG2 3.89Å; G736-T777 WeakPolarHBondContact CA-OG1 3.43Å; L757-T777 HydrophobicContact CD1-CG2 3.84Å; N773-T777 WeakPolarHBondContact O-CB 3.41Å; N773-T777 PolarHBondContact O-N 3Å; N773-T777 PolarHBondContact O-OG1 2.98Å; T774-T777 PolarHBondContact O-N 2.95Å; A775-T777 PolarHBondContact O-N 3.33Å; T777-G779 VanDerWaalsContact C-N 3.29Å; T777-G779 PolarHBondContact O-N 3.18Å; T777-R780 PolarHBondContact O-N 3.04Å; T777-L781 HydrophobicContact CG2-CD1 4.08Å; T777-L781 HydrophobicContact CG2-CG 4.42Å; T777-L781 WeakPolarHBondContact O-CB 3.46Å; T777-L781 WeakPolarHBondContact O-CG 3.37Å; T777-L781 PolarHBondContact O-N 3.4Å
778	I	98.8	Very high	97.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-42.7	172.9	-69.1	171	0	0	0	110.6	L757 V758 I761 T774 A775 L781 G782 V789 F796	L757-I778 HydrophobicContact CB-CD1 3.97Å; L757-I778 HydrophobicContact CB-CG1 3.81Å; L757-I778 HydrophobicContact CD1-CG1 4.31Å; V758-I778 HydrophobicContact CG2-CD1 4.3Å; I761-I778 HydrophobicContact CB-CD1 4.42Å; I761-I778 HydrophobicContact CD1-CD1 4.1Å; I761-I778 HydrophobicContact CG2-CD1 4.15Å; T774-I778 HydrophobicContact CG2-CD1 4.01Å; T774-I778 VanDerWaalsContact O-CG1 3.32Å; T774-I778 WeakPolarHBondContact O-CG1 3.31Å; T774-I778 PolarHBondContact O-N 3.48Å; A775-I778 PolarHBondContact O-N 3.36Å; I778-L781 PolarHBondContact O-N 2.86Å; I778-G782 PolarHBondContact O-N 3.42Å; I778-V789 HydrophobicContact CG2-CG1 4.27Å; I778-F796 HydrophobicContact CG2-CD1 4.19Å; I778-F796 HydrophobicContact CG2-CD2 3.87Å; I778-F796 HydrophobicContact CG2-CE1 3.85Å; I778-F796 HydrophobicContact CG2-CE2 3.52Å; I778-F796 HydrophobicContact CG2-CG 4.2Å; I778-F796 HydrophobicContact CG2-CZ 3.5Å
779	G	98.4	Very high	97.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-57	-52.4	174.7	0	0	0	0	0	111.5	A775 I776 T777 L781 G782 Y783 G819	A775-G779 PolarHBondContact O-N 3.14Å; I776-G779 WeakPolarHBondContact O-CA 3.49Å; I776-G779 PolarHBondContact O-N 2.97Å; I776-G779 VanDerWaalsContact O-N 3.15Å; T777-G779 VanDerWaalsContact C-N 3.29Å; T777-G779 PolarHBondContact O-N 3.18Å; G779-L781 PolarHBondContact O-N 2.94Å; G779-G782 CarbonylContact O-C 3.59Å; G779-G782 PolarHBondContact O-N 3.09Å; G779-G782 VanDerWaalsContact O-N 3.17Å; G779-Y783 PolarHBondContact O-N 2.88Å; G779-G819 VanDerWaalsContact O-CA 3.24Å; G779-G819 WeakPolarHBondContact O-CA 3.4Å
780	R	98.7	Very high	97.9	Very high	11 Å²	11	20.2 Å²	20.2	4%	0.042	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-41.5	179.9	-69.1	176.3	163.5	179.9	-14.7	113.1	G736 E737 I740 I776 T777 G782 Y783 V784 S815	G736-R780 WeakPolarHBondContact O-CD 3.21Å; E737-R780 IonicContact OE1-CZ 3.36Å; E737-R780 IonicContact OE1-NH1 2.65Å; E737-R780 PolarHBondContact OE1-NH1 3.05Å; E737-R780 IonicContact OE1-NH2 2.7Å; E737-R780 PolarHBondContact OE1-NH2 3.18Å; E737-R780 IonicContact OE2-NH1 3.64Å; E737-R780 IonicContact OE2-NH2 3.14Å; I740-R780 HydrophobicContact CD1-CB 3.96Å; I740-R780 HydrophobicContact CD1-CG 3.87Å; I740-R780 HydrophobicContact CG1-CB 4.15Å; I740-R780 HydrophobicContact CG1-CG 3.95Å; I776-R780 HydrophobicContact CG2-CG 4.35Å; I776-R780 WeakPolarHBondContact O-CG 3.42Å; I776-R780 PolarHBondContact O-N 3.3Å; T777-R780 PolarHBondContact O-N 3.04Å; R780-G782 VanDerWaalsContact C-N 3.33Å; R780-G782 PolarHBondContact O-N 3.45Å; R780-Y783 WeakPolarHBondContact O-CB 3.32Å; R780-Y783 PolarHBondContact O-N 3.1Å; R780-V784 PolarHBondContact O-N 3.36Å; R780-V784 VanDerWaalsContact O-N 3.16Å; R780-S815 PolarHBondContact NE-OG 2.9Å
781	L	98.7	Very high	98	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.9	-44.7	173	-73.6	169.6	0	0	0	111.3	S739 M746 I750 V753 L757 T777 I778 G779 Y783 V784 C785 V789	S739-L781 WeakPolarHBondContact OG-CD2 3.48Å; M746-L781 HydrophobicContact CE-CD2 3.92Å; M746-L781 HydrophobicContact CG-CD2 4.04Å; I750-L781 HydrophobicContact CG1-CD2 4.32Å; V753-L781 HydrophobicContact CG2-CD1 4.06Å; L757-L781 HydrophobicContact CD1-CD1 3.59Å; T777-L781 HydrophobicContact CG2-CD1 4.08Å; T777-L781 HydrophobicContact CG2-CG 4.42Å; T777-L781 WeakPolarHBondContact O-CB 3.46Å; T777-L781 WeakPolarHBondContact O-CG 3.37Å; T777-L781 PolarHBondContact O-N 3.4Å; I778-L781 PolarHBondContact O-N 2.86Å; G779-L781 PolarHBondContact O-N 2.94Å; L781-Y783 VanDerWaalsContact C-N 3.28Å; L781-Y783 PolarHBondContact O-N 3.47Å; L781-V784 WeakPolarHBondContact O-CG2 3.44Å; L781-V784 PolarHBondContact O-N 3.39Å; L781-C785 PolarHBondContact O-N 3.41Å; L781-V789 HydrophobicContact CB-CG2 4.09Å
782	G	98.3	Very high	98.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.9	-26.5	176.3	0	0	0	0	0	113.9	I778 G779 R780 P786	I778-G782 PolarHBondContact O-N 3.42Å; G779-G782 CarbonylContact O-C 3.59Å; G779-G782 PolarHBondContact O-N 3.09Å; G779-G782 VanDerWaalsContact O-N 3.17Å; R780-G782 VanDerWaalsContact C-N 3.33Å; R780-G782 PolarHBondContact O-N 3.45Å; G782-P786 WeakPolarHBondContact O-CA 3.4Å; G782-P786 VanDerWaalsContact O-CB 3.27Å; G782-P786 WeakPolarHBondContact O-CB 3.39Å
783	Y	98.3	Very high	98.1	Very high	101 Å²	101	24.4 Å²	24.4	40%	0.396	12%	0.123	S	C	.	.	H	α-helix	trans	-67.8	-45.4	173.7	-175.5	-135.9	0	0	0	111.5	I740 G779 R780 L781 R818 G819	I740-Y783 HydrophobicContact CD1-CD1 3.91Å; G779-Y783 PolarHBondContact O-N 2.88Å; R780-Y783 WeakPolarHBondContact O-CB 3.32Å; R780-Y783 PolarHBondContact O-N 3.1Å; L781-Y783 VanDerWaalsContact C-N 3.28Å; L781-Y783 PolarHBondContact O-N 3.47Å; Y783-R818 HydrophobicContact CD2-CB 3.85Å; Y783-R818 HydrophobicContact CE2-CB 3.8Å; Y783-R818 HydrophobicContact CG-CB 4.35Å; Y783-G819 VanDerWaalsContact CB-CA 3.49Å
784	V	98.1	Very high	98.1	Very high	22 Å²	22	29.4 Å²	29.4	13%	0.133	15%	0.146	C	C	.	.	H	α-helix	trans	-85	-28.3	-175.1	-57.8	0	0	0	0	113.4	S739 I740 M746 R780 L781	S739-V784 WeakPolarHBondContact O-CG1 3.34Å; I740-V784 HydrophobicContact CD1-CG1 4.4Å; M746-V784 HydrophobicContact CB-CG2 4.19Å; R780-V784 PolarHBondContact O-N 3.36Å; R780-V784 VanDerWaalsContact O-N 3.16Å; L781-V784 WeakPolarHBondContact O-CG2 3.44Å; L781-V784 PolarHBondContact O-N 3.39Å
785	C	98	Very high	98	Very high	12 Å²	12	34.5 Å²	34.5	8%	0.081	17%	0.17	C	C	.	.			trans	-138.6	64.9	-178	-72.1	0	0	0	0	111.8	I750 L781 Q787 E788 V789	I750-C785 HydrophobicContact CD1-CB 3.08Å; L781-C785 PolarHBondContact O-N 3.41Å; C785-Q787 PolarHBondContact O-N 2.74Å; C785-Q787 VanDerWaalsContact O-N 3.16Å; C785-E788 HydrophobicContact CB-CG 4.44Å; C785-E788 PolarHBondContact O-N 3.34Å; C785-E788 VanDerWaalsContact O-N 3.15Å; C785-V789 PolarHBondContact O-N 3.43Å
786	P	97.8	Very high	98	Very high	25 Å²	25	34.5 Å²	34.5	16%	0.162	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-28.2	-171.7	24.6	-35.6	0	0	0	113.8	G782 E788 A790 T822 V826	G782-P786 WeakPolarHBondContact O-CA 3.4Å; G782-P786 VanDerWaalsContact O-CB 3.27Å; G782-P786 WeakPolarHBondContact O-CB 3.39Å; P786-E788 VanDerWaalsContact C-N 3.28Å; P786-E788 PolarHBondContact O-N 3.16Å; P786-A790 WeakPolarHBondContact O-CB 3.35Å; P786-A790 PolarHBondContact O-N 3.01Å; P786-T822 HydrophobicContact CB-CG2 3.81Å; P786-T822 HydrophobicContact CG-CG2 3.88Å; P786-V826 HydrophobicContact CB-CG2 4.02Å; P786-V826 HydrophobicContact CG-CG2 4.48Å
787	Q	97.7	Very high	98	Very high	131 Å²	131	34.5 Å²	34.5	61%	0.612	17%	0.17	S	C	*	.	H	α-helix	trans	-66.9	-29.9	180	-60.4	-58.3	-40.1	0	0	112.8	C785 P791	C785-Q787 PolarHBondContact O-N 2.74Å; C785-Q787 VanDerWaalsContact O-N 3.16Å; Q787-P791 WeakPolarHBondContact O-CD 3.38Å; Q787-P791 WeakPolarHBondContact O-CG 3.48Å
788	E	97.8	Very high	97.9	Very high	86 Å²	86	41.3 Å²	41.3	40%	0.402	20%	0.196	S	C	.	.	H	α-helix	trans	-84.9	-35.9	-178.8	-57.2	-65.2	174	0	0	111.5	Q747 I750 C785 P786	Q747-E788 HydrophobicContact CG-CG 4.13Å; Q747-E788 PolarHBondContact NE2-OE1 2.97Å; I750-E788 HydrophobicContact CD1-CB 3.97Å; I750-E788 HydrophobicContact CD1-CG 4.12Å; I750-E788 HydrophobicContact CG2-CB 4.02Å; C785-E788 HydrophobicContact CB-CG 4.44Å; C785-E788 PolarHBondContact O-N 3.34Å; C785-E788 VanDerWaalsContact O-N 3.15Å; P786-E788 VanDerWaalsContact C-N 3.28Å; P786-E788 PolarHBondContact O-N 3.16Å
789	V	98.3	Very high	97.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-93.8	-38.3	-172.6	-169.8	0	0	0	0	113	I750 L754 I778 L781 C785 P791 M792 F796 M823	I750-V789 HydrophobicContact CG2-CG2 4.24Å; L754-V789 HydrophobicContact CD1-CG1 3.84Å; L754-V789 HydrophobicContact CD1-CG2 4.49Å; L754-V789 HydrophobicContact CD2-CB 4.41Å; L754-V789 HydrophobicContact CD2-CG1 4.32Å; L754-V789 HydrophobicContact CD2-CG2 4.21Å; I778-V789 HydrophobicContact CG2-CG1 4.27Å; L781-V789 HydrophobicContact CB-CG2 4.09Å; C785-V789 PolarHBondContact O-N 3.43Å; V789-P791 VanDerWaalsContact C-N 3.29Å; V789-P791 VanDerWaalsContact O-N 3.14Å; V789-M792 PolarHBondContact O-N 3.38Å; V789-F796 HydrophobicContact CG1-CE1 4.32Å; V789-F796 HydrophobicContact CG1-CZ 4.34Å; V789-M823 HydrophobicContact CB-SD 3.71Å; V789-M823 HydrophobicContact CG1-CE 4.38Å; V789-M823 HydrophobicContact CG1-SD 3.4Å; V789-M823 WeakPolarHBondContact CG1-SD 3.3Å
790	A	97.9	Very high	97.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-56.3	-29.3	-177.5	0	0	0	0	0	115.4	P786 M792 L793 M823 V826 N827	P786-A790 WeakPolarHBondContact O-CB 3.35Å; P786-A790 PolarHBondContact O-N 3.01Å; A790-M792 PolarHBondContact O-N 3.21Å; A790-L793 VanDerWaalsContact O-CB 3.24Å; A790-L793 WeakPolarHBondContact O-CB 3.39Å; A790-L793 PolarHBondContact O-N 2.82Å; A790-M823 HydrophobicContact CB-CB 3.92Å; A790-M823 HydrophobicContact CB-CG 4.05Å; A790-V826 HydrophobicContact CB-CB 4.08Å; A790-V826 HydrophobicContact CB-CG1 3.98Å; A790-N827 HydrophobicContact CB-CB 4Å; A790-N827 PolarHBondContact O-ND2 3.32Å
791	P	97.9	Very high	97.7	Very high	89 Å²	89	42.3 Å²	42.3	58%	0.578	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-58.3	-26.4	172.4	-27.4	37	0	0	0	114.3	Q787 V789	Q787-P791 WeakPolarHBondContact O-CD 3.38Å; Q787-P791 WeakPolarHBondContact O-CG 3.48Å; V789-P791 VanDerWaalsContact C-N 3.29Å; V789-P791 VanDerWaalsContact O-N 3.14Å
792	M	97.6	Very high	97.6	Very high	35 Å²	35	45.4 Å²	45.4	17%	0.172	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-92.7	1.7	179.9	-62.5	-172	75.5	0	0	113.7	L754 V758 V789 A790 Q794 Q795 F796	L754-M792 HydrophobicContact CD2-CG 4.47Å; L754-M792 HydrophobicContact CD2-SD 3.58Å; L754-M792 VanDerWaalsContact CD2-SD 3.58Å; L754-M792 HydrophobicContact CG-SD 3.71Å; V758-M792 HydrophobicContact CB-CE 3.92Å; V758-M792 HydrophobicContact CG1-CE 3.89Å; V758-M792 HydrophobicContact CG2-CE 3.78Å; V758-M792 HydrophobicContact CG2-SD 4.34Å; V789-M792 PolarHBondContact O-N 3.38Å; A790-M792 PolarHBondContact O-N 3.21Å; M792-Q794 VanDerWaalsContact C-N 3.28Å; M792-Q794 PolarHBondContact O-N 2.65Å; M792-Q794 VanDerWaalsContact O-N 3.12Å; M792-Q795 VanDerWaalsContact CE-OE1 3.29Å; M792-Q795 WeakPolarHBondContact O-CB 3.43Å; M792-Q795 PolarHBondContact O-N 3.05Å; M792-F796 HydrophobicContact CB-CD1 4.31Å; M792-F796 HydrophobicContact CB-CE1 4.13Å; M792-F796 VanDerWaalsContact O-CD1 3.22Å; M792-F796 WeakPolarHBondContact O-CD1 3.07Å; M792-F796 WeakPolarHBondContact O-CE1 3.16Å
793	L	96.4	Very high	97.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-50.9	-43.6	-171.9	-172.5	63.7	0	0	0	113.7	A790 Q795 F796 I797 I820 M823 I824 V831	A790-L793 VanDerWaalsContact O-CB 3.24Å; A790-L793 WeakPolarHBondContact O-CB 3.39Å; A790-L793 PolarHBondContact O-N 2.82Å; L793-Q795 PolarHBondContact O-N 3.24Å; L793-F796 HydrophobicContact CD1-CE2 3.91Å; L793-F796 HydrophobicContact CD1-CZ 3.76Å; L793-F796 PolarHBondContact O-N 3.48Å; L793-I797 HydrophobicContact CD1-CB 4.48Å; L793-I797 HydrophobicContact CD1-CD1 4.24Å; L793-I797 VanDerWaalsContact O-CB 3.26Å; L793-I797 WeakPolarHBondContact O-CB 3.49Å; L793-I797 WeakPolarHBondContact O-CG2 3.4Å; L793-I797 PolarHBondContact O-N 3.1Å; L793-I820 HydrophobicContact CD1-CD1 3.49Å; L793-I820 VanDerWaalsContact CD1-CD1 3.49Å; L793-I820 HydrophobicContact CD1-CG1 4.42Å; L793-M823 HydrophobicContact CD1-CB 4.33Å; L793-I824 HydrophobicContact CD2-CG1 3.87Å; L793-V831 HydrophobicContact CD2-CB 4.36Å
794	Q	96.8	Very high	97.2	Very high	104 Å²	104	41.3 Å²	41.3	49%	0.486	21%	0.209	S	C	.	.	H	α-helix	trans	-62.6	-24.8	179.5	-168.4	179.8	7.8	0	0	113.3	M792 G830	M792-Q794 VanDerWaalsContact C-N 3.28Å; M792-Q794 PolarHBondContact O-N 2.65Å; M792-Q794 VanDerWaalsContact O-N 3.12Å; Q794-G830 VanDerWaalsContact CA-O 3.28Å; Q794-G830 WeakPolarHBondContact CA-O 3.26Å
795	Q	97.6	Very high	96.9	Very high	108 Å²	108	45.2 Å²	45.2	51%	0.505	22%	0.221	S	C	.	.	H	α-helix	trans	-81	-21.8	-175.7	-57.5	-178.3	21.6	0	0	113.2	V758 N762 M792 L793	V758-Q795 HydrophobicContact CG1-CB 3.93Å; N762-Q795 PolarHBondContact ND2-O 3.37Å; N762-Q795 PolarHBondContact OD1-O 3.03Å; M792-Q795 VanDerWaalsContact CE-OE1 3.29Å; M792-Q795 WeakPolarHBondContact O-CB 3.43Å; M792-Q795 PolarHBondContact O-N 3.05Å; L793-Q795 PolarHBondContact O-N 3.24Å
796	F	97.9	Very high	96.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-128.3	-12.9	-174.9	66.9	-103.1	0	0	0	114.4	V758 I761 I778 V789 M792 L793 R798 P799 W800 I820 M823	V758-F796 HydrophobicContact CG2-CD1 3.94Å; I761-F796 HydrophobicContact CG2-CB 3.82Å; I778-F796 HydrophobicContact CG2-CD1 4.19Å; I778-F796 HydrophobicContact CG2-CD2 3.87Å; I778-F796 HydrophobicContact CG2-CE1 3.85Å; I778-F796 HydrophobicContact CG2-CE2 3.52Å; I778-F796 HydrophobicContact CG2-CG 4.2Å; I778-F796 HydrophobicContact CG2-CZ 3.5Å; V789-F796 HydrophobicContact CG1-CE1 4.32Å; V789-F796 HydrophobicContact CG1-CZ 4.34Å; M792-F796 HydrophobicContact CB-CD1 4.31Å; M792-F796 HydrophobicContact CB-CE1 4.13Å; M792-F796 VanDerWaalsContact O-CD1 3.22Å; M792-F796 WeakPolarHBondContact O-CD1 3.07Å; M792-F796 WeakPolarHBondContact O-CE1 3.16Å; L793-F796 HydrophobicContact CD1-CE2 3.91Å; L793-F796 HydrophobicContact CD1-CZ 3.76Å; L793-F796 PolarHBondContact O-N 3.48Å; F796-R798 PolarHBondContact O-N 3.27Å; F796-R798 VanDerWaalsContact O-N 3.12Å; F796-P799 WeakPolarHBondContact O-CD 3.47Å; F796-P799 VanDerWaalsContact O-CG 3.3Å; F796-P799 WeakPolarHBondContact O-CG 3.43Å; F796-W800 HydrophobicContact CD2-CB 4.01Å; F796-W800 HydrophobicContact CD2-CG 4.22Å; F796-W800 WeakPolarHBondContact O-CB 3.43Å; F796-W800 PolarHBondContact O-N 3.12Å; F796-I820 HydrophobicContact CE2-CD1 3.83Å; F796-M823 HydrophobicContact CE2-CE 4.27Å; F796-M823 HydrophobicContact CZ-CE 3.93Å; F796-M823 HydrophobicContact CZ-SD 3.99Å
797	I	97.9	Very high	95.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.1	-36.4	-173	-173.3	61.6	0	0	0	113.2	L793 W800 C801 I820 V831 D834	L793-I797 HydrophobicContact CD1-CB 4.48Å; L793-I797 HydrophobicContact CD1-CD1 4.24Å; L793-I797 VanDerWaalsContact O-CB 3.26Å; L793-I797 WeakPolarHBondContact O-CB 3.49Å; L793-I797 WeakPolarHBondContact O-CG2 3.4Å; L793-I797 PolarHBondContact O-N 3.1Å; I797-W800 HydrophobicContact CD1-CE3 4.44Å; I797-C801 WeakPolarHBondContact O-CB 3.5Å; I797-C801 PolarHBondContact O-N 3.49Å; I797-C801 PolarHBondContact O-SG 3.08Å; I797-I820 HydrophobicContact CD1-CD1 3.71Å; I797-I820 HydrophobicContact CD1-CG1 3.72Å; I797-V831 HydrophobicContact CD1-CG2 4.38Å; I797-V831 HydrophobicContact CG1-CG2 3.89Å; I797-D834 HydrophobicContact CG2-CB 4.04Å
798	R	96.8	Very high	95.2	Very high	144 Å²	144	45.6 Å²	45.6	54%	0.543	22%	0.217	S	C	.	.	H	α-helix	trans	-68.5	-56.6	-178.9	-177.6	173.9	177.3	-170.6	-1.3	113.3	F796 W800 C801 T802 F837	F796-R798 PolarHBondContact O-N 3.27Å; F796-R798 VanDerWaalsContact O-N 3.12Å; R798-W800 VanDerWaalsContact C-N 3.29Å; R798-W800 PolarHBondContact O-N 3.35Å; R798-C801 PolarHBondContact O-N 3.07Å; R798-T802 PolarHBondContact O-N 2.99Å; R798-T802 VanDerWaalsContact O-N 3.12Å; R798-T802 PolarHBondContact O-OG1 2.89Å; R798-F837 HydrophobicContact CG-CD1 4.06Å; R798-F837 HydrophobicContact CG-CD2 4.04Å; R798-F837 HydrophobicContact CG-CE1 3.88Å; R798-F837 HydrophobicContact CG-CE2 3.85Å; R798-F837 HydrophobicContact CG-CG 4.15Å; R798-F837 HydrophobicContact CG-CZ 3.79Å
799	P	97	Very high	94.8	Very high	29 Å²	29	43.5 Å²	43.5	19%	0.188	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-34.6	174.9	27.1	-36.2	0	0	0	111.8	I761 F796 C801 T802 S803	I761-P799 HydrophobicContact CG1-CB 4.03Å; I761-P799 HydrophobicContact CG1-CG 4.1Å; I761-P799 HydrophobicContact CG2-CG 4.29Å; I761-P799 VanDerWaalsContact O-CB 3.24Å; I761-P799 WeakPolarHBondContact O-CB 3.39Å; F796-P799 WeakPolarHBondContact O-CD 3.47Å; F796-P799 VanDerWaalsContact O-CG 3.3Å; F796-P799 WeakPolarHBondContact O-CG 3.43Å; P799-C801 PolarHBondContact O-N 3.34Å; P799-T802 PolarHBondContact O-N 3.26Å; P799-T802 VanDerWaalsContact O-N 3.15Å; P799-S803 PolarHBondContact O-N 3.47Å; P799-S803 PolarHBondContact O-OG 3.45Å
800	W	98.3	Very high	94.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56.3	-48.6	175.1	-173.3	98.5	0	0	0	113	I761 A775 F796 I797 R798 L804 A816 F817 I820	I761-W800 HydrophobicContact CD1-CB 3.94Å; A775-W800 HydrophobicContact CB-CG 4.06Å; A775-W800 VanDerWaalsContact O-CD1 3.3Å; A775-W800 PolarHBondContact O-NE1 3.21Å; F796-W800 HydrophobicContact CD2-CB 4.01Å; F796-W800 HydrophobicContact CD2-CG 4.22Å; F796-W800 WeakPolarHBondContact O-CB 3.43Å; F796-W800 PolarHBondContact O-N 3.12Å; I797-W800 HydrophobicContact CD1-CE3 4.44Å; R798-W800 VanDerWaalsContact C-N 3.29Å; R798-W800 PolarHBondContact O-N 3.35Å; W800-L804 HydrophobicContact CD2-CD1 4.09Å; W800-L804 VanDerWaalsContact CE2-CD1 3.5Å; W800-L804 HydrophobicContact CH2-CD1 3.85Å; W800-L804 HydrophobicContact CZ2-CD1 3.39Å; W800-L804 HydrophobicContact CZ3-CD1 4.39Å; W800-L804 PolarHBondContact O-N 2.75Å; W800-L804 VanDerWaalsContact O-N 3.08Å; W800-A816 HydrophobicContact CZ2-CB 4.08Å; W800-F817 AromaticContact CH2-CD1 3.94Å; W800-F817 HydrophobicContact CH2-CD1 3.94Å; W800-F817 AromaticContact CH2-CD2 3.73Å; W800-F817 HydrophobicContact CH2-CD2 3.73Å; W800-F817 HydrophobicContact CH2-CE1 4.05Å; W800-F817 AromaticContact CH2-CE2 3.85Å; W800-F817 HydrophobicContact CH2-CE2 3.85Å; W800-F817 AromaticContact CH2-CG 3.81Å; W800-F817 HydrophobicContact CH2-CG 3.81Å; W800-F817 HydrophobicContact CH2-CZ 4.03Å; W800-F817 HydrophobicContact CZ2-CD2 4.48Å; W800-F817 HydrophobicContact CZ3-CD1 4.32Å; W800-F817 HydrophobicContact CZ3-CE1 4.05Å; W800-F817 HydrophobicContact CZ3-CE2 4.28Å; W800-F817 HydrophobicContact CZ3-CZ 4.05Å; W800-I820 HydrophobicContact CD2-CD1 4.15Å; W800-I820 HydrophobicContact CD2-CG1 4.4Å; W800-I820 HydrophobicContact CE3-CD1 4.32Å; W800-I820 HydrophobicContact CE3-CG1 4.11Å; W800-I820 HydrophobicContact CH2-CB 3.65Å; W800-I820 HydrophobicContact CH2-CG1 4.01Å; W800-I820 HydrophobicContact CH2-CG2 3.58Å; W800-I820 HydrophobicContact CZ2-CB 3.82Å; W800-I820 HydrophobicContact CZ2-CD1 4.41Å; W800-I820 HydrophobicContact CZ2-CG1 4.23Å; W800-I820 HydrophobicContact CZ2-CG2 4.25Å; W800-I820 HydrophobicContact CZ3-CB 4.08Å; W800-I820 HydrophobicContact CZ3-CG1 3.94Å; W800-I820 HydrophobicContact CZ3-CG2 3.93Å
801	C	97.6	Very high	94	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-39.1	176.8	-75.9	0	0	0	0	112	I797 R798 P799 R805 F837 A841	I797-C801 WeakPolarHBondContact O-CB 3.5Å; I797-C801 PolarHBondContact O-N 3.49Å; I797-C801 PolarHBondContact O-SG 3.08Å; R798-C801 PolarHBondContact O-N 3.07Å; P799-C801 PolarHBondContact O-N 3.34Å; C801-R805 WeakPolarHBondContact O-CB 3.5Å; C801-R805 VanDerWaalsContact O-CG 3.3Å; C801-R805 WeakPolarHBondContact O-CG 3.3Å; C801-R805 PolarHBondContact O-N 2.91Å; C801-F837 HydrophobicContact CB-CB 3.67Å; C801-F837 WeakPolarHBondContact CB-O 3.37Å; C801-F837 VanDerWaalsContact SG-C 3.6Å; C801-A841 HydrophobicContact CB-CB 3.94Å
802	T	94.7	Very high	93.8	Very high	66 Å²	66	49.2 Å²	49.2	41%	0.405	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-39.5	178.7	-53.9	0	0	0	0	112	R798 P799 R805	R798-T802 PolarHBondContact O-N 2.99Å; R798-T802 VanDerWaalsContact O-N 3.12Å; R798-T802 PolarHBondContact O-OG1 2.89Å; P799-T802 PolarHBondContact O-N 3.26Å; P799-T802 VanDerWaalsContact O-N 3.15Å; T802-R805 WeakPolarHBondContact O-CG 3.47Å
803	S	94.3	Very high	93.7	Very high	14 Å²	14	47.7 Å²	47.7	10%	0.098	22%	0.222	C	C	.	.	H	α-helix	trans	-72.9	-52.4	177.9	-58.1	0	0	0	0	111.4	P799 R805 N806	P799-S803 PolarHBondContact O-N 3.47Å; P799-S803 PolarHBondContact O-OG 3.45Å; S803-R805 VanDerWaalsContact C-N 3.3Å; S803-R805 PolarHBondContact O-N 2.83Å; S803-N806 PolarHBondContact O-N 2.6Å
804	L	95.1	Very high	93.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-80.1	-3.8	-171.3	-58.9	-172.2	0	0	0	115.3	E772 A775 I776 W800 N806 I807 K813 A816 F817	E772-L804 HydrophobicContact CB-CD2 4.45Å; A775-L804 HydrophobicContact CB-CD1 3.93Å; A775-L804 HydrophobicContact CB-CD2 3.84Å; A775-L804 HydrophobicContact CB-CG 3.69Å; I776-L804 HydrophobicContact CD1-CD2 4.29Å; I776-L804 HydrophobicContact CG1-CD1 4.37Å; I776-L804 HydrophobicContact CG1-CD2 3.8Å; W800-L804 HydrophobicContact CD2-CD1 4.09Å; W800-L804 VanDerWaalsContact CE2-CD1 3.5Å; W800-L804 HydrophobicContact CH2-CD1 3.85Å; W800-L804 HydrophobicContact CZ2-CD1 3.39Å; W800-L804 HydrophobicContact CZ3-CD1 4.39Å; W800-L804 PolarHBondContact O-N 2.75Å; W800-L804 VanDerWaalsContact O-N 3.08Å; L804-N806 VanDerWaalsContact C-N 3.26Å; L804-N806 PolarHBondContact O-N 2.92Å; L804-I807 HydrophobicContact CB-CD1 4.38Å; L804-I807 HydrophobicContact CB-CG1 4.34Å; L804-I807 HydrophobicContact CD2-CD1 3.67Å; L804-I807 HydrophobicContact CD2-CG1 4.25Å; L804-I807 WeakPolarHBondContact O-CG1 3.27Å; L804-K813 WeakPolarHBondContact O-CE 3.29Å; L804-A816 HydrophobicContact CD1-CB 3.96Å; L804-F817 HydrophobicContact CB-CE2 4Å; L804-F817 HydrophobicContact CB-CZ 4.5Å; L804-F817 HydrophobicContact CD1-CE2 4.37Å
805	R	91.4	Very high	93.7	Very high	104 Å²	104	44 Å²	44	39%	0.392	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.5	172.8	55.4	167.6	-91.5	175.3	-11.1	112.9	C801 T802 S803 D840 S844	C801-R805 WeakPolarHBondContact O-CB 3.5Å; C801-R805 VanDerWaalsContact O-CG 3.3Å; C801-R805 WeakPolarHBondContact O-CG 3.3Å; C801-R805 PolarHBondContact O-N 2.91Å; T802-R805 WeakPolarHBondContact O-CG 3.47Å; S803-R805 VanDerWaalsContact C-N 3.3Å; S803-R805 PolarHBondContact O-N 2.83Å; R805-D840 WeakPolarHBondContact CD-OD2 3.26Å; R805-D840 IonicContact CZ-OD2 3.73Å; R805-D840 IonicContact NE-OD2 3.31Å; R805-D840 IonicContact NH1-OD1 3.28Å; R805-D840 IonicContact NH1-OD2 2.64Å; R805-D840 PolarHBondContact NH1-OD2 3.34Å; R805-S844 WeakPolarHBondContact O-CB 3.42Å; R805-S844 PolarHBondContact O-OG 2.76Å
806	N	83.5	Confident	93.8	Very high	68 Å²	68	38.8 Å²	38.8	36%	0.364	18%	0.182	S	C	.	.	S	Bend	trans	-101	-0	-172.6	-59.3	-26.7	0	0	0	113.6	H349 S803 L804	H349-N806 PolarHBondContact ND1-O 3.4Å; S803-N806 PolarHBondContact O-N 2.6Å; L804-N806 VanDerWaalsContact C-N 3.26Å; L804-N806 PolarHBondContact O-N 2.92Å
807	I	87.1	Confident	93.8	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.015	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-88.2	145.9	177.3	63.7	160.7	0	0	0	111.5	Q347 E772 I776 L804 K813	Q347-I807 HydrophobicContact CB-CG2 4.04Å; Q347-I807 HydrophobicContact CG-CG2 4.41Å; E772-I807 HydrophobicContact CB-CG2 4.48Å; E772-I807 VanDerWaalsContact CD-CG2 3.48Å; E772-I807 HydrophobicContact CG-CG2 3.98Å; I776-I807 HydrophobicContact CD1-CD1 4.33Å; L804-I807 HydrophobicContact CB-CD1 4.38Å; L804-I807 HydrophobicContact CB-CG1 4.34Å; L804-I807 HydrophobicContact CD2-CD1 3.67Å; L804-I807 HydrophobicContact CD2-CG1 4.25Å; L804-I807 WeakPolarHBondContact O-CG1 3.27Å; I807-K813 HydrophobicContact CD1-CB 3.62Å; I807-K813 HydrophobicContact CD1-CD 4.1Å; I807-K813 HydrophobicContact CD1-CG 3.62Å; I807-K813 HydrophobicContact CG1-CB 4.32Å; I807-K813 HydrophobicContact CG1-CD 3.86Å; I807-K813 HydrophobicContact CG1-CG 3.92Å; I807-K813 PolarHBondContact O-NZ 2.91Å
808	R	86.6	Confident	93.8	Very high	105 Å²	105	40.1 Å²	40.1	40%	0.396	19%	0.187	S	C	.	.			trans	-59.7	152.5	175.7	-74.7	-177.2	-171.1	176.3	0.9	111.9	Q348 H349 E350 N810 K813	Q348-R808 HydrophobicContact CB-CG 4.43Å; Q348-R808 WeakPolarHBondContact O-CG 3.46Å; Q348-R808 PolarHBondContact O-N 3.09Å; Q348-R808 VanDerWaalsContact OE1-NH1 3.16Å; H349-R808 PolarHBondContact O-NE 3.36Å; H349-R808 PolarHBondContact O-NH2 3.02Å; E350-R808 HydrophobicContact CB-CG 3.86Å; E350-R808 HydrophobicContact CG-CG 3.98Å; R808-N810 PolarHBondContact O-N 3.21Å; R808-K813 WeakPolarHBondContact O-CD 3.45Å
809	D	89.3	Confident	93.9	Very high	43 Å²	43	33.2 Å²	33.2	23%	0.23	16%	0.161	C	C	.	.	S	Bend	trans	-68.4	99.1	174	-71.6	-3.8	0	0	0	110.3	K813 W845 V846 N847	D809-K813 IonicContact OD1-NZ 3.54Å; D809-K813 PolarHBondContact OD1-NZ 3.33Å; D809-W845 HydrophobicContact CB-CE3 4Å; D809-W845 HydrophobicContact CB-CZ3 3.9Å; D809-V846 PolarHBondContact OD2-N 3.18Å; D809-N847 PolarHBondContact OD2-N 2.82Å
810	N	89.4	Confident	93.9	Very high	45 Å²	45	31.9 Å²	31.9	24%	0.241	15%	0.152	C	C	.	.			trans	-132.2	179.4	178.7	68.3	8.7	0	0	0	111.8	Q347 R808 E812 K813 D814	Q347-N810 PolarHBondContact OE1-ND2 3.48Å; R808-N810 PolarHBondContact O-N 3.21Å; N810-E812 VanDerWaalsContact C-N 3.26Å; N810-E812 PolarHBondContact ND2-OE2 3.49Å; N810-E812 VanDerWaalsContact ND2-OE2 3.11Å; N810-E812 PolarHBondContact O-N 3.28Å; N810-E812 PolarHBondContact OD1-N 2.95Å; N810-K813 WeakPolarHBondContact OD1-CB 3.13Å; N810-K813 PolarHBondContact OD1-N 3.29Å; N810-D814 WeakPolarHBondContact O-CB 3.42Å; N810-D814 PolarHBondContact O-N 2.87Å
811	E	90.4	Very high	93.9	Very high	125 Å²	125	32 Å²	32	58%	0.584	15%	0.153	S	C	*	.	H	α-helix	trans	-64.6	-29.6	179.5	-67.7	-65.2	153.6	0	0	112.7	S815 K849	E811-S815 WeakPolarHBondContact O-CB 3.46Å; E811-S815 PolarHBondContact O-N 3.31Å; E811-S815 PolarHBondContact O-OG 2.87Å; E811-K849 IonicContact OE1-NZ 3.29Å; E811-K849 PolarHBondContact OE1-NZ 3.48Å; E811-K849 IonicContact OE2-NZ 2.82Å; E811-K849 PolarHBondContact OE2-NZ 3.06Å
812	E	93.5	Very high	93.9	Very high	39 Å²	39	33.2 Å²	33.2	18%	0.182	16%	0.161	C	C	.	.	H	α-helix	trans	-69.5	-50	178.9	-67.8	157.5	151.3	0	0	110.7	Q347 I776 N810 D814 S815 A816	Q347-E812 VanDerWaalsContact CD-OE2 3.31Å; Q347-E812 VanDerWaalsContact NE2-CD 3.3Å; Q347-E812 PolarHBondContact NE2-OE2 2.89Å; Q347-E812 PolarHBondContact OE1-OE2 3.31Å; I776-E812 HydrophobicContact CD1-CB 4.13Å; I776-E812 HydrophobicContact CG2-CB 4.32Å; N810-E812 VanDerWaalsContact C-N 3.26Å; N810-E812 PolarHBondContact ND2-OE2 3.49Å; N810-E812 VanDerWaalsContact ND2-OE2 3.11Å; N810-E812 PolarHBondContact O-N 3.28Å; N810-E812 PolarHBondContact OD1-N 2.95Å; E812-D814 VanDerWaalsContact C-N 3.34Å; E812-D814 PolarHBondContact O-N 3.4Å; E812-S815 PolarHBondContact O-N 3.14Å; E812-S815 PolarHBondContact O-OG 3.04Å; E812-A816 WeakPolarHBondContact O-CB 3.24Å; E812-A816 PolarHBondContact O-N 2.93Å
813	K	95.6	Very high	94.1	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-55.9	-47.3	171.3	-162.3	-174.9	-172.4	174.9	0	110.8	L804 I807 R808 D809 N810 S815 A816 F817 S844 W845	L804-K813 WeakPolarHBondContact O-CE 3.29Å; I807-K813 HydrophobicContact CD1-CB 3.62Å; I807-K813 HydrophobicContact CD1-CD 4.1Å; I807-K813 HydrophobicContact CD1-CG 3.62Å; I807-K813 HydrophobicContact CG1-CB 4.32Å; I807-K813 HydrophobicContact CG1-CD 3.86Å; I807-K813 HydrophobicContact CG1-CG 3.92Å; I807-K813 PolarHBondContact O-NZ 2.91Å; R808-K813 WeakPolarHBondContact O-CD 3.45Å; D809-K813 IonicContact OD1-NZ 3.54Å; D809-K813 PolarHBondContact OD1-NZ 3.33Å; N810-K813 WeakPolarHBondContact OD1-CB 3.13Å; N810-K813 PolarHBondContact OD1-N 3.29Å; K813-S815 PolarHBondContact O-N 3.17Å; K813-A816 PolarHBondContact O-N 3.47Å; K813-F817 HydrophobicContact CD-CE2 4.36Å; K813-F817 HydrophobicContact CG-CD2 3.73Å; K813-F817 HydrophobicContact CG-CE2 3.63Å; K813-F817 VanDerWaalsContact O-CD2 3.26Å; K813-F817 WeakPolarHBondContact O-CD2 3.26Å; K813-F817 PolarHBondContact O-N 3.43Å; K813-S844 PolarHBondContact NZ-OG 3.31Å; K813-S844 VanDerWaalsContact NZ-OG 3.15Å; K813-W845 HydrophobicContact CB-CH2 4.01Å; K813-W845 HydrophobicContact CB-CZ2 3.96Å; K813-W845 HydrophobicContact CD-CD2 4.33Å; K813-W845 HydrophobicContact CD-CH2 4.02Å; K813-W845 HydrophobicContact CD-CZ2 3.69Å; K813-W845 HydrophobicContact CD-CZ3 4.48Å; K813-W845 HydrophobicContact CG-CH2 3.95Å; K813-W845 HydrophobicContact CG-CZ2 3.45Å; K813-W845 VanDerWaalsContact CG-CZ2 3.45Å
814	D	97.1	Very high	94.3	Very high	12 Å²	12	29.9 Å²	29.9	6%	0.064	14%	0.139	C	C	.	.	H	α-helix	trans	-57.8	-50.2	179.5	175.6	83.5	0	0	0	111	N810 E812 A816 F817 R818 W845 L852	N810-D814 WeakPolarHBondContact O-CB 3.42Å; N810-D814 PolarHBondContact O-N 2.87Å; E812-D814 VanDerWaalsContact C-N 3.34Å; E812-D814 PolarHBondContact O-N 3.4Å; D814-A816 PolarHBondContact O-N 3.09Å; D814-F817 PolarHBondContact O-N 2.9Å; D814-R818 VanDerWaalsContact O-CG 3.32Å; D814-R818 WeakPolarHBondContact O-CG 3.45Å; D814-R818 PolarHBondContact O-N 3.44Å; D814-R818 IonicContact OD1-CZ 3.67Å; D814-R818 IonicContact OD1-NE 3.38Å; D814-R818 PolarHBondContact OD1-NE 3.13Å; D814-R818 IonicContact OD1-NH2 3.1Å; D814-R818 PolarHBondContact OD1-NH2 3.5Å; D814-R818 IonicContact OD2-CZ 2.66Å; D814-R818 IonicContact OD2-NE 2.85Å; D814-R818 PolarHBondContact OD2-NE 3.47Å; D814-R818 IonicContact OD2-NH2 2.68Å; D814-R818 PolarHBondContact OD2-NH2 2.87Å; D814-W845 HydrophobicContact CB-CH2 3.87Å; D814-L852 WeakPolarHBondContact OD1-CD2 3.34Å
815	S	97.3	Very high	94.3	Very high	14 Å²	14	33.9 Å²	33.9	10%	0.098	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-40.2	179.2	71.4	0	0	0	0	112.9	R780 E811 E812 K813 R818 G819	R780-S815 PolarHBondContact NE-OG 2.9Å; E811-S815 WeakPolarHBondContact O-CB 3.46Å; E811-S815 PolarHBondContact O-N 3.31Å; E811-S815 PolarHBondContact O-OG 2.87Å; E812-S815 PolarHBondContact O-N 3.14Å; E812-S815 PolarHBondContact O-OG 3.04Å; K813-S815 PolarHBondContact O-N 3.17Å; S815-R818 PolarHBondContact O-N 3.45Å; S815-G819 PolarHBondContact O-N 3.41Å
816	A	98.1	Very high	94.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.7	-44.2	178.1	0	0	0	0	0	111.7	I776 W800 L804 E812 K813 D814 G819 I820	I776-A816 HydrophobicContact CB-CB 4.4Å; I776-A816 HydrophobicContact CG1-CB 4.29Å; I776-A816 HydrophobicContact CG2-CB 4.45Å; W800-A816 HydrophobicContact CZ2-CB 4.08Å; L804-A816 HydrophobicContact CD1-CB 3.96Å; E812-A816 WeakPolarHBondContact O-CB 3.24Å; E812-A816 PolarHBondContact O-N 2.93Å; K813-A816 PolarHBondContact O-N 3.47Å; D814-A816 PolarHBondContact O-N 3.09Å; A816-G819 WeakPolarHBondContact O-CA 3.29Å; A816-G819 PolarHBondContact O-N 2.87Å; A816-G819 VanDerWaalsContact O-N 3.14Å; A816-I820 PolarHBondContact O-N 2.92Å
817	F	98.4	Very high	95.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-71.1	-30.9	178.9	-86	-100.1	0	0	0	112.9	W800 L804 K813 D814 G819 I820 C821 A841 W845 L852 F856	W800-F817 AromaticContact CH2-CD1 3.94Å; W800-F817 HydrophobicContact CH2-CD1 3.94Å; W800-F817 AromaticContact CH2-CD2 3.73Å; W800-F817 HydrophobicContact CH2-CD2 3.73Å; W800-F817 HydrophobicContact CH2-CE1 4.05Å; W800-F817 AromaticContact CH2-CE2 3.85Å; W800-F817 HydrophobicContact CH2-CE2 3.85Å; W800-F817 AromaticContact CH2-CG 3.81Å; W800-F817 HydrophobicContact CH2-CG 3.81Å; W800-F817 HydrophobicContact CH2-CZ 4.03Å; W800-F817 HydrophobicContact CZ2-CD2 4.48Å; W800-F817 HydrophobicContact CZ3-CD1 4.32Å; W800-F817 HydrophobicContact CZ3-CE1 4.05Å; W800-F817 HydrophobicContact CZ3-CE2 4.28Å; W800-F817 HydrophobicContact CZ3-CZ 4.05Å; L804-F817 HydrophobicContact CB-CE2 4Å; L804-F817 HydrophobicContact CB-CZ 4.5Å; L804-F817 HydrophobicContact CD1-CE2 4.37Å; K813-F817 HydrophobicContact CD-CE2 4.36Å; K813-F817 HydrophobicContact CG-CD2 3.73Å; K813-F817 HydrophobicContact CG-CE2 3.63Å; K813-F817 VanDerWaalsContact O-CD2 3.26Å; K813-F817 WeakPolarHBondContact O-CD2 3.26Å; K813-F817 PolarHBondContact O-N 3.43Å; D814-F817 PolarHBondContact O-N 2.9Å; F817-G819 PolarHBondContact O-N 2.75Å; F817-I820 HydrophobicContact CD1-CG2 4.26Å; F817-I820 WeakPolarHBondContact O-CG2 3.44Å; F817-I820 PolarHBondContact O-N 2.83Å; F817-C821 WeakPolarHBondContact O-CB 3.19Å; F817-C821 PolarHBondContact O-N 3.28Å; F817-C821 PolarHBondContact O-SG 2.88Å; F817-A841 HydrophobicContact CE1-CB 3.98Å; F817-A841 HydrophobicContact CZ-CB 3.9Å; F817-A841 WeakPolarHBondContact CZ-O 3.43Å; F817-W845 HydrophobicContact CB-CZ2 4.18Å; F817-W845 AromaticContact CD1-NE1 3.53Å; F817-W845 AromaticContact CD2-CZ2 3.88Å; F817-W845 HydrophobicContact CD2-CZ2 3.88Å; F817-W845 AromaticContact CD2-NE1 3.59Å; F817-W845 AromaticContact CE1-NE1 3.5Å; F817-W845 HydrophobicContact CE2-CZ2 4.44Å; F817-W845 AromaticContact CE2-NE1 3.55Å; F817-W845 HydrophobicContact CG-CZ2 4.07Å; F817-W845 AromaticContact CG-NE1 3.55Å; F817-W845 AromaticContact CZ-NE1 3.48Å; F817-L852 HydrophobicContact CB-CD1 4.15Å; F817-L852 HydrophobicContact CB-CD2 4.23Å; F817-F856 HydrophobicContact CB-CE1 4.21Å; F817-F856 HydrophobicContact CB-CZ 4.08Å; F817-F856 AromaticContact CD1-CE1 3.68Å; F817-F856 HydrophobicContact CD1-CE1 3.68Å; F817-F856 AromaticContact CD1-CZ 3.63Å; F817-F856 HydrophobicContact CD1-CZ 3.63Å; F817-F856 HydrophobicContact CE1-CZ 4.38Å; F817-F856 HydrophobicContact CG-CE1 4.38Å; F817-F856 HydrophobicContact CG-CZ 4.14Å
818	R	98.3	Very high	95.4	Very high	27 Å²	27	33.5 Å²	33.5	10%	0.102	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-40.5	167.8	-72.1	171.9	-171.8	-76.2	-13	111.1	Y783 D814 S815 T822 D851 L852 M855	Y783-R818 HydrophobicContact CD2-CB 3.85Å; Y783-R818 HydrophobicContact CE2-CB 3.8Å; Y783-R818 HydrophobicContact CG-CB 4.35Å; D814-R818 VanDerWaalsContact O-CG 3.32Å; D814-R818 WeakPolarHBondContact O-CG 3.45Å; D814-R818 PolarHBondContact O-N 3.44Å; D814-R818 IonicContact OD1-CZ 3.67Å; D814-R818 IonicContact OD1-NE 3.38Å; D814-R818 PolarHBondContact OD1-NE 3.13Å; D814-R818 IonicContact OD1-NH2 3.1Å; D814-R818 PolarHBondContact OD1-NH2 3.5Å; D814-R818 IonicContact OD2-CZ 2.66Å; D814-R818 IonicContact OD2-NE 2.85Å; D814-R818 PolarHBondContact OD2-NE 3.47Å; D814-R818 IonicContact OD2-NH2 2.68Å; D814-R818 PolarHBondContact OD2-NH2 2.87Å; S815-R818 PolarHBondContact O-N 3.45Å; R818-T822 WeakPolarHBondContact O-CB 3.24Å; R818-T822 PolarHBondContact O-N 3.44Å; R818-T822 PolarHBondContact O-OG1 3.16Å; R818-D851 IonicContact CZ-OD1 2.74Å; R818-D851 IonicContact CZ-OD2 2.83Å; R818-D851 VanDerWaalsContact CZ-OD2 3.29Å; R818-D851 VanDerWaalsContact NH1-CG 3.34Å; R818-D851 IonicContact NH1-OD1 3.02Å; R818-D851 IonicContact NH1-OD2 3.55Å; R818-D851 PolarHBondContact NH1-OD2 3.06Å; R818-D851 VanDerWaalsContact NH2-CG 3.28Å; R818-D851 IonicContact NH2-OD1 2.86Å; R818-D851 PolarHBondContact NH2-OD1 2.96Å; R818-D851 IonicContact NH2-OD2 2.7Å; R818-D851 PolarHBondContact NH2-OD2 3.35Å; R818-D851 VanDerWaalsContact NH2-OD2 3.1Å; R818-L852 HydrophobicContact CG-CD1 4.05Å; R818-M855 HydrophobicContact CG-SD 4.48Å
819	G	98.1	Very high	95.6	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-52.6	173.4	0	0	0	0	0	113.8	G779 Y783 S815 A816 F817 C821 T822 M823	G779-G819 VanDerWaalsContact O-CA 3.24Å; G779-G819 WeakPolarHBondContact O-CA 3.4Å; Y783-G819 VanDerWaalsContact CB-CA 3.49Å; S815-G819 PolarHBondContact O-N 3.41Å; A816-G819 WeakPolarHBondContact O-CA 3.29Å; A816-G819 PolarHBondContact O-N 2.87Å; A816-G819 VanDerWaalsContact O-N 3.14Å; F817-G819 PolarHBondContact O-N 2.75Å; G819-C821 VanDerWaalsContact C-N 3.31Å; G819-C821 PolarHBondContact O-N 3.08Å; G819-T822 PolarHBondContact O-N 2.89Å; G819-M823 WeakPolarHBondContact O-CG 3.44Å; G819-M823 PolarHBondContact O-N 3.23Å
820	I	98.4	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-41.8	179.5	-149.4	63.6	0	0	0	111.5	L793 F796 I797 W800 A816 F817 T822 M823 I824 F838	L793-I820 HydrophobicContact CD1-CD1 3.49Å; L793-I820 VanDerWaalsContact CD1-CD1 3.49Å; L793-I820 HydrophobicContact CD1-CG1 4.42Å; F796-I820 HydrophobicContact CE2-CD1 3.83Å; I797-I820 HydrophobicContact CD1-CD1 3.71Å; I797-I820 HydrophobicContact CD1-CG1 3.72Å; W800-I820 HydrophobicContact CD2-CD1 4.15Å; W800-I820 HydrophobicContact CD2-CG1 4.4Å; W800-I820 HydrophobicContact CE3-CD1 4.32Å; W800-I820 HydrophobicContact CE3-CG1 4.11Å; W800-I820 HydrophobicContact CH2-CB 3.65Å; W800-I820 HydrophobicContact CH2-CG1 4.01Å; W800-I820 HydrophobicContact CH2-CG2 3.58Å; W800-I820 HydrophobicContact CZ2-CB 3.82Å; W800-I820 HydrophobicContact CZ2-CD1 4.41Å; W800-I820 HydrophobicContact CZ2-CG1 4.23Å; W800-I820 HydrophobicContact CZ2-CG2 4.25Å; W800-I820 HydrophobicContact CZ3-CB 4.08Å; W800-I820 HydrophobicContact CZ3-CG1 3.94Å; W800-I820 HydrophobicContact CZ3-CG2 3.93Å; A816-I820 PolarHBondContact O-N 2.92Å; F817-I820 HydrophobicContact CD1-CG2 4.26Å; F817-I820 WeakPolarHBondContact O-CG2 3.44Å; F817-I820 PolarHBondContact O-N 2.83Å; I820-T822 VanDerWaalsContact C-N 3.33Å; I820-T822 PolarHBondContact O-N 2.82Å; I820-M823 HydrophobicContact CD1-CE 3.69Å; I820-M823 PolarHBondContact O-N 3.13Å; I820-I824 HydrophobicContact CG1-CD1 4.31Å; I820-I824 WeakPolarHBondContact O-CB 3.49Å; I820-I824 VanDerWaalsContact O-CG1 3.24Å; I820-I824 WeakPolarHBondContact O-CG1 3.4Å; I820-I824 PolarHBondContact O-N 3.04Å; I820-F838 HydrophobicContact CG2-CD2 4.43Å; I820-F838 HydrophobicContact CG2-CE2 3.79Å
821	C	98.2	Very high	95.9	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.02	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-39.6	178.5	-67.2	0	0	0	0	111.8	F817 G819 I824 S825 M855 I859	F817-C821 WeakPolarHBondContact O-CB 3.19Å; F817-C821 PolarHBondContact O-N 3.28Å; F817-C821 PolarHBondContact O-SG 2.88Å; G819-C821 VanDerWaalsContact C-N 3.31Å; G819-C821 PolarHBondContact O-N 3.08Å; C821-I824 PolarHBondContact O-N 2.79Å; C821-S825 PolarHBondContact O-N 2.94Å; C821-M855 HydrophobicContact CB-CB 4.01Å; C821-M855 HydrophobicContact CB-CE 3.45Å; C821-M855 VanDerWaalsContact CB-CE 3.45Å; C821-M855 HydrophobicContact CB-SD 4.16Å; C821-I859 HydrophobicContact CB-CD1 3.67Å
822	T	98	Very high	95.8	Very high	28 Å²	28	23.8 Å²	23.8	17%	0.172	15%	0.153	C	C	.	.	H	α-helix	trans	-65.1	-44.6	176.2	-55.2	0	0	0	0	110.7	P786 R818 G819 I820 S825 V826	P786-T822 HydrophobicContact CB-CG2 3.81Å; P786-T822 HydrophobicContact CG-CG2 3.88Å; R818-T822 WeakPolarHBondContact O-CB 3.24Å; R818-T822 PolarHBondContact O-N 3.44Å; R818-T822 PolarHBondContact O-OG1 3.16Å; G819-T822 PolarHBondContact O-N 2.89Å; I820-T822 VanDerWaalsContact C-N 3.33Å; I820-T822 PolarHBondContact O-N 2.82Å; T822-S825 WeakPolarHBondContact O-CB 3.35Å; T822-S825 PolarHBondContact O-N 3.05Å; T822-S825 PolarHBondContact O-OG 3.2Å; T822-V826 PolarHBondContact O-N 3.14Å
823	M	98.3	Very high	95.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.2	-42.6	176.2	-72.1	-170.4	-81	0	0	112.7	V789 A790 L793 F796 G819 I820 S825 V826 N827	V789-M823 HydrophobicContact CB-SD 3.71Å; V789-M823 HydrophobicContact CG1-CE 4.38Å; V789-M823 HydrophobicContact CG1-SD 3.4Å; V789-M823 WeakPolarHBondContact CG1-SD 3.3Å; A790-M823 HydrophobicContact CB-CB 3.92Å; A790-M823 HydrophobicContact CB-CG 4.05Å; L793-M823 HydrophobicContact CD1-CB 4.33Å; F796-M823 HydrophobicContact CE2-CE 4.27Å; F796-M823 HydrophobicContact CZ-CE 3.93Å; F796-M823 HydrophobicContact CZ-SD 3.99Å; G819-M823 WeakPolarHBondContact O-CG 3.44Å; G819-M823 PolarHBondContact O-N 3.23Å; I820-M823 HydrophobicContact CD1-CE 3.69Å; I820-M823 PolarHBondContact O-N 3.13Å; M823-S825 VanDerWaalsContact C-N 3.25Å; M823-S825 PolarHBondContact O-N 3.46Å; M823-V826 PolarHBondContact O-N 2.95Å; M823-N827 PolarHBondContact O-N 3.4Å
824	I	97.6	Very high	95.4	Very high	9 Å²	9	30.5 Å²	30.5	5%	0.046	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-37.6	175.2	-69.9	165.4	0	0	0	110.5	L793 I820 C821 V826 N827 P828 V831 F838 I859	L793-I824 HydrophobicContact CD2-CG1 3.87Å; I820-I824 HydrophobicContact CG1-CD1 4.31Å; I820-I824 WeakPolarHBondContact O-CB 3.49Å; I820-I824 VanDerWaalsContact O-CG1 3.24Å; I820-I824 WeakPolarHBondContact O-CG1 3.4Å; I820-I824 PolarHBondContact O-N 3.04Å; C821-I824 PolarHBondContact O-N 2.79Å; I824-V826 VanDerWaalsContact C-N 3.26Å; I824-V826 PolarHBondContact O-N 3.37Å; I824-N827 CarbonylContact O-C 3.28Å; I824-P828 VanDerWaalsContact O-CA 3.24Å; I824-P828 WeakPolarHBondContact O-CA 3.41Å; I824-P828 WeakPolarHBondContact O-CD 3.49Å; I824-P828 WeakPolarHBondContact O-CG 3.23Å; I824-V831 HydrophobicContact CD1-CG1 4.33Å; I824-V831 HydrophobicContact CD1-CG2 4.43Å; I824-V831 HydrophobicContact CG1-CB 4.32Å; I824-V831 HydrophobicContact CG1-CG1 3.99Å; I824-V831 HydrophobicContact CG2-CG1 4Å; I824-F838 HydrophobicContact CD1-CD2 3.83Å; I824-F838 HydrophobicContact CD1-CE1 4.44Å; I824-F838 HydrophobicContact CD1-CE2 3.67Å; I824-F838 HydrophobicContact CD1-CG 4.29Å; I824-F838 HydrophobicContact CD1-CZ 3.98Å; I824-I859 HydrophobicContact CB-CD1 4.17Å; I824-I859 HydrophobicContact CD1-CD1 4.21Å; I824-I859 HydrophobicContact CG2-CD1 4.07Å; I824-I859 HydrophobicContact CG2-CG1 4.14Å; I824-I859 HydrophobicContact CG2-CG2 3.95Å
825	S	95.6	Very high	95.2	Very high	85 Å²	85	30.1 Å²	30.1	59%	0.594	18%	0.183	S	C	*	.	H	α-helix	trans	-65.5	-29	176.4	80.6	0	0	0	0	113.4	C821 T822 M823	C821-S825 PolarHBondContact O-N 2.94Å; T822-S825 WeakPolarHBondContact O-CB 3.35Å; T822-S825 PolarHBondContact O-N 3.05Å; T822-S825 PolarHBondContact O-OG 3.2Å; M823-S825 VanDerWaalsContact C-N 3.25Å; M823-S825 PolarHBondContact O-N 3.46Å
826	V	96.7	Very high	94.9	Very high	54 Å²	54	31.9 Å²	31.9	33%	0.327	19%	0.191	S	C	.	.	H	α-helix	trans	-84.2	-41.7	177.8	173.1	0	0	0	0	111.9	P786 A790 T822 M823 I824	P786-V826 HydrophobicContact CB-CG2 4.02Å; P786-V826 HydrophobicContact CG-CG2 4.48Å; A790-V826 HydrophobicContact CB-CB 4.08Å; A790-V826 HydrophobicContact CB-CG1 3.98Å; T822-V826 PolarHBondContact O-N 3.14Å; M823-V826 PolarHBondContact O-N 2.95Å; I824-V826 VanDerWaalsContact C-N 3.26Å; I824-V826 PolarHBondContact O-N 3.37Å
827	N	95.9	Very high	94.7	Very high	50 Å²	50	34.4 Å²	34.4	27%	0.267	20%	0.202	S	C	.	.			trans	-131.6	74.6	179.4	-177.3	17	0	0	0	111.7	A790 M823 I824 G829 G830	A790-N827 HydrophobicContact CB-CB 4Å; A790-N827 PolarHBondContact O-ND2 3.32Å; M823-N827 PolarHBondContact O-N 3.4Å; I824-N827 CarbonylContact O-C 3.28Å; N827-G829 PolarHBondContact O-N 2.86Å; N827-G830 PolarHBondContact O-N 3.42Å; N827-G830 VanDerWaalsContact O-N 3.12Å; N827-G830 PolarHBondContact OD1-N 3.15Å
828	P	92.6	Very high	94.6	Very high	63 Å²	63	34.4 Å²	34.4	41%	0.409	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-60.5	-30.9	179.3	-20.8	29.1	0	0	0	112.7	I824 G830 V831 V832	I824-P828 VanDerWaalsContact O-CA 3.24Å; I824-P828 WeakPolarHBondContact O-CA 3.41Å; I824-P828 WeakPolarHBondContact O-CD 3.49Å; I824-P828 WeakPolarHBondContact O-CG 3.23Å; P828-G830 PolarHBondContact O-N 3.33Å; P828-V831 WeakPolarHBondContact O-CG1 3.48Å; P828-V831 PolarHBondContact O-N 2.95Å; P828-V832 WeakPolarHBondContact O-CG2 3.09Å
829	G	91.7	Very high	94.4	Very high	51 Å²	51	33.1 Å²	33.1	53%	0.526	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-60.5	-24.7	179.1	0	0	0	0	0	113.7	N827 V831	N827-G829 PolarHBondContact O-N 2.86Å; G829-V831 VanDerWaalsContact C-N 3.32Å; G829-V831 PolarHBondContact O-N 3.48Å
830	G	90.8	Very high	94.1	Very high	3 Å²	3	35.2 Å²	35.2	3%	0.031	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-71.7	-17.7	-178.9	0	0	0	0	0	115.2	Q794 N827 P828	Q794-G830 VanDerWaalsContact CA-O 3.28Å; Q794-G830 WeakPolarHBondContact CA-O 3.26Å; N827-G830 PolarHBondContact O-N 3.42Å; N827-G830 VanDerWaalsContact O-N 3.12Å; N827-G830 PolarHBondContact OD1-N 3.15Å; P828-G830 PolarHBondContact O-N 3.33Å
831	V	92.8	Very high	93.9	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.024	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-11.1	-178.2	66.5	0	0	0	0	113.7	L793 I797 I824 P828 G829 Q833 D834 F835 F838	L793-V831 HydrophobicContact CD2-CB 4.36Å; I797-V831 HydrophobicContact CD1-CG2 4.38Å; I797-V831 HydrophobicContact CG1-CG2 3.89Å; I824-V831 HydrophobicContact CD1-CG1 4.33Å; I824-V831 HydrophobicContact CD1-CG2 4.43Å; I824-V831 HydrophobicContact CG1-CB 4.32Å; I824-V831 HydrophobicContact CG1-CG1 3.99Å; I824-V831 HydrophobicContact CG2-CG1 4Å; P828-V831 WeakPolarHBondContact O-CG1 3.48Å; P828-V831 PolarHBondContact O-N 2.95Å; G829-V831 VanDerWaalsContact C-N 3.32Å; G829-V831 PolarHBondContact O-N 3.48Å; V831-Q833 VanDerWaalsContact C-N 3.3Å; V831-Q833 PolarHBondContact O-N 2.9Å; V831-D834 CarbonylContact O-C 3.46Å; V831-D834 PolarHBondContact O-N 3.13Å; V831-D834 VanDerWaalsContact O-N 3.12Å; V831-F835 HydrophobicContact CG1-CD2 4.23Å; V831-F835 HydrophobicContact CG2-CD2 4.12Å; V831-F835 WeakPolarHBondContact O-CA 3.46Å; V831-F835 PolarHBondContact O-N 3.42Å; V831-F838 HydrophobicContact CG2-CB 4.08Å
832	V	88.6	Confident	93.8	Very high	56 Å²	56	35 Å²	35	34%	0.339	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-57.6	-39.3	-170.6	173.3	0	0	0	0	113.3	P828 F863	P828-V832 WeakPolarHBondContact O-CG2 3.09Å; V832-F863 HydrophobicContact CB-CE2 4.48Å; V832-F863 HydrophobicContact CG1-CE2 4.15Å; V832-F863 HydrophobicContact CG2-CE2 4.47Å
833	Q	88.1	Confident	93.6	Very high	151 Å²	151	34 Å²	34	71%	0.706	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-72	-30.9	-177.7	-67.7	-174.3	-12.3	0	0	112.8	V831	V831-Q833 VanDerWaalsContact C-N 3.3Å; V831-Q833 PolarHBondContact O-N 2.9Å
834	D	92.4	Very high	93.3	Very high	31 Å²	31	34.9 Å²	34.9	17%	0.166	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-114.6	22.3	-174	-64.4	-73	0	0	0	111.9	I797 V831 I836 F837	I797-D834 HydrophobicContact CG2-CB 4.04Å; V831-D834 CarbonylContact O-C 3.46Å; V831-D834 PolarHBondContact O-N 3.13Å; V831-D834 VanDerWaalsContact O-N 3.12Å; D834-I836 PolarHBondContact O-N 3.43Å; D834-F837 HydrophobicContact CB-CD2 3.95Å; D834-F837 WeakPolarHBondContact O-CB 3.36Å; D834-F837 PolarHBondContact O-N 3.44Å
835	F	92.6	Very high	93	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.013	21%	0.207	C	C	.	.	H	α-helix	trans	-59.7	-25.1	-172.6	-166.8	-104.4	0	0	0	113.3	V831 F837 F838 C839 I859 L860 F863 W872 F875	V831-F835 HydrophobicContact CG1-CD2 4.23Å; V831-F835 HydrophobicContact CG2-CD2 4.12Å; V831-F835 WeakPolarHBondContact O-CA 3.46Å; V831-F835 PolarHBondContact O-N 3.42Å; F835-F837 VanDerWaalsContact C-N 3.29Å; F835-F837 PolarHBondContact O-N 2.84Å; F835-F838 HydrophobicContact CD2-CD1 4.42Å; F835-F838 AromaticContact CE2-CD1 3.87Å; F835-F838 HydrophobicContact CE2-CD1 3.87Å; F835-F838 HydrophobicContact CE2-CE1 4.49Å; F835-F838 HydrophobicContact CZ-CD1 4.22Å; F835-F838 PolarHBondContact O-N 3.18Å; F835-C839 WeakPolarHBondContact CE1-SG 3.44Å; F835-C839 PolarHBondContact O-N 3.17Å; F835-C839 PolarHBondContact O-SG 3.29Å; F835-I859 HydrophobicContact CE2-CG2 3.9Å; F835-I859 HydrophobicContact CZ-CG2 4.27Å; F835-L860 HydrophobicContact CE1-CD2 4.23Å; F835-L860 HydrophobicContact CZ-CD2 4.09Å; F835-F863 HydrophobicContact CB-CD2 4.32Å; F835-F863 HydrophobicContact CB-CE1 4.44Å; F835-F863 HydrophobicContact CB-CE2 3.79Å; F835-F863 HydrophobicContact CB-CZ 3.85Å; F835-F863 HydrophobicContact CD1-CB 4.3Å; F835-F863 AromaticContact CD1-CD1 3.43Å; F835-F863 HydrophobicContact CD1-CD1 3.43Å; F835-F863 VanDerWaalsContact CD1-CD1 3.43Å; F835-F863 AromaticContact CD1-CD2 3.87Å; F835-F863 HydrophobicContact CD1-CD2 3.87Å; F835-F863 AromaticContact CD1-CE1 3.53Å; F835-F863 HydrophobicContact CD1-CE1 3.53Å; F835-F863 AromaticContact CD1-CE2 3.97Å; F835-F863 HydrophobicContact CD1-CE2 3.97Å; F835-F863 AromaticContact CD1-CG 3.59Å; F835-F863 HydrophobicContact CD1-CG 3.59Å; F835-F863 AromaticContact CD1-CZ 3.8Å; F835-F863 HydrophobicContact CD1-CZ 3.8Å; F835-F863 HydrophobicContact CD2-CB 4.43Å; F835-F863 AromaticContact CD2-CD2 3.68Å; F835-F863 HydrophobicContact CD2-CD2 3.68Å; F835-F863 HydrophobicContact CD2-CE2 4.02Å; F835-F863 HydrophobicContact CD2-CG 4.02Å; F835-F863 HydrophobicContact CE1-CB 3.63Å; F835-F863 AromaticContact CE1-CD1 3.4Å; F835-F863 HydrophobicContact CE1-CD1 3.4Å; F835-F863 HydrophobicContact CE1-CD2 4.07Å; F835-F863 HydrophobicContact CE1-CE1 4.01Å; F835-F863 AromaticContact CE1-CG 3.42Å; F835-F863 HydrophobicContact CE1-CG 3.42Å; F835-F863 VanDerWaalsContact CE1-CG 3.42Å; F835-F863 HydrophobicContact CE2-CB 3.8Å; F835-F863 AromaticContact CE2-CD2 3.9Å; F835-F863 HydrophobicContact CE2-CD2 3.9Å; F835-F863 AromaticContact CE2-CG 3.88Å; F835-F863 HydrophobicContact CE2-CG 3.88Å; F835-F863 HydrophobicContact CG-CD1 4.11Å; F835-F863 AromaticContact CG-CD2 3.68Å; F835-F863 HydrophobicContact CG-CD2 3.68Å; F835-F863 HydrophobicContact CG-CE1 4.08Å; F835-F863 AromaticContact CG-CE2 3.64Å; F835-F863 HydrophobicContact CG-CE2 3.64Å; F835-F863 AromaticContact CG-CG 3.9Å; F835-F863 HydrophobicContact CG-CG 3.9Å; F835-F863 AromaticContact CG-CZ 3.84Å; F835-F863 HydrophobicContact CG-CZ 3.84Å; F835-F863 HydrophobicContact CZ-CB 3.35Å; F835-F863 HydrophobicContact CZ-CD1 4.06Å; F835-F863 HydrophobicContact CZ-CD2 4.09Å; F835-F863 AromaticContact CZ-CG 3.58Å; F835-F863 HydrophobicContact CZ-CG 3.58Å; F835-W872 HydrophobicContact CD1-CZ3 4.47Å; F835-W872 HydrophobicContact CE1-CH2 4.45Å; F835-W872 HydrophobicContact CE1-CZ3 4.03Å; F835-F875 HydrophobicContact CB-CZ 4.25Å; F835-F875 AromaticContact CD1-CE1 3.92Å; F835-F875 HydrophobicContact CD1-CE1 3.92Å; F835-F875 HydrophobicContact CD1-CZ 4.17Å
836	I	91.6	Very high	92.7	Very high	52 Å²	52	33.2 Å²	33.2	27%	0.267	19%	0.193	S	C	.	.	H	α-helix	trans	-62.3	-37	176.4	-172.3	163.5	0	0	0	111.9	D834 F838 C839 D840 F875 F879	D834-I836 PolarHBondContact O-N 3.43Å; I836-F838 VanDerWaalsContact C-N 3.34Å; I836-C839 WeakPolarHBondContact O-CB 3.36Å; I836-C839 PolarHBondContact O-N 3.07Å; I836-D840 PolarHBondContact O-N 3.31Å; I836-F875 HydrophobicContact CB-CE2 4.18Å; I836-F875 HydrophobicContact CB-CZ 3.78Å; I836-F879 HydrophobicContact CB-CE1 4.47Å; I836-F879 HydrophobicContact CD1-CD1 3.99Å; I836-F879 HydrophobicContact CD1-CE1 3.97Å; I836-F879 HydrophobicContact CG1-CD1 4.14Å; I836-F879 HydrophobicContact CG1-CE1 3.79Å
837	F	93.9	Very high	92.3	Very high	52 Å²	52	37 Å²	37	23%	0.228	21%	0.211	C	C	.	.	H	α-helix	trans	-67.2	-39.1	177.2	-68.4	-85.9	0	0	0	110.9	R798 C801 D834 F835 D840 A841	R798-F837 HydrophobicContact CG-CD1 4.06Å; R798-F837 HydrophobicContact CG-CD2 4.04Å; R798-F837 HydrophobicContact CG-CE1 3.88Å; R798-F837 HydrophobicContact CG-CE2 3.85Å; R798-F837 HydrophobicContact CG-CG 4.15Å; R798-F837 HydrophobicContact CG-CZ 3.79Å; C801-F837 HydrophobicContact CB-CB 3.67Å; C801-F837 WeakPolarHBondContact CB-O 3.37Å; C801-F837 VanDerWaalsContact SG-C 3.6Å; D834-F837 HydrophobicContact CB-CD2 3.95Å; D834-F837 WeakPolarHBondContact O-CB 3.36Å; D834-F837 PolarHBondContact O-N 3.44Å; F835-F837 VanDerWaalsContact C-N 3.29Å; F835-F837 PolarHBondContact O-N 2.84Å; F837-D840 PolarHBondContact O-N 2.66Å; F837-A841 WeakPolarHBondContact O-CB 3.43Å; F837-A841 PolarHBondContact O-N 3.26Å
838	F	95.6	Very high	92.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-42.1	173.8	-179.9	-103	0	0	0	112	I820 I824 V831 F835 I836 D840 A841 V842 F856 I859	I820-F838 HydrophobicContact CG2-CD2 4.43Å; I820-F838 HydrophobicContact CG2-CE2 3.79Å; I824-F838 HydrophobicContact CD1-CD2 3.83Å; I824-F838 HydrophobicContact CD1-CE1 4.44Å; I824-F838 HydrophobicContact CD1-CE2 3.67Å; I824-F838 HydrophobicContact CD1-CG 4.29Å; I824-F838 HydrophobicContact CD1-CZ 3.98Å; V831-F838 HydrophobicContact CG2-CB 4.08Å; F835-F838 HydrophobicContact CD2-CD1 4.42Å; F835-F838 AromaticContact CE2-CD1 3.87Å; F835-F838 HydrophobicContact CE2-CD1 3.87Å; F835-F838 HydrophobicContact CE2-CE1 4.49Å; F835-F838 HydrophobicContact CZ-CD1 4.22Å; F835-F838 PolarHBondContact O-N 3.18Å; I836-F838 VanDerWaalsContact C-N 3.34Å; F838-D840 VanDerWaalsContact C-N 3.33Å; F838-D840 PolarHBondContact O-N 2.97Å; F838-A841 PolarHBondContact O-N 3.19Å; F838-V842 HydrophobicContact CD1-CG2 4.18Å; F838-V842 HydrophobicContact CD2-CG2 4.28Å; F838-V842 HydrophobicContact CE1-CG2 3.67Å; F838-V842 HydrophobicContact CE2-CG2 3.78Å; F838-V842 HydrophobicContact CG-CG2 4.47Å; F838-V842 HydrophobicContact CZ-CG2 3.45Å; F838-V842 VanDerWaalsContact CZ-CG2 3.45Å; F838-V842 WeakPolarHBondContact O-CB 3.36Å; F838-V842 WeakPolarHBondContact O-CG2 3.46Å; F838-V842 PolarHBondContact O-N 3.36Å; F838-F856 HydrophobicContact CZ-CD1 4.31Å; F838-I859 HydrophobicContact CD1-CG2 4.18Å; F838-I859 HydrophobicContact CE1-CB 4.15Å; F838-I859 HydrophobicContact CE1-CD1 4.5Å; F838-I859 HydrophobicContact CE1-CG2 3.49Å; F838-I859 VanDerWaalsContact CE1-CG2 3.49Å; F838-I859 HydrophobicContact CZ-CB 4.48Å; F838-I859 HydrophobicContact CZ-CD1 4.02Å; F838-I859 HydrophobicContact CZ-CG2 4.09Å
839	C	94.5	Very high	92.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.6	-45.3	174.4	-73.2	0	0	0	0	112.3	F835 I836 V842 A843 F879 L887	F835-C839 WeakPolarHBondContact CE1-SG 3.44Å; F835-C839 PolarHBondContact O-N 3.17Å; F835-C839 PolarHBondContact O-SG 3.29Å; I836-C839 WeakPolarHBondContact O-CB 3.36Å; I836-C839 PolarHBondContact O-N 3.07Å; C839-V842 PolarHBondContact O-N 2.97Å; C839-A843 WeakPolarHBondContact O-CB 3.46Å; C839-A843 PolarHBondContact O-N 2.98Å; C839-F879 HydrophobicContact CB-CE2 4.4Å; C839-F879 HydrophobicContact CB-CZ 4Å; C839-L887 HydrophobicContact CB-CD1 3.9Å
840	D	92.6	Very high	92.2	Very high	44 Å²	44	40.6 Å²	40.6	24%	0.235	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-46.1	177.9	-169.5	43.2	0	0	0	111.9	R805 I836 F837 F838 V842 A843 S844 L883	R805-D840 WeakPolarHBondContact CD-OD2 3.26Å; R805-D840 IonicContact CZ-OD2 3.73Å; R805-D840 IonicContact NE-OD2 3.31Å; R805-D840 IonicContact NH1-OD1 3.28Å; R805-D840 IonicContact NH1-OD2 2.64Å; R805-D840 PolarHBondContact NH1-OD2 3.34Å; I836-D840 PolarHBondContact O-N 3.31Å; F837-D840 PolarHBondContact O-N 2.66Å; F838-D840 VanDerWaalsContact C-N 3.33Å; F838-D840 PolarHBondContact O-N 2.97Å; D840-V842 PolarHBondContact O-N 2.97Å; D840-A843 CarbonylContact O-C 3.53Å; D840-A843 WeakPolarHBondContact O-CB 3.34Å; D840-A843 PolarHBondContact O-N 3.41Å; D840-A843 VanDerWaalsContact O-N 3.1Å; D840-S844 PolarHBondContact O-N 3.45Å; D840-L883 HydrophobicContact CB-CD2 4.26Å
841	A	94.9	Very high	92.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-37.6	176.8	0	0	0	0	0	113.1	C801 F817 F837 F838 A843 S844	C801-A841 HydrophobicContact CB-CB 3.94Å; F817-A841 HydrophobicContact CE1-CB 3.98Å; F817-A841 HydrophobicContact CZ-CB 3.9Å; F817-A841 WeakPolarHBondContact CZ-O 3.43Å; F837-A841 WeakPolarHBondContact O-CB 3.43Å; F837-A841 PolarHBondContact O-N 3.26Å; F838-A841 PolarHBondContact O-N 3.19Å; A841-A843 VanDerWaalsContact C-N 3.32Å; A841-S844 PolarHBondContact O-N 3.22Å; A841-S844 PolarHBondContact O-OG 3.4Å
842	V	95.7	Very high	92.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.3	-34.5	173.6	167.5	0	0	0	0	111.4	F838 C839 D840 S844 W845 F856 L860 L887 Y891	F838-V842 HydrophobicContact CD1-CG2 4.18Å; F838-V842 HydrophobicContact CD2-CG2 4.28Å; F838-V842 HydrophobicContact CE1-CG2 3.67Å; F838-V842 HydrophobicContact CE2-CG2 3.78Å; F838-V842 HydrophobicContact CG-CG2 4.47Å; F838-V842 HydrophobicContact CZ-CG2 3.45Å; F838-V842 VanDerWaalsContact CZ-CG2 3.45Å; F838-V842 WeakPolarHBondContact O-CB 3.36Å; F838-V842 WeakPolarHBondContact O-CG2 3.46Å; F838-V842 PolarHBondContact O-N 3.36Å; C839-V842 PolarHBondContact O-N 2.97Å; D840-V842 PolarHBondContact O-N 2.97Å; V842-S844 VanDerWaalsContact C-N 3.28Å; V842-W845 PolarHBondContact O-N 2.68Å; V842-F856 HydrophobicContact CG1-CB 3.92Å; V842-F856 HydrophobicContact CG1-CD1 4.27Å; V842-F856 HydrophobicContact CG1-CD2 3.79Å; V842-F856 HydrophobicContact CG1-CE2 4.29Å; V842-F856 HydrophobicContact CG1-CG 3.75Å; V842-F856 HydrophobicContact CG2-CD1 3.68Å; V842-F856 HydrophobicContact CG2-CE1 3.87Å; V842-F856 HydrophobicContact CG2-CG 4.03Å; V842-F856 HydrophobicContact CG2-CZ 4.33Å; V842-L860 HydrophobicContact CG1-CD1 4.28Å; V842-L887 HydrophobicContact CG1-CD2 4.34Å; V842-Y891 HydrophobicContact CG1-CD2 4.35Å; V842-Y891 HydrophobicContact CG1-CE1 4.47Å; V842-Y891 HydrophobicContact CG1-CE2 3.62Å
843	A	92.4	Very high	92.8	Very high	6 Å²	6	45.6 Å²	45.6	5%	0.05	23%	0.229	C	C	.	.	H	α-helix	trans	-73.7	-19.1	176.9	0	0	0	0	0	112.7	C839 D840 A841 W845 L883 R886 L887	C839-A843 WeakPolarHBondContact O-CB 3.46Å; C839-A843 PolarHBondContact O-N 2.98Å; D840-A843 CarbonylContact O-C 3.53Å; D840-A843 WeakPolarHBondContact O-CB 3.34Å; D840-A843 PolarHBondContact O-N 3.41Å; D840-A843 VanDerWaalsContact O-N 3.1Å; A841-A843 VanDerWaalsContact C-N 3.32Å; A843-W845 PolarHBondContact O-N 2.68Å; A843-L883 HydrophobicContact CB-CD1 3.15Å; A843-R886 WeakPolarHBondContact O-CD 3.49Å; A843-R886 PolarHBondContact O-NH1 3.33Å; A843-L887 HydrophobicContact CB-CD2 4.1Å; A843-L887 HydrophobicContact CB-CG 4.25Å
844	S	92.2	Very high	93.1	Very high	19 Å²	19	43.4 Å²	43.4	13%	0.133	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.5	175.5	79	0	0	0	0	113	R805 K813 D840 A841 V842 V846	R805-S844 WeakPolarHBondContact O-CB 3.42Å; R805-S844 PolarHBondContact O-OG 2.76Å; K813-S844 PolarHBondContact NZ-OG 3.31Å; K813-S844 VanDerWaalsContact NZ-OG 3.15Å; D840-S844 PolarHBondContact O-N 3.45Å; A841-S844 PolarHBondContact O-N 3.22Å; A841-S844 PolarHBondContact O-OG 3.4Å; V842-S844 VanDerWaalsContact C-N 3.28Å; S844-V846 PolarHBondContact O-N 3.1Å
845	W	92.6	Very high	93.3	Very high	9 Å²	9	44.3 Å²	44.3	3%	0.034	22%	0.222	C	C	.	.			trans	-63.7	128.9	175.8	-75	85.6	0	0	0	112.2	D809 K813 D814 F817 V842 A843 P848 L852 F856	D809-W845 HydrophobicContact CB-CE3 4Å; D809-W845 HydrophobicContact CB-CZ3 3.9Å; K813-W845 HydrophobicContact CB-CH2 4.01Å; K813-W845 HydrophobicContact CB-CZ2 3.96Å; K813-W845 HydrophobicContact CD-CD2 4.33Å; K813-W845 HydrophobicContact CD-CH2 4.02Å; K813-W845 HydrophobicContact CD-CZ2 3.69Å; K813-W845 HydrophobicContact CD-CZ3 4.48Å; K813-W845 HydrophobicContact CG-CH2 3.95Å; K813-W845 HydrophobicContact CG-CZ2 3.45Å; K813-W845 VanDerWaalsContact CG-CZ2 3.45Å; D814-W845 HydrophobicContact CB-CH2 3.87Å; F817-W845 HydrophobicContact CB-CZ2 4.18Å; F817-W845 AromaticContact CD1-NE1 3.53Å; F817-W845 AromaticContact CD2-CZ2 3.88Å; F817-W845 HydrophobicContact CD2-CZ2 3.88Å; F817-W845 AromaticContact CD2-NE1 3.59Å; F817-W845 AromaticContact CE1-NE1 3.5Å; F817-W845 HydrophobicContact CE2-CZ2 4.44Å; F817-W845 AromaticContact CE2-NE1 3.55Å; F817-W845 HydrophobicContact CG-CZ2 4.07Å; F817-W845 AromaticContact CG-NE1 3.55Å; F817-W845 AromaticContact CZ-NE1 3.48Å; V842-W845 PolarHBondContact O-N 2.68Å; A843-W845 PolarHBondContact O-N 2.68Å; W845-P848 HydrophobicContact CB-CB 4.29Å; W845-P848 HydrophobicContact CB-CG 4.17Å; W845-P848 HydrophobicContact CD2-CB 4.05Å; W845-P848 HydrophobicContact CE3-CB 3.72Å; W845-P848 HydrophobicContact CG-CB 4.33Å; W845-P848 HydrophobicContact CZ3-CB 4.39Å; W845-L852 HydrophobicContact CH2-CD2 3.87Å; W845-L852 HydrophobicContact CZ2-CD2 3.68Å; W845-L852 HydrophobicContact CZ3-CD2 4.4Å; W845-F856 AromaticContact CD1-CE2 3.89Å; W845-F856 AromaticContact CD1-CZ 3.92Å; W845-F856 HydrophobicContact CD2-CE2 4.45Å; W845-F856 HydrophobicContact CG-CE2 4.1Å; W845-F856 HydrophobicContact CG-CZ 4.48Å; W845-F856 AromaticContact NE1-CZ 3.69Å
846	V	88.5	Confident	93.6	Very high	49 Å²	49	44.1 Å²	44.1	30%	0.297	22%	0.222	S	C	.	.	S	Bend	trans	-91.1	-50.2	174.4	-176.1	0	0	0	0	109.7	D809 S844	D809-V846 PolarHBondContact OD2-N 3.18Å; S844-V846 PolarHBondContact O-N 3.1Å
847	N	87.6	Confident	93.8	Very high	134 Å²	134	47.2 Å²	47.2	72%	0.717	23%	0.231	S	C	*	.	S	Bend	trans	-136.9	67.3	-174.9	-67.6	-49.6	0	0	0	112.3	D809	D809-N847 PolarHBondContact OD2-N 2.82Å
848	P	92	Very high	93.8	Very high	15 Å²	15	50.4 Å²	50.4	10%	0.097	25%	0.245	C	C	.	.			trans	-68	145.4	177.6	29.3	-32.4	0	0	0	111.2	W845 L852 R853 F856	W845-P848 HydrophobicContact CB-CB 4.29Å; W845-P848 HydrophobicContact CB-CG 4.17Å; W845-P848 HydrophobicContact CD2-CB 4.05Å; W845-P848 HydrophobicContact CE3-CB 3.72Å; W845-P848 HydrophobicContact CG-CB 4.33Å; W845-P848 HydrophobicContact CZ3-CB 4.39Å; P848-L852 HydrophobicContact CB-CD2 4.5Å; P848-R853 HydrophobicContact CG-CB 4.31Å; P848-R853 HydrophobicContact CG-CG 4.49Å; P848-F856 HydrophobicContact CB-CE2 4.14Å
849	K	93.1	Very high	93.9	Very high	89 Å²	89	51.7 Å²	51.7	39%	0.387	25%	0.251	S	S	.	.			trans	-57.2	145.6	171.9	-66.7	175	-176.3	166.4	0	110.2	E811 D851 L852 R853	E811-K849 IonicContact OE1-NZ 3.29Å; E811-K849 PolarHBondContact OE1-NZ 3.48Å; E811-K849 IonicContact OE2-NZ 2.82Å; E811-K849 PolarHBondContact OE2-NZ 3.06Å; K849-D851 VanDerWaalsContact CB-OD1 3.31Å; K849-D851 WeakPolarHBondContact CB-OD1 3.19Å; K849-D851 PolarHBondContact O-N 3.2Å; K849-D851 VanDerWaalsContact O-N 3.16Å; K849-L852 PolarHBondContact O-N 2.88Å; K849-L852 VanDerWaalsContact O-N 3.1Å; K849-R853 PolarHBondContact O-N 3.45Å
850	D	93.3	Very high	93.9	Very high	135 Å²	135	51.7 Å²	51.7	72%	0.722	25%	0.251	S	S	*	.	H	α-helix	trans	-56.3	-36.6	-171.8	-77.1	-31.6	0	0	0	113.8	R853 E854	D850-R853 WeakPolarHBondContact O-CB 3.3Å; D850-R853 PolarHBondContact O-N 2.81Å; D850-E854 PolarHBondContact O-N 3.04Å
851	D	94.3	Very high	94	Very high	76 Å²	76	51.2 Å²	51.2	41%	0.406	25%	0.248	S	C	.	.	H	α-helix	trans	-70.7	-41.1	179.2	61.9	-21.7	0	0	0	112.3	R818 K849 E854 M855	R818-D851 IonicContact CZ-OD1 2.74Å; R818-D851 IonicContact CZ-OD2 2.83Å; R818-D851 VanDerWaalsContact CZ-OD2 3.29Å; R818-D851 VanDerWaalsContact NH1-CG 3.34Å; R818-D851 IonicContact NH1-OD1 3.02Å; R818-D851 IonicContact NH1-OD2 3.55Å; R818-D851 PolarHBondContact NH1-OD2 3.06Å; R818-D851 VanDerWaalsContact NH2-CG 3.28Å; R818-D851 IonicContact NH2-OD1 2.86Å; R818-D851 PolarHBondContact NH2-OD1 2.96Å; R818-D851 IonicContact NH2-OD2 2.7Å; R818-D851 PolarHBondContact NH2-OD2 3.35Å; R818-D851 VanDerWaalsContact NH2-OD2 3.1Å; K849-D851 VanDerWaalsContact CB-OD1 3.31Å; K849-D851 WeakPolarHBondContact CB-OD1 3.19Å; K849-D851 PolarHBondContact O-N 3.2Å; K849-D851 VanDerWaalsContact O-N 3.16Å; D851-E854 WeakPolarHBondContact O-CB 3.29Å; D851-E854 PolarHBondContact O-N 3.16Å; D851-M855 WeakPolarHBondContact O-CG 3.44Å; D851-M855 PolarHBondContact O-N 2.99Å
852	L	95.9	Very high	93.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.1	-41.6	171.7	-179.6	59.3	0	0	0	111.1	D814 F817 R818 W845 P848 K849 E854 M855 F856	D814-L852 WeakPolarHBondContact OD1-CD2 3.34Å; F817-L852 HydrophobicContact CB-CD1 4.15Å; F817-L852 HydrophobicContact CB-CD2 4.23Å; R818-L852 HydrophobicContact CG-CD1 4.05Å; W845-L852 HydrophobicContact CH2-CD2 3.87Å; W845-L852 HydrophobicContact CZ2-CD2 3.68Å; W845-L852 HydrophobicContact CZ3-CD2 4.4Å; P848-L852 HydrophobicContact CB-CD2 4.5Å; K849-L852 PolarHBondContact O-N 2.88Å; K849-L852 VanDerWaalsContact O-N 3.1Å; L852-E854 VanDerWaalsContact C-N 3.25Å; L852-E854 PolarHBondContact O-N 2.9Å; L852-M855 HydrophobicContact CD1-SD 4.35Å; L852-M855 WeakPolarHBondContact O-CA 3.2Å; L852-M855 WeakPolarHBondContact O-CB 3.42Å; L852-M855 PolarHBondContact O-N 3.03Å; L852-F856 HydrophobicContact CD1-CD1 4.36Å; L852-F856 HydrophobicContact CD1-CE1 3.68Å; L852-F856 HydrophobicContact CD1-CE2 4.31Å; L852-F856 HydrophobicContact CD1-CZ 3.68Å; L852-F856 HydrophobicContact CD2-CE2 4.06Å; L852-F856 HydrophobicContact CD2-CZ 3.76Å; L852-F856 HydrophobicContact CG-CD2 4.38Å; L852-F856 HydrophobicContact CG-CE1 4.04Å; L852-F856 HydrophobicContact CG-CE2 3.73Å; L852-F856 HydrophobicContact CG-CZ 3.53Å; L852-F856 WeakPolarHBondContact O-CG 3.27Å; L852-F856 PolarHBondContact O-N 3.08Å
853	R	94.3	Very high	93.7	Very high	93 Å²	93	53.8 Å²	53.8	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-57.8	-38.9	174.3	-170	-173.8	175.9	171.2	0.2	111.7	P848 K849 D850 F856 Y857 F890 Y891	P848-R853 HydrophobicContact CG-CB 4.31Å; P848-R853 HydrophobicContact CG-CG 4.49Å; K849-R853 PolarHBondContact O-N 3.45Å; D850-R853 WeakPolarHBondContact O-CB 3.3Å; D850-R853 PolarHBondContact O-N 2.81Å; R853-F856 PolarHBondContact O-N 2.94Å; R853-Y857 WeakPolarHBondContact O-CB 3.44Å; R853-Y857 PolarHBondContact O-N 3.09Å; R853-F890 PolarHBondContact NE-O 2.86Å; R853-F890 PolarHBondContact NH2-O 2.74Å; R853-Y891 HydrophobicContact CG-CD1 4.33Å; R853-Y891 HydrophobicContact CG-CE1 3.67Å
854	E	95.6	Very high	93.6	Very high	105 Å²	105	54.8 Å²	54.8	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-65.7	-37.6	174.9	-163.6	-168.6	154.3	0	0	112.1	D850 D851 L852 Y857 K858	D850-E854 PolarHBondContact O-N 3.04Å; D851-E854 WeakPolarHBondContact O-CB 3.29Å; D851-E854 PolarHBondContact O-N 3.16Å; L852-E854 VanDerWaalsContact C-N 3.25Å; L852-E854 PolarHBondContact O-N 2.9Å; E854-Y857 PolarHBondContact O-N 3.48Å; E854-K858 WeakPolarHBondContact O-CG 3.38Å; E854-K858 PolarHBondContact O-N 3.35Å; E854-K858 WeakPolarHBondContact OE1-CE 3.1Å; E854-K858 IonicContact OE1-NZ 2.76Å; E854-K858 PolarHBondContact OE1-NZ 3.15Å
855	M	97.3	Very high	93.6	Very high	49 Å²	49	59.7 Å²	59.7	24%	0.241	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-46.2	174.2	-62.3	178.6	86.5	0	0	111.3	R818 C821 D851 L852 Y857 K858 I859	R818-M855 HydrophobicContact CG-SD 4.48Å; C821-M855 HydrophobicContact CB-CB 4.01Å; C821-M855 HydrophobicContact CB-CE 3.45Å; C821-M855 VanDerWaalsContact CB-CE 3.45Å; C821-M855 HydrophobicContact CB-SD 4.16Å; D851-M855 WeakPolarHBondContact O-CG 3.44Å; D851-M855 PolarHBondContact O-N 2.99Å; L852-M855 HydrophobicContact CD1-SD 4.35Å; L852-M855 WeakPolarHBondContact O-CA 3.2Å; L852-M855 WeakPolarHBondContact O-CB 3.42Å; L852-M855 PolarHBondContact O-N 3.03Å; M855-Y857 VanDerWaalsContact C-N 3.35Å; M855-Y857 PolarHBondContact O-N 3.41Å; M855-K858 PolarHBondContact O-N 3.39Å; M855-I859 WeakPolarHBondContact O-CG1 3.42Å; M855-I859 PolarHBondContact O-N 3.11Å; M855-I859 VanDerWaalsContact O-N 3.12Å
856	F	97.3	Very high	93.4	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.6	-47.8	174.9	-63.5	-25.2	0	0	0	111.7	F817 F838 V842 W845 P848 L852 R853 K858 I859 L860 Y891	F817-F856 HydrophobicContact CB-CE1 4.21Å; F817-F856 HydrophobicContact CB-CZ 4.08Å; F817-F856 AromaticContact CD1-CE1 3.68Å; F817-F856 HydrophobicContact CD1-CE1 3.68Å; F817-F856 AromaticContact CD1-CZ 3.63Å; F817-F856 HydrophobicContact CD1-CZ 3.63Å; F817-F856 HydrophobicContact CE1-CZ 4.38Å; F817-F856 HydrophobicContact CG-CE1 4.38Å; F817-F856 HydrophobicContact CG-CZ 4.14Å; F838-F856 HydrophobicContact CZ-CD1 4.31Å; V842-F856 HydrophobicContact CG1-CB 3.92Å; V842-F856 HydrophobicContact CG1-CD1 4.27Å; V842-F856 HydrophobicContact CG1-CD2 3.79Å; V842-F856 HydrophobicContact CG1-CE2 4.29Å; V842-F856 HydrophobicContact CG1-CG 3.75Å; V842-F856 HydrophobicContact CG2-CD1 3.68Å; V842-F856 HydrophobicContact CG2-CE1 3.87Å; V842-F856 HydrophobicContact CG2-CG 4.03Å; V842-F856 HydrophobicContact CG2-CZ 4.33Å; W845-F856 AromaticContact CD1-CE2 3.89Å; W845-F856 AromaticContact CD1-CZ 3.92Å; W845-F856 HydrophobicContact CD2-CE2 4.45Å; W845-F856 HydrophobicContact CG-CE2 4.1Å; W845-F856 HydrophobicContact CG-CZ 4.48Å; W845-F856 AromaticContact NE1-CZ 3.69Å; P848-F856 HydrophobicContact CB-CE2 4.14Å; L852-F856 HydrophobicContact CD1-CD1 4.36Å; L852-F856 HydrophobicContact CD1-CE1 3.68Å; L852-F856 HydrophobicContact CD1-CE2 4.31Å; L852-F856 HydrophobicContact CD1-CZ 3.68Å; L852-F856 HydrophobicContact CD2-CE2 4.06Å; L852-F856 HydrophobicContact CD2-CZ 3.76Å; L852-F856 HydrophobicContact CG-CD2 4.38Å; L852-F856 HydrophobicContact CG-CE1 4.04Å; L852-F856 HydrophobicContact CG-CE2 3.73Å; L852-F856 HydrophobicContact CG-CZ 3.53Å; L852-F856 WeakPolarHBondContact O-CG 3.27Å; L852-F856 PolarHBondContact O-N 3.08Å; R853-F856 PolarHBondContact O-N 2.94Å; F856-K858 VanDerWaalsContact C-N 3.34Å; F856-K858 PolarHBondContact O-N 3.19Å; F856-I859 PolarHBondContact O-N 3.22Å; F856-L860 WeakPolarHBondContact O-CB 3.44Å; F856-L860 VanDerWaalsContact O-CG 3.32Å; F856-L860 WeakPolarHBondContact O-CG 3.28Å; F856-L860 PolarHBondContact O-N 3.14Å; F856-Y891 HydrophobicContact CB-CD1 4.14Å; F856-Y891 HydrophobicContact CB-CE1 3.62Å; F856-Y891 AromaticContact CD2-CE1 3.99Å; F856-Y891 HydrophobicContact CD2-CE1 3.99Å; F856-Y891 AromaticContact CD2-CZ 3.92Å; F856-Y891 VanDerWaalsContact CD2-OH 3.31Å; F856-Y891 WeakPolarHBondContact CD2-OH 3.24Å; F856-Y891 HydrophobicContact CG-CE1 4.32Å
857	Y	95.8	Very high	93.4	Very high	116 Å²	116	65.3 Å²	65.3	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-54.9	-48.7	176.6	178.8	-85.9	0	0	0	111.7	R853 E854 M855 I859 L860 H861	R853-Y857 WeakPolarHBondContact O-CB 3.44Å; R853-Y857 PolarHBondContact O-N 3.09Å; E854-Y857 PolarHBondContact O-N 3.48Å; M855-Y857 VanDerWaalsContact C-N 3.35Å; M855-Y857 PolarHBondContact O-N 3.41Å; Y857-I859 VanDerWaalsContact C-N 3.35Å; Y857-I859 PolarHBondContact O-N 3.35Å; Y857-L860 PolarHBondContact O-N 3.15Å; Y857-H861 AromaticContact CD1-CD2 3.96Å; Y857-H861 AromaticContact CD2-CD2 3.48Å; Y857-H861 VanDerWaalsContact CD2-CD2 3.48Å; Y857-H861 WeakPolarHBondContact CD2-CD2 3.29Å; Y857-H861 AromaticContact CD2-NE2 3.58Å; Y857-H861 AromaticContact CE1-CD2 3.74Å; Y857-H861 AromaticContact CE2-CD2 3.27Å; Y857-H861 WeakPolarHBondContact CE2-CD2 3.44Å; Y857-H861 AromaticContact CE2-CE1 3.96Å; Y857-H861 AromaticContact CE2-NE2 3.06Å; Y857-H861 WeakPolarHBondContact CE2-NE2 3.38Å; Y857-H861 AromaticContact CG-CD2 3.82Å; Y857-H861 AromaticContact CZ-CD2 3.39Å; Y857-H861 AromaticContact CZ-CG 3.95Å; Y857-H861 AromaticContact CZ-NE2 3.44Å; Y857-H861 WeakPolarHBondContact O-CB 3.32Å; Y857-H861 PolarHBondContact O-CD2 3.07Å; Y857-H861 VanDerWaalsContact O-CD2 3.29Å; Y857-H861 PolarHBondContact O-N 2.7Å
858	K	95.5	Very high	93.4	Very high	120 Å²	120	60.2 Å²	60.2	52%	0.522	30%	0.302	S	S	.	.	H	α-helix	trans	-60.5	-42.2	-179.6	-75.6	170.9	-176.9	161	0	112.5	E854 M855 F856 G862	E854-K858 WeakPolarHBondContact O-CG 3.38Å; E854-K858 PolarHBondContact O-N 3.35Å; E854-K858 WeakPolarHBondContact OE1-CE 3.1Å; E854-K858 IonicContact OE1-NZ 2.76Å; E854-K858 PolarHBondContact OE1-NZ 3.15Å; M855-K858 PolarHBondContact O-N 3.39Å; F856-K858 VanDerWaalsContact C-N 3.34Å; F856-K858 PolarHBondContact O-N 3.19Å; K858-G862 WeakPolarHBondContact O-CA 3.35Å; K858-G862 PolarHBondContact O-N 3.3Å
859	I	96	Very high	93.3	Very high	26 Å²	26	64.1 Å²	64.1	13%	0.133	32%	0.319	C	S	.	.	H	α-helix	trans	-70.2	-47.9	-179.1	-66.1	168.6	0	0	0	110.9	C821 I824 F835 F838 M855 F856 Y857 G862 F863	C821-I859 HydrophobicContact CB-CD1 3.67Å; I824-I859 HydrophobicContact CB-CD1 4.17Å; I824-I859 HydrophobicContact CD1-CD1 4.21Å; I824-I859 HydrophobicContact CG2-CD1 4.07Å; I824-I859 HydrophobicContact CG2-CG1 4.14Å; I824-I859 HydrophobicContact CG2-CG2 3.95Å; F835-I859 HydrophobicContact CE2-CG2 3.9Å; F835-I859 HydrophobicContact CZ-CG2 4.27Å; F838-I859 HydrophobicContact CD1-CG2 4.18Å; F838-I859 HydrophobicContact CE1-CB 4.15Å; F838-I859 HydrophobicContact CE1-CD1 4.5Å; F838-I859 HydrophobicContact CE1-CG2 3.49Å; F838-I859 VanDerWaalsContact CE1-CG2 3.49Å; F838-I859 HydrophobicContact CZ-CB 4.48Å; F838-I859 HydrophobicContact CZ-CD1 4.02Å; F838-I859 HydrophobicContact CZ-CG2 4.09Å; M855-I859 WeakPolarHBondContact O-CG1 3.42Å; M855-I859 PolarHBondContact O-N 3.11Å; M855-I859 VanDerWaalsContact O-N 3.12Å; F856-I859 PolarHBondContact O-N 3.22Å; Y857-I859 VanDerWaalsContact C-N 3.35Å; Y857-I859 PolarHBondContact O-N 3.35Å; I859-G862 PolarHBondContact O-N 3.05Å; I859-F863 PolarHBondContact O-N 2.98Å
860	L	95.3	Very high	93.1	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-48.6	-179.9	-70	169.8	0	0	0	111.8	F835 V842 F856 Y857 F863 K864 L887 Y891 V893	F835-L860 HydrophobicContact CE1-CD2 4.23Å; F835-L860 HydrophobicContact CZ-CD2 4.09Å; V842-L860 HydrophobicContact CG1-CD1 4.28Å; F856-L860 WeakPolarHBondContact O-CB 3.44Å; F856-L860 VanDerWaalsContact O-CG 3.32Å; F856-L860 WeakPolarHBondContact O-CG 3.28Å; F856-L860 PolarHBondContact O-N 3.14Å; Y857-L860 PolarHBondContact O-N 3.15Å; L860-F863 PolarHBondContact O-N 2.85Å; L860-K864 WeakPolarHBondContact O-CB 3.43Å; L860-K864 PolarHBondContact O-N 3.45Å; L860-L887 HydrophobicContact CD1-CD2 4.19Å; L860-Y891 HydrophobicContact CD1-CD1 4.24Å; L860-Y891 HydrophobicContact CD1-CD2 3.82Å; L860-Y891 HydrophobicContact CD1-CG 3.66Å; L860-V893 HydrophobicContact CB-CG1 4.07Å; L860-V893 HydrophobicContact CB-CG2 4.15Å; L860-V893 HydrophobicContact CD1-CG2 4.13Å
861	H	94.4	Very high	92.9	Very high	35 Å²	35	63.1 Å²	63.1	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-68.4	-34.6	176.3	-79.5	-87.1	0	0	0	112.4	Y857 K864 N865 Y891 V893	Y857-H861 AromaticContact CD1-CD2 3.96Å; Y857-H861 AromaticContact CD2-CD2 3.48Å; Y857-H861 VanDerWaalsContact CD2-CD2 3.48Å; Y857-H861 WeakPolarHBondContact CD2-CD2 3.29Å; Y857-H861 AromaticContact CD2-NE2 3.58Å; Y857-H861 AromaticContact CE1-CD2 3.74Å; Y857-H861 AromaticContact CE2-CD2 3.27Å; Y857-H861 WeakPolarHBondContact CE2-CD2 3.44Å; Y857-H861 AromaticContact CE2-CE1 3.96Å; Y857-H861 AromaticContact CE2-NE2 3.06Å; Y857-H861 WeakPolarHBondContact CE2-NE2 3.38Å; Y857-H861 AromaticContact CG-CD2 3.82Å; Y857-H861 AromaticContact CZ-CD2 3.39Å; Y857-H861 AromaticContact CZ-CG 3.95Å; Y857-H861 AromaticContact CZ-NE2 3.44Å; Y857-H861 WeakPolarHBondContact O-CB 3.32Å; Y857-H861 PolarHBondContact O-CD2 3.07Å; Y857-H861 VanDerWaalsContact O-CD2 3.29Å; Y857-H861 PolarHBondContact O-N 2.7Å; H861-K864 PolarHBondContact O-N 3.35Å; H861-N865 WeakPolarHBondContact O-CB 3.36Å; H861-N865 PolarHBondContact O-N 3Å; H861-N865 PolarHBondContact O-ND2 2.92Å; H861-Y891 PolarHBondContact NE2-O 3.41Å; H861-V893 VanDerWaalsContact NE2-CG1 3.32Å; H861-V893 WeakPolarHBondContact NE2-CG1 3.34Å
862	G	92.7	Very high	92.7	Very high	35 Å²	35	59.7 Å²	59.7	36%	0.361	30%	0.299	S	S	.	.	H	α-helix	trans	-58.3	-48.9	174	0	0	0	0	0	112	K858 I859 N865 Q866	K858-G862 WeakPolarHBondContact O-CA 3.35Å; K858-G862 PolarHBondContact O-N 3.3Å; I859-G862 PolarHBondContact O-N 3.05Å; G862-N865 PolarHBondContact O-N 2.8Å; G862-Q866 WeakPolarHBondContact O-CB 3.41Å; G862-Q866 PolarHBondContact O-N 3.34Å
863	F	91.4	Very high	92.4	Very high	18 Å²	18	66.8 Å²	66.8	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-64.5	-47	177.3	-173.3	-91.8	0	0	0	112	V832 F835 I859 L860 N865 Q866 V867 W872 F875	V832-F863 HydrophobicContact CB-CE2 4.48Å; V832-F863 HydrophobicContact CG1-CE2 4.15Å; V832-F863 HydrophobicContact CG2-CE2 4.47Å; F835-F863 HydrophobicContact CB-CD2 4.32Å; F835-F863 HydrophobicContact CB-CE1 4.44Å; F835-F863 HydrophobicContact CB-CE2 3.79Å; F835-F863 HydrophobicContact CB-CZ 3.85Å; F835-F863 HydrophobicContact CD1-CB 4.3Å; F835-F863 AromaticContact CD1-CD1 3.43Å; F835-F863 HydrophobicContact CD1-CD1 3.43Å; F835-F863 VanDerWaalsContact CD1-CD1 3.43Å; F835-F863 AromaticContact CD1-CD2 3.87Å; F835-F863 HydrophobicContact CD1-CD2 3.87Å; F835-F863 AromaticContact CD1-CE1 3.53Å; F835-F863 HydrophobicContact CD1-CE1 3.53Å; F835-F863 AromaticContact CD1-CE2 3.97Å; F835-F863 HydrophobicContact CD1-CE2 3.97Å; F835-F863 AromaticContact CD1-CG 3.59Å; F835-F863 HydrophobicContact CD1-CG 3.59Å; F835-F863 AromaticContact CD1-CZ 3.8Å; F835-F863 HydrophobicContact CD1-CZ 3.8Å; F835-F863 HydrophobicContact CD2-CB 4.43Å; F835-F863 AromaticContact CD2-CD2 3.68Å; F835-F863 HydrophobicContact CD2-CD2 3.68Å; F835-F863 HydrophobicContact CD2-CE2 4.02Å; F835-F863 HydrophobicContact CD2-CG 4.02Å; F835-F863 HydrophobicContact CE1-CB 3.63Å; F835-F863 AromaticContact CE1-CD1 3.4Å; F835-F863 HydrophobicContact CE1-CD1 3.4Å; F835-F863 HydrophobicContact CE1-CD2 4.07Å; F835-F863 HydrophobicContact CE1-CE1 4.01Å; F835-F863 AromaticContact CE1-CG 3.42Å; F835-F863 HydrophobicContact CE1-CG 3.42Å; F835-F863 VanDerWaalsContact CE1-CG 3.42Å; F835-F863 HydrophobicContact CE2-CB 3.8Å; F835-F863 AromaticContact CE2-CD2 3.9Å; F835-F863 HydrophobicContact CE2-CD2 3.9Å; F835-F863 AromaticContact CE2-CG 3.88Å; F835-F863 HydrophobicContact CE2-CG 3.88Å; F835-F863 HydrophobicContact CG-CD1 4.11Å; F835-F863 AromaticContact CG-CD2 3.68Å; F835-F863 HydrophobicContact CG-CD2 3.68Å; F835-F863 HydrophobicContact CG-CE1 4.08Å; F835-F863 AromaticContact CG-CE2 3.64Å; F835-F863 HydrophobicContact CG-CE2 3.64Å; F835-F863 AromaticContact CG-CG 3.9Å; F835-F863 HydrophobicContact CG-CG 3.9Å; F835-F863 AromaticContact CG-CZ 3.84Å; F835-F863 HydrophobicContact CG-CZ 3.84Å; F835-F863 HydrophobicContact CZ-CB 3.35Å; F835-F863 HydrophobicContact CZ-CD1 4.06Å; F835-F863 HydrophobicContact CZ-CD2 4.09Å; F835-F863 AromaticContact CZ-CG 3.58Å; F835-F863 HydrophobicContact CZ-CG 3.58Å; I859-F863 PolarHBondContact O-N 2.98Å; L860-F863 PolarHBondContact O-N 2.85Å; F863-N865 VanDerWaalsContact C-N 3.28Å; F863-N865 PolarHBondContact O-N 3.4Å; F863-Q866 WeakPolarHBondContact O-CB 3.12Å; F863-Q866 PolarHBondContact O-N 3.12Å; F863-V867 HydrophobicContact CD1-CG1 4.19Å; F863-V867 HydrophobicContact CD1-CG2 4.31Å; F863-V867 HydrophobicContact CE1-CG1 3.73Å; F863-V867 HydrophobicContact CE1-CG2 4.19Å; F863-V867 HydrophobicContact CE2-CG1 4.23Å; F863-V867 HydrophobicContact CZ-CG1 3.76Å; F863-V867 WeakPolarHBondContact O-CG2 3.28Å; F863-V867 PolarHBondContact O-N 3.07Å; F863-W872 AromaticContact CD1-CE3 3.89Å; F863-W872 HydrophobicContact CD1-CE3 3.89Å; F863-W872 AromaticContact CD1-CZ3 3.72Å; F863-W872 HydrophobicContact CD1-CZ3 3.72Å; F863-W872 HydrophobicContact CE1-CE3 4.2Å; F863-W872 HydrophobicContact CE1-CZ3 4.13Å; F863-F875 HydrophobicContact CE1-CD1 4.33Å; F863-F875 HydrophobicContact CE1-CE1 4.25Å
864	K	91.6	Very high	92.1	Very high	27 Å²	27	70.8 Å²	70.8	12%	0.117	34%	0.341	C	S	.	.	H	α-helix	trans	-54.1	-44.5	176.1	177.6	173	178.4	177.8	0	112.1	L860 H861 G868 E869 W872 V893	L860-K864 WeakPolarHBondContact O-CB 3.43Å; L860-K864 PolarHBondContact O-N 3.45Å; H861-K864 PolarHBondContact O-N 3.35Å; K864-G868 WeakPolarHBondContact O-CA 3.45Å; K864-G868 PolarHBondContact O-N 3.49Å; K864-E869 VanDerWaalsContact CE-CD 3.43Å; K864-E869 WeakPolarHBondContact CE-OE1 3.46Å; K864-E869 WeakPolarHBondContact CE-OE2 3.01Å; K864-E869 IonicContact NZ-OE1 3.88Å; K864-E869 PolarHBondContact NZ-OE1 3.25Å; K864-E869 IonicContact NZ-OE2 3.17Å; K864-W872 HydrophobicContact CB-CD2 4.03Å; K864-W872 HydrophobicContact CB-CE3 4.23Å; K864-W872 HydrophobicContact CB-CG 4.21Å; K864-W872 HydrophobicContact CD-CD2 4.33Å; K864-W872 HydrophobicContact CD-CG 4.05Å; K864-W872 HydrophobicContact CG-CB 4.06Å; K864-W872 HydrophobicContact CG-CD2 4.02Å; K864-W872 HydrophobicContact CG-CG 3.69Å; K864-V893 HydrophobicContact CD-CG1 4.26Å
865	N	91.9	Very high	91.8	Very high	122 Å²	122	67.7 Å²	67.7	65%	0.652	33%	0.326	S	S	*	.	H	α-helix	trans	-66.9	-35.6	177.1	-71.6	-30.8	0	0	0	112.6	H861 G862 F863	H861-N865 WeakPolarHBondContact O-CB 3.36Å; H861-N865 PolarHBondContact O-N 3Å; H861-N865 PolarHBondContact O-ND2 2.92Å; G862-N865 PolarHBondContact O-N 2.8Å; F863-N865 VanDerWaalsContact C-N 3.28Å; F863-N865 PolarHBondContact O-N 3.4Å
866	Q	88.9	Confident	91.3	Very high	135 Å²	135	65.9 Å²	65.9	63%	0.631	32%	0.318	S	S	*	.	H	α-helix	trans	-70.3	-41.5	-179.9	-175	176.6	0.4	0	0	112.7	G862 F863	G862-Q866 WeakPolarHBondContact O-CB 3.41Å; G862-Q866 PolarHBondContact O-N 3.34Å; F863-Q866 WeakPolarHBondContact O-CB 3.12Å; F863-Q866 PolarHBondContact O-N 3.12Å
867	V	87	Confident	90.9	Very high	41 Å²	41	71.1 Å²	71.1	25%	0.248	35%	0.346	C	S	.	.	H	α-helix	trans	-83.6	-23.4	179.7	-57.6	0	0	0	0	112.8	F863 N871 W872	F863-V867 HydrophobicContact CD1-CG1 4.19Å; F863-V867 HydrophobicContact CD1-CG2 4.31Å; F863-V867 HydrophobicContact CE1-CG1 3.73Å; F863-V867 HydrophobicContact CE1-CG2 4.19Å; F863-V867 HydrophobicContact CE2-CG1 4.23Å; F863-V867 HydrophobicContact CZ-CG1 3.76Å; F863-V867 WeakPolarHBondContact O-CG2 3.28Å; F863-V867 PolarHBondContact O-N 3.07Å; V867-N871 HydrophobicContact CB-CB 4.13Å; V867-N871 HydrophobicContact CG2-CB 4.37Å; V867-N871 WeakPolarHBondContact O-CB 3.28Å; V867-N871 PolarHBondContact O-ND2 3.01Å; V867-W872 HydrophobicContact CG2-CB 3.93Å
868	G	88.6	Confident	90.5	Very high	28 Å²	28	71.9 Å²	71.9	29%	0.289	35%	0.354	S	S	.	.			trans	83.6	154	-176.1	0	0	0	0	0	113.3	K864 D870 N871 W872	K864-G868 WeakPolarHBondContact O-CA 3.45Å; K864-G868 PolarHBondContact O-N 3.49Å; G868-D870 PolarHBondContact O-N 3.11Å; G868-N871 PolarHBondContact O-N 3.36Å; G868-W872 WeakPolarHBondContact O-CB 3.41Å; G868-W872 PolarHBondContact O-N 3.09Å
869	E	88.9	Confident	90.1	Very high	97 Å²	97	67 Å²	67	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-52.1	-44.2	-172.9	-78.6	-73.1	166.3	0	0	114.3	K864 W872 R873	K864-E869 VanDerWaalsContact CE-CD 3.43Å; K864-E869 WeakPolarHBondContact CE-OE1 3.46Å; K864-E869 WeakPolarHBondContact CE-OE2 3.01Å; K864-E869 IonicContact NZ-OE1 3.88Å; K864-E869 PolarHBondContact NZ-OE1 3.25Å; K864-E869 IonicContact NZ-OE2 3.17Å; E869-W872 PolarHBondContact O-N 3.31Å; E869-R873 WeakPolarHBondContact O-CG 3.43Å; E869-R873 PolarHBondContact O-N 3.05Å
870	D	89	Confident	89.7	Confident	117 Å²	117	69.7 Å²	69.7	63%	0.626	35%	0.352	S	S	*	.	H	α-helix	trans	-69.4	-38.1	-177.4	-69.8	-32.1	0	0	0	112.7	G868 R874	G868-D870 PolarHBondContact O-N 3.11Å; D870-R874 WeakPolarHBondContact O-CG 3.36Å; D870-R874 PolarHBondContact O-N 2.89Å
871	N	88.8	Confident	89.3	Confident	86 Å²	86	75.1 Å²	75.1	46%	0.46	38%	0.38	S	S	.	.	H	α-helix	trans	-76.1	-36.2	177	-67.4	-36.7	0	0	0	111.2	V867 G868 R873 R874 F875	V867-N871 HydrophobicContact CB-CB 4.13Å; V867-N871 HydrophobicContact CG2-CB 4.37Å; V867-N871 WeakPolarHBondContact O-CB 3.28Å; V867-N871 PolarHBondContact O-ND2 3.01Å; G868-N871 PolarHBondContact O-N 3.36Å; N871-R873 VanDerWaalsContact C-N 3.34Å; N871-R873 PolarHBondContact O-N 3.22Å; N871-R874 PolarHBondContact O-N 2.87Å; N871-F875 WeakPolarHBondContact O-CB 3.49Å; N871-F875 PolarHBondContact O-N 2.81Å
872	W	90.4	Very high	88.9	Confident	4 Å²	4	77.9 Å²	77.9	2%	0.015	40%	0.401	C	S	.	.	H	α-helix	trans	-59.3	-44.7	172.4	174.7	-106.5	0	0	0	111.3	F835 F863 K864 V867 G868 E869 F875 S876 F879 V893	F835-W872 HydrophobicContact CD1-CZ3 4.47Å; F835-W872 HydrophobicContact CE1-CH2 4.45Å; F835-W872 HydrophobicContact CE1-CZ3 4.03Å; F863-W872 AromaticContact CD1-CE3 3.89Å; F863-W872 HydrophobicContact CD1-CE3 3.89Å; F863-W872 AromaticContact CD1-CZ3 3.72Å; F863-W872 HydrophobicContact CD1-CZ3 3.72Å; F863-W872 HydrophobicContact CE1-CE3 4.2Å; F863-W872 HydrophobicContact CE1-CZ3 4.13Å; K864-W872 HydrophobicContact CB-CD2 4.03Å; K864-W872 HydrophobicContact CB-CE3 4.23Å; K864-W872 HydrophobicContact CB-CG 4.21Å; K864-W872 HydrophobicContact CD-CD2 4.33Å; K864-W872 HydrophobicContact CD-CG 4.05Å; K864-W872 HydrophobicContact CG-CB 4.06Å; K864-W872 HydrophobicContact CG-CD2 4.02Å; K864-W872 HydrophobicContact CG-CG 3.69Å; V867-W872 HydrophobicContact CG2-CB 3.93Å; G868-W872 WeakPolarHBondContact O-CB 3.41Å; G868-W872 PolarHBondContact O-N 3.09Å; E869-W872 PolarHBondContact O-N 3.31Å; W872-F875 AromaticContact CE3-CD1 4Å; W872-F875 HydrophobicContact CE3-CD1 4Å; W872-F875 AromaticContact CZ3-CD1 3.78Å; W872-F875 HydrophobicContact CZ3-CD1 3.78Å; W872-F875 HydrophobicContact CZ3-CE1 4.01Å; W872-F875 WeakPolarHBondContact O-CB 3.29Å; W872-F875 PolarHBondContact O-N 3.23Å; W872-S876 WeakPolarHBondContact O-CB 3.35Å; W872-S876 PolarHBondContact O-N 3.31Å; W872-S876 PolarHBondContact O-OG 3Å; W872-F879 HydrophobicContact CH2-CE2 4.48Å; W872-V893 HydrophobicContact CZ2-CB 3.71Å; W872-V893 HydrophobicContact CZ2-CG2 3.97Å; W872-V893 PolarHBondContact NE1-OXT 3.01Å
873	R	89.4	Confident	88.7	Confident	148 Å²	148	76.9 Å²	76.9	56%	0.558	39%	0.387	S	S	*	.	H	α-helix	trans	-59.2	-47.9	175	-75.7	175.3	-175.5	-171.8	-0.4	112.2	E869 N871 F875 S876 D877	E869-R873 WeakPolarHBondContact O-CG 3.43Å; E869-R873 PolarHBondContact O-N 3.05Å; N871-R873 VanDerWaalsContact C-N 3.34Å; N871-R873 PolarHBondContact O-N 3.22Å; R873-F875 PolarHBondContact O-N 3.28Å; R873-S876 PolarHBondContact O-N 2.99Å; R873-S876 PolarHBondContact O-OG 3.05Å; R873-D877 WeakPolarHBondContact O-CB 3.32Å; R873-D877 PolarHBondContact O-N 3.25Å
874	R	88.6	Confident	88.6	Confident	178 Å²	178	79.5 Å²	79.5	67%	0.672	40%	0.399	S	S	*	.	H	α-helix	trans	-61.2	-31.3	176.8	-71.9	175.2	-178.9	175.7	1.3	113.3	D870 N871 Q878	D870-R874 WeakPolarHBondContact O-CG 3.36Å; D870-R874 PolarHBondContact O-N 2.89Å; N871-R874 PolarHBondContact O-N 2.87Å; R874-Q878 PolarHBondContact O-NE2 3.45Å
875	F	88	Confident	88.4	Confident	40 Å²	40	83.6 Å²	83.6	18%	0.175	42%	0.418	C	S	.	.	H	α-helix	trans	-76.1	-50.5	176.7	178.5	-104.6	0	0	0	111.4	F835 I836 F863 N871 W872 R873 D877 Q878 F879	F835-F875 HydrophobicContact CB-CZ 4.25Å; F835-F875 AromaticContact CD1-CE1 3.92Å; F835-F875 HydrophobicContact CD1-CE1 3.92Å; F835-F875 HydrophobicContact CD1-CZ 4.17Å; I836-F875 HydrophobicContact CB-CE2 4.18Å; I836-F875 HydrophobicContact CB-CZ 3.78Å; F863-F875 HydrophobicContact CE1-CD1 4.33Å; F863-F875 HydrophobicContact CE1-CE1 4.25Å; N871-F875 WeakPolarHBondContact O-CB 3.49Å; N871-F875 PolarHBondContact O-N 2.81Å; W872-F875 AromaticContact CE3-CD1 4Å; W872-F875 HydrophobicContact CE3-CD1 4Å; W872-F875 AromaticContact CZ3-CD1 3.78Å; W872-F875 HydrophobicContact CZ3-CD1 3.78Å; W872-F875 HydrophobicContact CZ3-CE1 4.01Å; W872-F875 WeakPolarHBondContact O-CB 3.29Å; W872-F875 PolarHBondContact O-N 3.23Å; R873-F875 PolarHBondContact O-N 3.28Å; F875-D877 VanDerWaalsContact C-N 3.26Å; F875-D877 PolarHBondContact O-N 3.41Å; F875-Q878 VanDerWaalsContact O-CB 3.32Å; F875-Q878 WeakPolarHBondContact O-CB 3.24Å; F875-Q878 PolarHBondContact O-N 3.1Å; F875-Q878 VanDerWaalsContact O-N 3.07Å; F875-F879 HydrophobicContact CD1-CE1 4.03Å; F875-F879 AromaticContact CD1-CZ 3.86Å; F875-F879 HydrophobicContact CD1-CZ 3.86Å; F875-F879 AromaticContact CE1-CE1 3.67Å; F875-F879 HydrophobicContact CE1-CE1 3.67Å; F875-F879 AromaticContact CE1-CZ 3.5Å; F875-F879 HydrophobicContact CE1-CZ 3.5Å; F875-F879 HydrophobicContact CZ-CE1 4.1Å; F875-F879 HydrophobicContact CZ-CZ 4.32Å
876	S	88.3	Confident	88.2	Confident	10 Å²	10	82.6 Å²	82.6	7%	0.07	41%	0.406	C	S	.	.	H	α-helix	trans	-71.7	-16.3	-179.2	63.5	0	0	0	0	114	W872 R873 Q878 F879	W872-S876 WeakPolarHBondContact O-CB 3.35Å; W872-S876 PolarHBondContact O-N 3.31Å; W872-S876 PolarHBondContact O-OG 3Å; R873-S876 PolarHBondContact O-N 2.99Å; R873-S876 PolarHBondContact O-OG 3.05Å; S876-Q878 PolarHBondContact O-N 3.1Å; S876-F879 WeakPolarHBondContact O-CB 3.36Å; S876-F879 PolarHBondContact O-N 3.3Å
877	D	87.9	Confident	88.3	Confident	110 Å²	110	76.3 Å²	76.3	59%	0.588	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-13.9	168.7	-75.3	-18.3	0	0	0	113.3	R873 F875 F879 K884	R873-D877 WeakPolarHBondContact O-CB 3.32Å; R873-D877 PolarHBondContact O-N 3.25Å; F875-D877 VanDerWaalsContact C-N 3.26Å; F875-D877 PolarHBondContact O-N 3.41Å; D877-F879 VanDerWaalsContact C-N 3.33Å; D877-K884 IonicContact OD1-NZ 2.83Å; D877-K884 PolarHBondContact OD1-NZ 3.44Å
878	Q	87.6	Confident	88.4	Confident	132 Å²	132	76.8 Å²	76.8	62%	0.617	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-10	174	-58.6	170.3	41	0	0	112.5	R874 F875 S876	R874-Q878 PolarHBondContact O-NE2 3.45Å; F875-Q878 VanDerWaalsContact O-CB 3.32Å; F875-Q878 WeakPolarHBondContact O-CB 3.24Å; F875-Q878 PolarHBondContact O-N 3.1Å; F875-Q878 VanDerWaalsContact O-N 3.07Å; S876-Q878 PolarHBondContact O-N 3.1Å
879	F	88.3	Confident	88.4	Confident	18 Å²	18	80.6 Å²	80.6	8%	0.079	40%	0.402	C	S	.	.	S	Bend	trans	-74.5	141.5	-177	-64.3	-6.6	0	0	0	111.3	I836 C839 W872 F875 S876 D877 L883 K884 L887	I836-F879 HydrophobicContact CB-CE1 4.47Å; I836-F879 HydrophobicContact CD1-CD1 3.99Å; I836-F879 HydrophobicContact CD1-CE1 3.97Å; I836-F879 HydrophobicContact CG1-CD1 4.14Å; I836-F879 HydrophobicContact CG1-CE1 3.79Å; C839-F879 HydrophobicContact CB-CE2 4.4Å; C839-F879 HydrophobicContact CB-CZ 4Å; W872-F879 HydrophobicContact CH2-CE2 4.48Å; F875-F879 HydrophobicContact CD1-CE1 4.03Å; F875-F879 AromaticContact CD1-CZ 3.86Å; F875-F879 HydrophobicContact CD1-CZ 3.86Å; F875-F879 AromaticContact CE1-CE1 3.67Å; F875-F879 HydrophobicContact CE1-CE1 3.67Å; F875-F879 AromaticContact CE1-CZ 3.5Å; F875-F879 HydrophobicContact CE1-CZ 3.5Å; F875-F879 HydrophobicContact CZ-CE1 4.1Å; F875-F879 HydrophobicContact CZ-CZ 4.32Å; S876-F879 WeakPolarHBondContact O-CB 3.36Å; S876-F879 PolarHBondContact O-N 3.3Å; D877-F879 VanDerWaalsContact C-N 3.33Å; F879-L883 HydrophobicContact CB-CB 4.4Å; F879-L883 HydrophobicContact CB-CD2 4.02Å; F879-L883 HydrophobicContact CB-CG 4.18Å; F879-L883 HydrophobicContact CD1-CD2 4.16Å; F879-L883 HydrophobicContact CD2-CD2 4.25Å; F879-L883 HydrophobicContact CD2-CG 4.17Å; F879-L883 HydrophobicContact CG-CD2 3.89Å; F879-L883 HydrophobicContact CG-CG 4.2Å; F879-K884 HydrophobicContact CB-CB 4.19Å; F879-L887 HydrophobicContact CD2-CD1 4.11Å; F879-L887 HydrophobicContact CE2-CD1 3.71Å
880	P	87.1	Confident	88.2	Confident	82 Å²	82	79.2 Å²	79.2	53%	0.532	40%	0.395	S	S	.	.			trans	-53.7	146	163.1	-24.2	34.6	0	0	0	110.8	P882 L883 K884	P880-P882 VanDerWaalsContact C-CD 3.47Å; P880-P882 VanDerWaalsContact C-N 3.35Å; P880-L883 HydrophobicContact CB-CB 4.46Å; P880-L883 WeakPolarHBondContact O-CB 3.38Å; P880-L883 PolarHBondContact O-N 3.16Å; P880-L883 VanDerWaalsContact O-N 3.08Å; P880-K884 PolarHBondContact O-N 3.34Å
881	L	87	Confident	88.3	Confident	115 Å²	115	74 Å²	74	60%	0.602	37%	0.367	S	S	*	.	H	α-helix	trans	-53.4	-44.8	-177.5	-175	67.1	0	0	0	113.1	L883 K884 E885	L881-L883 VanDerWaalsContact C-N 3.33Å; L881-L883 PolarHBondContact O-N 3.33Å; L881-K884 PolarHBondContact O-N 2.86Å; L881-E885 HydrophobicContact CD1-CG 4.21Å; L881-E885 HydrophobicContact CG-CG 4.39Å; L881-E885 WeakPolarHBondContact O-CG 3.38Å; L881-E885 PolarHBondContact O-N 2.99Å
882	P	85.4	Confident	88.3	Confident	93 Å²	93	72.2 Å²	72.2	60%	0.604	37%	0.369	S	S	*	.	H	α-helix	trans	-60.8	-40.4	178.1	-23.7	35	0	0	0	113.2	P880 R886	P880-P882 VanDerWaalsContact C-CD 3.47Å; P880-P882 VanDerWaalsContact C-N 3.35Å; P882-R886 VanDerWaalsContact O-CB 3.29Å; P882-R886 WeakPolarHBondContact O-CB 3.44Å; P882-R886 PolarHBondContact O-N 3.46Å
883	L	87.6	Confident	88	Confident	13 Å²	13	73.4 Å²	73.4	7%	0.068	38%	0.376	C	S	.	.	H	α-helix	trans	-62.5	-47.9	177.5	174.9	57.8	0	0	0	110.9	D840 A843 F879 P880 L881 E885 R886 L887	D840-L883 HydrophobicContact CB-CD2 4.26Å; A843-L883 HydrophobicContact CB-CD1 3.15Å; F879-L883 HydrophobicContact CB-CB 4.4Å; F879-L883 HydrophobicContact CB-CD2 4.02Å; F879-L883 HydrophobicContact CB-CG 4.18Å; F879-L883 HydrophobicContact CD1-CD2 4.16Å; F879-L883 HydrophobicContact CD2-CD2 4.25Å; F879-L883 HydrophobicContact CD2-CG 4.17Å; F879-L883 HydrophobicContact CG-CD2 3.89Å; F879-L883 HydrophobicContact CG-CG 4.2Å; P880-L883 HydrophobicContact CB-CB 4.46Å; P880-L883 WeakPolarHBondContact O-CB 3.38Å; P880-L883 PolarHBondContact O-N 3.16Å; P880-L883 VanDerWaalsContact O-N 3.08Å; L881-L883 VanDerWaalsContact C-N 3.33Å; L881-L883 PolarHBondContact O-N 3.33Å; L883-E885 PolarHBondContact O-N 3.09Å; L883-R886 PolarHBondContact O-N 3.22Å; L883-L887 HydrophobicContact CD1-CD1 3.76Å; L883-L887 HydrophobicContact CD1-CG 4.03Å; L883-L887 HydrophobicContact CG-CD1 4.12Å; L883-L887 WeakPolarHBondContact O-CG 3.32Å; L883-L887 PolarHBondContact O-N 2.92Å
884	K	89.1	Confident	88	Confident	73 Å²	73	69.7 Å²	69.7	32%	0.317	37%	0.367	S	S	.	.	H	α-helix	trans	-61.6	-45.8	180	-169.7	171.7	-171.7	162.2	0	112	D877 F879 P880 L881 A888	D877-K884 IonicContact OD1-NZ 2.83Å; D877-K884 PolarHBondContact OD1-NZ 3.44Å; F879-K884 HydrophobicContact CB-CB 4.19Å; P880-K884 PolarHBondContact O-N 3.34Å; L881-K884 PolarHBondContact O-N 2.86Å; K884-A888 WeakPolarHBondContact O-CB 3.27Å; K884-A888 PolarHBondContact O-N 3.11Å
885	E	88.7	Confident	87.9	Confident	113 Å²	113	64 Å²	64	53%	0.528	35%	0.351	S	S	.	.	H	α-helix	trans	-65.4	-42	179.3	-72.6	-178.9	166.4	0	0	112	L881 L883 A888 T889	L881-E885 HydrophobicContact CD1-CG 4.21Å; L881-E885 HydrophobicContact CG-CG 4.39Å; L881-E885 WeakPolarHBondContact O-CG 3.38Å; L881-E885 PolarHBondContact O-N 2.99Å; L883-E885 PolarHBondContact O-N 3.09Å; E885-A888 PolarHBondContact O-N 2.93Å; E885-T889 VanDerWaalsContact O-CB 3.28Å; E885-T889 WeakPolarHBondContact O-CB 3.31Å; E885-T889 PolarHBondContact O-N 3.43Å; E885-T889 PolarHBondContact O-OG1 3.15Å
886	R	87.8	Confident	87.9	Confident	102 Å²	102	65.3 Å²	65.3	39%	0.385	36%	0.361	S	S	.	.	H	α-helix	trans	-65.7	-46.1	179.7	-163.9	177.6	-79.8	-166.9	-3.5	111.2	A843 P882 L883 A888 T889 F890	A843-R886 WeakPolarHBondContact O-CD 3.49Å; A843-R886 PolarHBondContact O-NH1 3.33Å; P882-R886 VanDerWaalsContact O-CB 3.29Å; P882-R886 WeakPolarHBondContact O-CB 3.44Å; P882-R886 PolarHBondContact O-N 3.46Å; L883-R886 PolarHBondContact O-N 3.22Å; R886-A888 PolarHBondContact O-N 3.28Å; R886-T889 PolarHBondContact O-N 3.11Å; R886-F890 HydrophobicContact CG-CD2 3.7Å; R886-F890 HydrophobicContact CG-CE2 3.91Å; R886-F890 WeakPolarHBondContact O-CD2 3.17Å; R886-F890 PolarHBondContact O-N 2.83Å
887	L	90.9	Very high	87.9	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.01	38%	0.378	C	S	.	.	H	α-helix	trans	-63.4	-41.4	177.5	-69.8	175.8	0	0	0	112.6	C839 V842 A843 L860 F879 L883 Y891 G892 V893	C839-L887 HydrophobicContact CB-CD1 3.9Å; V842-L887 HydrophobicContact CG1-CD2 4.34Å; A843-L887 HydrophobicContact CB-CD2 4.1Å; A843-L887 HydrophobicContact CB-CG 4.25Å; L860-L887 HydrophobicContact CD1-CD2 4.19Å; F879-L887 HydrophobicContact CD2-CD1 4.11Å; F879-L887 HydrophobicContact CE2-CD1 3.71Å; L883-L887 HydrophobicContact CD1-CD1 3.76Å; L883-L887 HydrophobicContact CD1-CG 4.03Å; L883-L887 HydrophobicContact CG-CD1 4.12Å; L883-L887 WeakPolarHBondContact O-CG 3.32Å; L883-L887 PolarHBondContact O-N 2.92Å; L887-Y891 HydrophobicContact CD2-CD2 3.86Å; L887-Y891 HydrophobicContact CD2-CE2 4.14Å; L887-Y891 WeakPolarHBondContact O-CA 3.35Å; L887-Y891 WeakPolarHBondContact O-CB 3.23Å; L887-Y891 PolarHBondContact O-N 3.26Å; L887-G892 PolarHBondContact O-N 3.08Å; L887-V893 HydrophobicContact CB-CG2 4.26Å
888	A	89.2	Confident	87.9	Confident	52 Å²	52	66 Å²	66	43%	0.43	37%	0.365	S	S	.	.	H	α-helix	trans	-63.8	-41.4	175.6	0	0	0	0	0	111.9	K884 E885 R886 G892	K884-A888 WeakPolarHBondContact O-CB 3.27Å; K884-A888 PolarHBondContact O-N 3.11Å; E885-A888 PolarHBondContact O-N 2.93Å; R886-A888 PolarHBondContact O-N 3.28Å; A888-G892 VanDerWaalsContact O-CA 3.28Å; A888-G892 WeakPolarHBondContact O-CA 3.32Å; A888-G892 PolarHBondContact O-N 2.86Å
889	T	87.9	Confident	87.9	Confident	107 Å²	107	61.6 Å²	61.6	66%	0.656	35%	0.348	S	S	*	.	H	α-helix	trans	-69.4	-45.7	-177.9	-59.2	0	0	0	0	112.2	E885 R886	E885-T889 VanDerWaalsContact O-CB 3.28Å; E885-T889 WeakPolarHBondContact O-CB 3.31Å; E885-T889 PolarHBondContact O-N 3.43Å; E885-T889 PolarHBondContact O-OG1 3.15Å; R886-T889 PolarHBondContact O-N 3.11Å
890	F	84.8	Confident	87.9	Confident	68 Å²	68	64.7 Å²	64.7	30%	0.298	37%	0.367	S	S	.	.	H	α-helix	trans	-87.6	-30.6	-174.1	-77.2	-80.1	0	0	0	113.8	R853 R886	R853-F890 PolarHBondContact NE-O 2.86Å; R853-F890 PolarHBondContact NH2-O 2.74Å; R886-F890 HydrophobicContact CG-CD2 3.7Å; R886-F890 HydrophobicContact CG-CE2 3.91Å; R886-F890 WeakPolarHBondContact O-CD2 3.17Å; R886-F890 PolarHBondContact O-N 2.83Å
891	Y	91.5	Very high	88	Confident	8 Å²	8	63.4 Å²	63.4	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-128.7	-8.7	-169.7	-49.6	-75.6	0	0	0	114.5	V842 R853 F856 L860 H861 L887 V893	V842-Y891 HydrophobicContact CG1-CD2 4.35Å; V842-Y891 HydrophobicContact CG1-CE1 4.47Å; V842-Y891 HydrophobicContact CG1-CE2 3.62Å; R853-Y891 HydrophobicContact CG-CD1 4.33Å; R853-Y891 HydrophobicContact CG-CE1 3.67Å; F856-Y891 HydrophobicContact CB-CD1 4.14Å; F856-Y891 HydrophobicContact CB-CE1 3.62Å; F856-Y891 AromaticContact CD2-CE1 3.99Å; F856-Y891 HydrophobicContact CD2-CE1 3.99Å; F856-Y891 AromaticContact CD2-CZ 3.92Å; F856-Y891 VanDerWaalsContact CD2-OH 3.31Å; F856-Y891 WeakPolarHBondContact CD2-OH 3.24Å; F856-Y891 HydrophobicContact CG-CE1 4.32Å; L860-Y891 HydrophobicContact CD1-CD1 4.24Å; L860-Y891 HydrophobicContact CD1-CD2 3.82Å; L860-Y891 HydrophobicContact CD1-CG 3.66Å; H861-Y891 PolarHBondContact NE2-O 3.41Å; L887-Y891 HydrophobicContact CD2-CD2 3.86Å; L887-Y891 HydrophobicContact CD2-CE2 4.14Å; L887-Y891 WeakPolarHBondContact O-CA 3.35Å; L887-Y891 WeakPolarHBondContact O-CB 3.23Å; L887-Y891 PolarHBondContact O-N 3.26Å; Y891-V893 PolarHBondContact O-N 3.38Å
892	G	88.4	Confident	88	Confident	49 Å²	49	59.1 Å²	59.1	51%	0.505	33%	0.334	S	S	.	.			trans	68.4	29.4	173.8	0	0	0	0	0	114.9	L887 A888	L887-G892 PolarHBondContact O-N 3.08Å; A888-G892 VanDerWaalsContact O-CA 3.28Å; A888-G892 WeakPolarHBondContact O-CA 3.32Å; A888-G892 PolarHBondContact O-N 2.86Å
893	V	85.1	Confident	88.3	Confident	29 Å²	29	56 Å²	56	18%	0.176	31%	0.31	C	S	.	.			trans	-109.9	0	179.8	-69.7	0	0	0	0	113.6	L860 H861 K864 W872 L887 Y891	L860-V893 HydrophobicContact CB-CG1 4.07Å; L860-V893 HydrophobicContact CB-CG2 4.15Å; L860-V893 HydrophobicContact CD1-CG2 4.13Å; H861-V893 VanDerWaalsContact NE2-CG1 3.32Å; H861-V893 WeakPolarHBondContact NE2-CG1 3.34Å; K864-V893 HydrophobicContact CD-CG1 4.26Å; W872-V893 HydrophobicContact CZ2-CB 3.71Å; W872-V893 HydrophobicContact CZ2-CG2 3.97Å; W872-V893 PolarHBondContact NE1-OXT 3.01Å; L887-V893 HydrophobicContact CB-CG2 4.26Å; Y891-V893 PolarHBondContact O-N 3.38Å

Retrieved 893 of 893 residues in 972.6 ms (Link to these results)

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