XPO2_HUMAN Loading...

Exportin-2

Export receptor for importin-alpha. Mediates importin-alpha re-export from the nucleus to the cytoplasm after import substrates (cargos) have been released into the nucleoplasm. In the nucleus binds cooperatively to importin-alpha and to the GTPase Ran in its active GTP-bound form. Docking of this trimeric complex to the nuclear pore complex (NPC) is mediated through binding to nucleoporins. Upon transit of a nuclear export complex into the cytoplasm, disassembling of the complex and hydrolysis of Ran-GTP to Ran-GDP (induced by RANBP1 and RANGAP1, respectively) cause release of the importin-alpha from the export receptor. CSE1L/XPO2 then return to the nuclear compartment and mediate another round of transport. The directionality of nuclear export is thought to be conferred by an asymmetric distribution of the GTP- and GDP-bound forms of Ran between the cytoplasm and nucleus.

AlphaFold DB , UniProt , Accession P55060, Species HUMAN (Homo sapiens, Human), Gene CSE1L, Length 971 aa.

						>XPO2_HUMAN|P55060|CSE1L
MELSDANLQTLTEYLKKTLDPDPAIRRPAEKFLESVEGNQNYPLLLLTLLEKSQDNVIKVCASVTFKNYIKRNWRIVEDEPNKICEADRVAIKANIVHLMLSSPEQIQKQLSDAISIIGREDFPQKWPDLLTEMVNRFQSGDFHVINGVLRTAHSLFKRYRHEFKSNELWTEIKLVLDAFALPLTNLFKATIELCSTHANDASALRILFSSLILISKLFYSLNFQDLPEFFEDNMETWMNNFHTLLTLDNKLLQTDDEEEAGLLELLKSQICDNAALYAQKYDEEFQRYLPRFVTAIWNLLVTTGQEVKYDLLVSNAIQFLASVCERPHYKNLFEDQNTLTSICEKVIVPNMEFRAADEEAFEDNSEEYIRRDLEGSDIDTRRRAACDLVRGLCKFFEGPVTGIFSGYVNSMLQEYAKNPSVNWKHKDAAIYLVTSLASKAQTQKHGITQANELVNLTEFFVNHILPDLKSANVNEFPVLKADGIKYIMIFRNQVPKEHLLVSIPLLINHLQAESIVVHTYAAHALERLFTMRGPNNATLFTAAEIAPFVEILLTNLFKALTLPGSSENEYIMKAIMRSFSLLQEAIIPYIPTLITQLTQKLLAVSKNPSKPHFNHYMFEAICLSIRITCKANPAAVVNFEEALFLVFTEILQNDVQEFIPYVFQVMSLLLETHKNDIPSSYMALFPHLLQPVLWERTGNIPALVRLLQAFLERGSNTIASAAADKIPGLLGVFQKLIASKANDHQGFYLLNSIIEHMPPESVDQYRKQIFILLFQRLQNSKTTKFIKSFLVFINLYCIKYGALALQEIFDGIQPKMFGMVLEKIIIPEIQKVSGNVEKKICAVGITKLLTECPPMMDTEYTKLWTPLLQSLIGLFELPEDDTIPDEEHFIDIEDTPGYQTAFSQLAFAGKKEHDPVGQMVNNPKIHLAQSLHKLSTACPGRVPSMVSTSLNAEALQYLQGYLQAASVTLL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	85.6	Confident	90.6	Very high	45 Å²	45	68.2 Å²	68.2	22%	0.222	37%	0.37	C	S	.	.				0	123.7	0	-72.1	177.9	74.9	0	0	107.6	N7 L11 V36 N39 Q40 N41 Y42 L45	M1-N7 HydrophobicContact CE-CB 3.98Å; M1-L11 HydrophobicContact CE-CD1 4.44Å; M1-L11 HydrophobicContact CE-CD2 4.45Å; M1-L11 HydrophobicContact CE-CG 4.31Å; M1-V36 HydrophobicContact SD-CB 4.17Å; M1-V36 HydrophobicContact SD-CG2 4.42Å; M1-N39 HydrophobicContact CB-CB 4.38Å; M1-N39 HydrophobicContact CG-CB 3.73Å; M1-N39 HydrophobicContact SD-CB 4.3Å; M1-Q40 PolarHBondContact N-O 3.4Å; M1-N41 VanDerWaalsContact O-CB 3.32Å; M1-N41 WeakPolarHBondContact O-CB 3.49Å; M1-N41 PolarHBondContact O-ND2 2.97Å; M1-Y42 HydrophobicContact SD-CD2 4.24Å; M1-L45 HydrophobicContact CB-CD1 3.77Å; M1-L45 HydrophobicContact CE-CD1 3.91Å; M1-L45 HydrophobicContact SD-CD1 4.3Å
2	E	88.3	Confident	90.8	Very high	152 Å²	152	65.1 Å²	65.1	71%	0.71	36%	0.355	S	S	*	.			trans	-69.1	149.7	176.8	-66.2	-177.1	169.6	0	0	111.1	S4 N7	E2-S4 PolarHBondContact O-N 2.84Å; E2-N7 PolarHBondContact N-ND2 3.34Å; E2-N7 PolarHBondContact O-ND2 3.42Å
3	L	87.3	Confident	91	Very high	101 Å²	101	67.3 Å²	67.3	53%	0.529	36%	0.362	S	S	.	.	S	Bend	trans	-72.2	76.3	171.5	-72.9	165.6	0	0	0	109.7	N41 L44 L45	L3-N41 HydrophobicContact CD2-CB 4.28Å; L3-N41 HydrophobicContact CG-CB 4.04Å; L3-L44 HydrophobicContact CD1-CD1 4.49Å; L3-L44 HydrophobicContact CD2-CB 3.94Å; L3-L45 HydrophobicContact CD2-CD2 3.92Å; L3-L45 HydrophobicContact CD2-CG 3.98Å
4	S	89.9	Confident	91.3	Very high	37 Å²	37	66.9 Å²	66.9	26%	0.259	35%	0.353	S	S	.	.			trans	-123.6	152.6	-178.3	69.7	0	0	0	0	111.8	E2 A6 N7 L8	E2-S4 PolarHBondContact O-N 2.84Å; S4-A6 PolarHBondContact O-N 2.73Å; S4-N7 PolarHBondContact O-N 2.92Å; S4-N7 VanDerWaalsContact O-N 3.08Å; S4-N7 PolarHBondContact OG-N 3.45Å; S4-N7 PolarHBondContact OG-ND2 3.18Å; S4-L8 PolarHBondContact O-N 2.93Å; S4-L8 VanDerWaalsContact O-N 3.1Å
5	D	89.4	Confident	91.4	Very high	127 Å²	127	62.4 Å²	62.4	68%	0.679	33%	0.329	S	S	*	.	H	α-helix	trans	-59.8	-32.4	178.8	-66.5	-29.8	0	0	0	112.3	N7 L8 Q9	D5-N7 PolarHBondContact O-N 2.89Å; D5-L8 PolarHBondContact O-N 3.15Å; D5-Q9 WeakPolarHBondContact O-CB 3.23Å; D5-Q9 PolarHBondContact O-N 3.2Å
6	A	91.8	Very high	91.5	Very high	62 Å²	62	65 Å²	65	51%	0.512	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-40.8	175.3	0	0	0	0	0	112.6	S4 T10	S4-A6 PolarHBondContact O-N 2.73Å; A6-T10 WeakPolarHBondContact O-CB 3.32Å; A6-T10 PolarHBondContact O-N 3.49Å; A6-T10 PolarHBondContact O-OG1 3.18Å
7	N	92.7	Very high	91.5	Very high	37 Å²	37	66.1 Å²	66.1	20%	0.198	34%	0.339	C	S	.	.	H	α-helix	trans	-72.2	-37	177	-77.5	-30.6	0	0	0	111.8	M1 E2 S4 D5 T10 L11 L45	M1-N7 HydrophobicContact CE-CB 3.98Å; E2-N7 PolarHBondContact N-ND2 3.34Å; E2-N7 PolarHBondContact O-ND2 3.42Å; S4-N7 PolarHBondContact O-N 2.92Å; S4-N7 VanDerWaalsContact O-N 3.08Å; S4-N7 PolarHBondContact OG-N 3.45Å; S4-N7 PolarHBondContact OG-ND2 3.18Å; D5-N7 PolarHBondContact O-N 2.89Å; N7-T10 PolarHBondContact O-N 3.33Å; N7-L11 WeakPolarHBondContact O-CG 3.47Å; N7-L11 PolarHBondContact O-N 3.33Å; N7-L45 HydrophobicContact CB-CD1 3.91Å; N7-L45 HydrophobicContact CB-CD2 4.04Å
8	L	92	Very high	91.5	Very high	20 Å²	20	63.8 Å²	63.8	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-61.2	-44.3	172.8	-68.5	173.4	0	0	0	111.4	S4 D5 L11 T12 L45 T48 L49	S4-L8 PolarHBondContact O-N 2.93Å; S4-L8 VanDerWaalsContact O-N 3.1Å; D5-L8 PolarHBondContact O-N 3.15Å; L8-L11 PolarHBondContact O-N 2.81Å; L8-T12 WeakPolarHBondContact O-CB 3.31Å; L8-T12 PolarHBondContact O-N 2.65Å; L8-T12 PolarHBondContact O-OG1 3.44Å; L8-L45 HydrophobicContact CD2-CB 4.23Å; L8-L45 HydrophobicContact CD2-CD2 3.56Å; L8-L45 WeakPolarHBondContact CD2-O 3.44Å; L8-L45 HydrophobicContact CG-CD2 3.82Å; L8-T48 HydrophobicContact CD1-CG2 3.87Å; L8-T48 HydrophobicContact CD2-CG2 3.93Å; L8-L49 HydrophobicContact CB-CD2 4Å; L8-L49 HydrophobicContact CD2-CD2 3.8Å; L8-L49 HydrophobicContact CD2-CG 3.75Å; L8-L49 HydrophobicContact CG-CD2 4.47Å
9	Q	92.5	Very high	91.3	Very high	123 Å²	123	65.4 Å²	65.4	58%	0.575	34%	0.337	S	S	*	.	H	α-helix	trans	-63.3	-45.2	176.4	-174.4	175	-5.5	0	0	111.5	D5 L11 T12 E13	D5-Q9 WeakPolarHBondContact O-CB 3.23Å; D5-Q9 PolarHBondContact O-N 3.2Å; Q9-L11 PolarHBondContact O-N 3.25Å; Q9-T12 WeakPolarHBondContact O-CB 3.34Å; Q9-T12 PolarHBondContact O-N 3.01Å; Q9-E13 WeakPolarHBondContact O-CG 3.35Å; Q9-E13 PolarHBondContact O-N 2.7Å
10	T	93.2	Very high	91.2	Very high	46 Å²	46	64.7 Å²	64.7	28%	0.282	33%	0.333	S	S	.	.	H	α-helix	trans	-58.2	-49.7	177.5	-58.1	0	0	0	0	111.3	A6 N7 T12 E13 Y14 F32	A6-T10 WeakPolarHBondContact O-CB 3.32Å; A6-T10 PolarHBondContact O-N 3.49Å; A6-T10 PolarHBondContact O-OG1 3.18Å; N7-T10 PolarHBondContact O-N 3.33Å; T10-T12 VanDerWaalsContact C-N 3.31Å; T10-T12 PolarHBondContact O-N 3.34Å; T10-E13 PolarHBondContact O-N 2.62Å; T10-Y14 HydrophobicContact CG2-CD2 3.93Å; T10-Y14 HydrophobicContact CG2-CE2 3.91Å; T10-Y14 VanDerWaalsContact O-CD2 3.3Å; T10-Y14 WeakPolarHBondContact O-CD2 3.38Å; T10-Y14 PolarHBondContact O-N 2.72Å; T10-Y14 VanDerWaalsContact O-N 3.14Å; T10-F32 HydrophobicContact CG2-CE1 4.33Å; T10-F32 HydrophobicContact CG2-CZ 4.15Å
11	L	93.6	Very high	90.9	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-63.8	-37.5	178.2	-72.1	176.6	0	0	0	112.2	M1 N7 L8 Q9 E13 Y14 L15 L33 V36 Y42 L45 L49	M1-L11 HydrophobicContact CE-CD1 4.44Å; M1-L11 HydrophobicContact CE-CD2 4.45Å; M1-L11 HydrophobicContact CE-CG 4.31Å; N7-L11 WeakPolarHBondContact O-CG 3.47Å; N7-L11 PolarHBondContact O-N 3.33Å; L8-L11 PolarHBondContact O-N 2.81Å; Q9-L11 PolarHBondContact O-N 3.25Å; L11-E13 PolarHBondContact O-N 2.74Å; L11-Y14 PolarHBondContact O-N 2.98Å; L11-L15 WeakPolarHBondContact O-CB 3.48Å; L11-L15 VanDerWaalsContact O-CG 3.22Å; L11-L15 WeakPolarHBondContact O-CG 3.45Å; L11-L15 PolarHBondContact O-N 3.41Å; L11-L33 HydrophobicContact CD2-CD2 3.9Å; L11-V36 HydrophobicContact CD2-CG2 4.46Å; L11-Y42 HydrophobicContact CD1-CD2 4.42Å; L11-Y42 HydrophobicContact CD1-CE2 4.46Å; L11-Y42 HydrophobicContact CD2-CD2 4.21Å; L11-Y42 HydrophobicContact CD2-CE2 3.72Å; L11-L45 HydrophobicContact CD1-CB 3.53Å; L11-L45 HydrophobicContact CD1-CD1 3.88Å; L11-L45 HydrophobicContact CD1-CG 4.28Å; L11-L49 HydrophobicContact CB-CD1 3.85Å
12	T	93.7	Very high	90.9	Very high	31 Å²	31	68.3 Å²	68.3	19%	0.19	36%	0.361	C	S	.	.	H	α-helix	trans	-58.5	-47.1	174.8	-61.3	0	0	0	0	111.2	L8 Q9 T10 L15 K16 L49 I58	L8-T12 WeakPolarHBondContact O-CB 3.31Å; L8-T12 PolarHBondContact O-N 2.65Å; L8-T12 PolarHBondContact O-OG1 3.44Å; Q9-T12 WeakPolarHBondContact O-CB 3.34Å; Q9-T12 PolarHBondContact O-N 3.01Å; T10-T12 VanDerWaalsContact C-N 3.31Å; T10-T12 PolarHBondContact O-N 3.34Å; T12-L15 PolarHBondContact O-N 3.29Å; T12-K16 WeakPolarHBondContact O-CG 3.49Å; T12-K16 PolarHBondContact O-N 2.82Å; T12-L49 VanDerWaalsContact OG1-CD2 3.28Å; T12-L49 WeakPolarHBondContact OG1-CD2 3.06Å; T12-I58 HydrophobicContact CG2-CD1 3.95Å; T12-I58 HydrophobicContact CG2-CG1 4.01Å; T12-I58 HydrophobicContact CG2-CG2 4.26Å
13	E	93.5	Very high	90.6	Very high	94 Å²	94	63.7 Å²	63.7	44%	0.439	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-43.7	179.6	-71.8	177.1	-168.4	0	0	112.4	Q9 T10 L11 K16 K17	Q9-E13 WeakPolarHBondContact O-CG 3.35Å; Q9-E13 PolarHBondContact O-N 2.7Å; T10-E13 PolarHBondContact O-N 2.62Å; L11-E13 PolarHBondContact O-N 2.74Å; E13-K16 PolarHBondContact O-N 3.08Å; E13-K17 WeakPolarHBondContact O-CG 3.39Å; E13-K17 PolarHBondContact O-N 3.47Å; E13-K17 VanDerWaalsContact O-N 3.14Å
14	Y	94.3	Very high	90.6	Very high	61 Å²	61	62.2 Å²	62.2	24%	0.239	35%	0.346	C	S	.	.	H	α-helix	trans	-69.9	-39.3	178.1	-80	-75.4	0	0	0	112.7	T10 L11 K16 K17 T18 A29 F32	T10-Y14 HydrophobicContact CG2-CD2 3.93Å; T10-Y14 HydrophobicContact CG2-CE2 3.91Å; T10-Y14 VanDerWaalsContact O-CD2 3.3Å; T10-Y14 WeakPolarHBondContact O-CD2 3.38Å; T10-Y14 PolarHBondContact O-N 2.72Å; T10-Y14 VanDerWaalsContact O-N 3.14Å; L11-Y14 PolarHBondContact O-N 2.98Å; Y14-K16 VanDerWaalsContact C-N 3.31Å; Y14-K16 PolarHBondContact O-N 2.82Å; Y14-K17 HydrophobicContact CD1-CD 4.43Å; Y14-K17 PolarHBondContact O-N 3.36Å; Y14-K17 VanDerWaalsContact O-N 3.14Å; Y14-T18 WeakPolarHBondContact O-CG2 3.46Å; Y14-T18 PolarHBondContact O-N 2.9Å; Y14-A29 HydrophobicContact CD1-CB 4.05Å; Y14-F32 HydrophobicContact CD1-CB 3.8Å; Y14-F32 AromaticContact CD1-CD1 3.58Å; Y14-F32 HydrophobicContact CD1-CD1 3.58Å; Y14-F32 HydrophobicContact CD1-CE1 4.37Å; Y14-F32 AromaticContact CD1-CG 3.77Å; Y14-F32 HydrophobicContact CD1-CG 3.77Å; Y14-F32 AromaticContact CD2-CD1 3.31Å; Y14-F32 HydrophobicContact CD2-CD1 3.31Å; Y14-F32 AromaticContact CD2-CE1 3.22Å; Y14-F32 HydrophobicContact CD2-CE1 3.22Å; Y14-F32 HydrophobicContact CD2-CG 4.04Å; Y14-F32 AromaticContact CD2-CZ 3.9Å; Y14-F32 HydrophobicContact CD2-CZ 3.9Å; Y14-F32 HydrophobicContact CE1-CB 3.63Å; Y14-F32 AromaticContact CE1-CD1 3.77Å; Y14-F32 HydrophobicContact CE1-CD1 3.77Å; Y14-F32 HydrophobicContact CE1-CD2 4.08Å; Y14-F32 HydrophobicContact CE1-CE1 4.48Å; Y14-F32 AromaticContact CE1-CG 3.53Å; Y14-F32 HydrophobicContact CE1-CG 3.53Å; Y14-F32 AromaticContact CE2-CD1 3.52Å; Y14-F32 HydrophobicContact CE2-CD1 3.52Å; Y14-F32 HydrophobicContact CE2-CD2 4.01Å; Y14-F32 AromaticContact CE2-CE1 3.37Å; Y14-F32 HydrophobicContact CE2-CE1 3.37Å; Y14-F32 AromaticContact CE2-CE2 3.87Å; Y14-F32 HydrophobicContact CE2-CE2 3.87Å; Y14-F32 AromaticContact CE2-CG 3.84Å; Y14-F32 HydrophobicContact CE2-CG 3.84Å; Y14-F32 AromaticContact CE2-CZ 3.55Å; Y14-F32 HydrophobicContact CE2-CZ 3.55Å; Y14-F32 HydrophobicContact CG-CB 4.43Å; Y14-F32 AromaticContact CG-CD1 3.33Å; Y14-F32 HydrophobicContact CG-CD1 3.33Å; Y14-F32 AromaticContact CG-CE1 3.76Å; Y14-F32 HydrophobicContact CG-CE1 3.76Å; Y14-F32 HydrophobicContact CG-CG 4.01Å; Y14-F32 AromaticContact CZ-CD1 3.73Å; Y14-F32 AromaticContact CZ-CD2 3.69Å; Y14-F32 AromaticContact CZ-CE2 3.97Å; Y14-F32 AromaticContact CZ-CG 3.56Å
15	L	93.6	Very high	90.5	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-60.2	-40.2	173.3	-72.8	169.6	0	0	0	111.3	L11 T12 K17 T18 L33 L46 L49 I58 C61 A62 T65	L11-L15 WeakPolarHBondContact O-CB 3.48Å; L11-L15 VanDerWaalsContact O-CG 3.22Å; L11-L15 WeakPolarHBondContact O-CG 3.45Å; L11-L15 PolarHBondContact O-N 3.41Å; T12-L15 PolarHBondContact O-N 3.29Å; L15-K17 VanDerWaalsContact C-N 3.34Å; L15-K17 PolarHBondContact O-N 3.3Å; L15-T18 PolarHBondContact O-N 2.97Å; L15-T18 PolarHBondContact O-OG1 3.07Å; L15-L33 HydrophobicContact CD2-CD1 3.85Å; L15-L46 HydrophobicContact CD1-CD2 4.23Å; L15-L49 HydrophobicContact CD1-CD1 3.95Å; L15-I58 HydrophobicContact CB-CD1 4.16Å; L15-C61 HydrophobicContact CB-CB 4.24Å; L15-C61 HydrophobicContact CD2-CB 4.18Å; L15-A62 HydrophobicContact CD1-CB 4.1Å; L15-T65 HydrophobicContact CD2-CG2 4.28Å; L15-T65 WeakPolarHBondContact CD2-OG1 3.37Å
16	K	92.8	Very high	90.5	Very high	104 Å²	104	61.6 Å²	61.6	45%	0.452	33%	0.333	S	S	.	.	H	α-helix	trans	-59.7	-44.7	173.1	-72.5	-174.5	179.2	-162.6	0	112.1	T12 E13 Y14 T18 L19 D55 I58	T12-K16 WeakPolarHBondContact O-CG 3.49Å; T12-K16 PolarHBondContact O-N 2.82Å; E13-K16 PolarHBondContact O-N 3.08Å; Y14-K16 VanDerWaalsContact C-N 3.31Å; Y14-K16 PolarHBondContact O-N 2.82Å; K16-T18 PolarHBondContact O-N 3.09Å; K16-L19 WeakPolarHBondContact O-CB 3.36Å; K16-L19 PolarHBondContact O-N 3.47Å; K16-D55 WeakPolarHBondContact CE-OD2 3.3Å; K16-D55 IonicContact NZ-OD2 2.59Å; K16-D55 PolarHBondContact NZ-OD2 3.29Å; K16-I58 HydrophobicContact CB-CD1 4.48Å; K16-I58 HydrophobicContact CD-CD1 4.08Å; K16-I58 VanDerWaalsContact CE-CD1 3.47Å; K16-I58 VanDerWaalsContact CE-CG1 3.45Å; K16-I58 HydrophobicContact CG-CD1 3.33Å; K16-I58 HydrophobicContact CG-CG1 4.25Å
17	K	92.2	Very high	90.3	Very high	84 Å²	84	66.3 Å²	66.3	37%	0.365	34%	0.338	S	S	.	.	H	α-helix	trans	-63.7	-26.7	178.8	-70.4	174.3	-176.1	174.7	0	113	E13 Y14 L15 L19 D20 I25 R26 A29	E13-K17 WeakPolarHBondContact O-CG 3.39Å; E13-K17 PolarHBondContact O-N 3.47Å; E13-K17 VanDerWaalsContact O-N 3.14Å; Y14-K17 HydrophobicContact CD1-CD 4.43Å; Y14-K17 PolarHBondContact O-N 3.36Å; Y14-K17 VanDerWaalsContact O-N 3.14Å; L15-K17 VanDerWaalsContact C-N 3.34Å; L15-K17 PolarHBondContact O-N 3.3Å; K17-L19 PolarHBondContact O-N 2.96Å; K17-D20 VanDerWaalsContact O-CB 3.31Å; K17-D20 WeakPolarHBondContact O-CB 3.26Å; K17-D20 PolarHBondContact O-N 3.18Å; K17-D20 VanDerWaalsContact O-N 3.14Å; K17-I25 HydrophobicContact CB-CG2 3.86Å; K17-I25 HydrophobicContact CD-CG2 4.42Å; K17-I25 HydrophobicContact CG-CG2 3.9Å; K17-R26 WeakPolarHBondContact O-CA 3.39Å; K17-A29 HydrophobicContact CB-CB 3.51Å
18	T	90	Very high	90.2	Very high	25 Å²	25	68 Å²	68	15%	0.153	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.8	174.1	64.5	0	0	0	0	113.9	Y14 L15 K16 R26 A29 E30 L33	Y14-T18 WeakPolarHBondContact O-CG2 3.46Å; Y14-T18 PolarHBondContact O-N 2.9Å; L15-T18 PolarHBondContact O-N 2.97Å; L15-T18 PolarHBondContact O-OG1 3.07Å; K16-T18 PolarHBondContact O-N 3.09Å; T18-R26 VanDerWaalsContact O-CD 3.26Å; T18-R26 WeakPolarHBondContact O-CD 3.4Å; T18-R26 WeakPolarHBondContact O-CG 3.28Å; T18-A29 HydrophobicContact CG2-CB 3.96Å; T18-E30 HydrophobicContact CG2-CG 4.16Å; T18-L33 HydrophobicContact CG2-CD1 3.61Å
19	L	88.2	Confident	90.1	Very high	94 Å²	94	67.1 Å²	67.1	49%	0.492	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-1	175.9	-56.3	178.5	0	0	0	113.2	K16 K17 V57 C61	K16-L19 WeakPolarHBondContact O-CB 3.36Å; K16-L19 PolarHBondContact O-N 3.47Å; K17-L19 PolarHBondContact O-N 2.96Å; L19-V57 HydrophobicContact CD1-CG1 3.23Å; L19-C61 VanDerWaalsContact CD1-SG 3.52Å
20	D	88.8	Confident	89.9	Confident	50 Å²	50	65 Å²	65	27%	0.267	34%	0.336	S	S	.	.			trans	-67.6	133.3	-177.2	-157.4	-66.9	0	0	0	110.2	K17 D22 I25 R26	K17-D20 VanDerWaalsContact O-CB 3.31Å; K17-D20 WeakPolarHBondContact O-CB 3.26Å; K17-D20 PolarHBondContact O-N 3.18Å; K17-D20 VanDerWaalsContact O-N 3.14Å; D20-D22 PolarHBondContact O-N 3.3Å; D20-D22 VanDerWaalsContact OD1-CB 3.27Å; D20-D22 WeakPolarHBondContact OD1-CB 3.27Å; D20-D22 PolarHBondContact OD1-N 3.4Å; D20-I25 HydrophobicContact CB-CB 3.93Å; D20-I25 HydrophobicContact CB-CG2 3.69Å; D20-I25 WeakPolarHBondContact OD2-CD1 3.46Å; D20-R26 PolarHBondContact O-NH1 3.39Å
21	P	84.8	Confident	89.7	Confident	114 Å²	114	69.8 Å²	69.8	74%	0.74	35%	0.353	S	S	*	.	S	Bend	trans	-63.5	-25.4	175.2	25.9	-34.9	0	0	0	112.5	P23	P21-P23 VanDerWaalsContact O-CD 3.26Å; P21-P23 WeakPolarHBondContact O-CD 3.23Å
22	D	86.9	Confident	89.7	Confident	73 Å²	73	72.2 Å²	72.2	39%	0.39	36%	0.364	S	S	.	.			trans	-75.9	114	177.2	-173.8	-4.4	0	0	0	111.3	D20 A24 I25 R26	D20-D22 PolarHBondContact O-N 3.3Å; D20-D22 VanDerWaalsContact OD1-CB 3.27Å; D20-D22 WeakPolarHBondContact OD1-CB 3.27Å; D20-D22 PolarHBondContact OD1-N 3.4Å; D22-A24 PolarHBondContact O-N 3.26Å; D22-A24 VanDerWaalsContact O-N 3.11Å; D22-A24 VanDerWaalsContact OD1-CB 3.24Å; D22-A24 WeakPolarHBondContact OD1-CB 3.29Å; D22-A24 PolarHBondContact OD1-N 3.21Å; D22-I25 HydrophobicContact CB-CB 4.42Å; D22-I25 HydrophobicContact CB-CD1 4.17Å; D22-I25 HydrophobicContact CB-CG1 4.23Å; D22-I25 PolarHBondContact O-N 3.22Å; D22-R26 PolarHBondContact O-N 2.69Å
23	P	81.7	Confident	89.5	Confident	55 Å²	55	71.3 Å²	71.3	36%	0.357	36%	0.358	S	S	.	.	H	α-helix	trans	-57.4	-25.5	175.1	-22.9	35	0	0	0	113.7	P21 I25 R27	P21-P23 VanDerWaalsContact O-CD 3.26Å; P21-P23 WeakPolarHBondContact O-CD 3.23Å; P23-I25 VanDerWaalsContact C-N 3.26Å; P23-I25 PolarHBondContact O-N 2.86Å; P23-R27 WeakPolarHBondContact O-CB 3.44Å; P23-R27 WeakPolarHBondContact O-CG 3.43Å; P23-R27 PolarHBondContact O-N 2.91Å
24	A	88	Confident	89.2	Confident	70 Å²	70	72.2 Å²	72.2	58%	0.579	36%	0.362	S	S	*	.	H	α-helix	trans	-70.9	-21	177.2	0	0	0	0	0	112.9	D22 P28	D22-A24 PolarHBondContact O-N 3.26Å; D22-A24 VanDerWaalsContact O-N 3.11Å; D22-A24 VanDerWaalsContact OD1-CB 3.24Å; D22-A24 WeakPolarHBondContact OD1-CB 3.29Å; D22-A24 PolarHBondContact OD1-N 3.21Å; A24-P28 WeakPolarHBondContact O-CD 3.33Å; A24-P28 WeakPolarHBondContact O-CG 3.19Å
25	I	87.5	Confident	88.9	Confident	65 Å²	65	73.6 Å²	73.6	33%	0.333	38%	0.38	S	S	.	.	H	α-helix	trans	-95.7	-43.2	173.2	-62.6	175.4	0	0	0	110.2	K17 D20 D22 P23 P28 A29	K17-I25 HydrophobicContact CB-CG2 3.86Å; K17-I25 HydrophobicContact CD-CG2 4.42Å; K17-I25 HydrophobicContact CG-CG2 3.9Å; D20-I25 HydrophobicContact CB-CB 3.93Å; D20-I25 HydrophobicContact CB-CG2 3.69Å; D20-I25 WeakPolarHBondContact OD2-CD1 3.46Å; D22-I25 HydrophobicContact CB-CB 4.42Å; D22-I25 HydrophobicContact CB-CD1 4.17Å; D22-I25 HydrophobicContact CB-CG1 4.23Å; D22-I25 PolarHBondContact O-N 3.22Å; P23-I25 VanDerWaalsContact C-N 3.26Å; P23-I25 PolarHBondContact O-N 2.86Å; I25-P28 WeakPolarHBondContact O-CD 3.45Å; I25-A29 PolarHBondContact O-N 3.07Å
26	R	89.6	Confident	88.8	Confident	85 Å²	85	74.4 Å²	74.4	32%	0.321	39%	0.385	S	S	.	.	H	α-helix	trans	-64.7	-51	-176.9	-177.1	171.6	73.5	-134.8	4.2	113.4	K17 T18 D20 D22 A29 E30	K17-R26 WeakPolarHBondContact O-CA 3.39Å; T18-R26 VanDerWaalsContact O-CD 3.26Å; T18-R26 WeakPolarHBondContact O-CD 3.4Å; T18-R26 WeakPolarHBondContact O-CG 3.28Å; D20-R26 PolarHBondContact O-NH1 3.39Å; D22-R26 PolarHBondContact O-N 2.69Å; R26-A29 WeakPolarHBondContact O-CB 3.36Å; R26-A29 PolarHBondContact O-N 2.85Å; R26-A29 VanDerWaalsContact O-N 3.09Å; R26-E30 HydrophobicContact CG-CG 4.33Å; R26-E30 VanDerWaalsContact CG-OE1 3.29Å; R26-E30 WeakPolarHBondContact CG-OE1 3.43Å; R26-E30 IonicContact NE-OE1 2.67Å; R26-E30 WeakPolarHBondContact O-CG 3.37Å; R26-E30 PolarHBondContact O-N 3.32Å
27	R	86.8	Confident	88.7	Confident	162 Å²	162	69.8 Å²	69.8	61%	0.611	37%	0.365	S	S	*	.	H	α-helix	trans	-63	-43.3	-175.4	-69.7	175.5	173.4	176.2	-1.8	113.3	P23 A29 E30 K31	P23-R27 WeakPolarHBondContact O-CB 3.44Å; P23-R27 WeakPolarHBondContact O-CG 3.43Å; P23-R27 PolarHBondContact O-N 2.91Å; R27-A29 VanDerWaalsContact C-N 3.26Å; R27-A29 PolarHBondContact O-N 3.15Å; R27-E30 PolarHBondContact O-N 3Å; R27-K31 WeakPolarHBondContact O-CB 3.13Å; R27-K31 WeakPolarHBondContact O-CG 3.34Å; R27-K31 PolarHBondContact O-N 3.32Å
28	P	90.5	Very high	88.4	Confident	73 Å²	73	68 Å²	68	47%	0.474	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-33.3	173.4	-26.4	37.3	0	0	0	113.2	A24 I25 F32	A24-P28 WeakPolarHBondContact O-CD 3.33Å; A24-P28 WeakPolarHBondContact O-CG 3.19Å; I25-P28 WeakPolarHBondContact O-CD 3.45Å; P28-F32 WeakPolarHBondContact O-CB 3.46Å; P28-F32 PolarHBondContact O-N 3.44Å
29	A	89.3	Confident	88.5	Confident	1 Å²	1	70 Å²	70	1%	0.008	38%	0.38	C	S	.	.	H	α-helix	trans	-69.9	-43.5	177.1	0	0	0	0	0	112.4	Y14 K17 T18 I25 R26 R27 F32 L33	Y14-A29 HydrophobicContact CD1-CB 4.05Å; K17-A29 HydrophobicContact CB-CB 3.51Å; T18-A29 HydrophobicContact CG2-CB 3.96Å; I25-A29 PolarHBondContact O-N 3.07Å; R26-A29 WeakPolarHBondContact O-CB 3.36Å; R26-A29 PolarHBondContact O-N 2.85Å; R26-A29 VanDerWaalsContact O-N 3.09Å; R27-A29 VanDerWaalsContact C-N 3.26Å; R27-A29 PolarHBondContact O-N 3.15Å; A29-F32 PolarHBondContact O-N 3.1Å; A29-L33 WeakPolarHBondContact O-CG 3.49Å; A29-L33 PolarHBondContact O-N 2.93Å
30	E	88.7	Confident	88.7	Confident	77 Å²	77	70.5 Å²	70.5	36%	0.36	38%	0.38	S	S	.	.	H	α-helix	trans	-57.3	-50.3	172.3	-69.8	166.2	170.9	0	0	110.7	T18 R26 R27 F32 L33 E34	T18-E30 HydrophobicContact CG2-CG 4.16Å; R26-E30 HydrophobicContact CG-CG 4.33Å; R26-E30 VanDerWaalsContact CG-OE1 3.29Å; R26-E30 WeakPolarHBondContact CG-OE1 3.43Å; R26-E30 IonicContact NE-OE1 2.67Å; R26-E30 WeakPolarHBondContact O-CG 3.37Å; R26-E30 PolarHBondContact O-N 3.32Å; R27-E30 PolarHBondContact O-N 3Å; E30-F32 VanDerWaalsContact C-N 3.3Å; E30-F32 PolarHBondContact O-N 3Å; E30-L33 PolarHBondContact O-N 3.45Å; E30-E34 WeakPolarHBondContact O-CG 2.93Å; E30-E34 PolarHBondContact O-N 2.88Å
31	K	89.3	Confident	89	Confident	148 Å²	148	69.8 Å²	69.8	64%	0.643	38%	0.376	S	S	*	.	H	α-helix	trans	-58.9	-38.4	175.9	-75.2	-175.8	178.2	-172.7	0	113.1	R27 S35	R27-K31 WeakPolarHBondContact O-CB 3.13Å; R27-K31 WeakPolarHBondContact O-CG 3.34Å; R27-K31 PolarHBondContact O-N 3.32Å; K31-S35 WeakPolarHBondContact O-CB 3.38Å; K31-S35 PolarHBondContact O-N 2.98Å; K31-S35 PolarHBondContact O-OG 3.38Å
32	F	92.4	Very high	89.4	Confident	50 Å²	50	64.4 Å²	64.4	22%	0.219	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-50.7	176.4	175.7	-92.9	0	0	0	110.6	T10 Y14 P28 A29 E30 E34 S35 V36	T10-F32 HydrophobicContact CG2-CE1 4.33Å; T10-F32 HydrophobicContact CG2-CZ 4.15Å; Y14-F32 HydrophobicContact CD1-CB 3.8Å; Y14-F32 AromaticContact CD1-CD1 3.58Å; Y14-F32 HydrophobicContact CD1-CD1 3.58Å; Y14-F32 HydrophobicContact CD1-CE1 4.37Å; Y14-F32 AromaticContact CD1-CG 3.77Å; Y14-F32 HydrophobicContact CD1-CG 3.77Å; Y14-F32 AromaticContact CD2-CD1 3.31Å; Y14-F32 HydrophobicContact CD2-CD1 3.31Å; Y14-F32 AromaticContact CD2-CE1 3.22Å; Y14-F32 HydrophobicContact CD2-CE1 3.22Å; Y14-F32 HydrophobicContact CD2-CG 4.04Å; Y14-F32 AromaticContact CD2-CZ 3.9Å; Y14-F32 HydrophobicContact CD2-CZ 3.9Å; Y14-F32 HydrophobicContact CE1-CB 3.63Å; Y14-F32 AromaticContact CE1-CD1 3.77Å; Y14-F32 HydrophobicContact CE1-CD1 3.77Å; Y14-F32 HydrophobicContact CE1-CD2 4.08Å; Y14-F32 HydrophobicContact CE1-CE1 4.48Å; Y14-F32 AromaticContact CE1-CG 3.53Å; Y14-F32 HydrophobicContact CE1-CG 3.53Å; Y14-F32 AromaticContact CE2-CD1 3.52Å; Y14-F32 HydrophobicContact CE2-CD1 3.52Å; Y14-F32 HydrophobicContact CE2-CD2 4.01Å; Y14-F32 AromaticContact CE2-CE1 3.37Å; Y14-F32 HydrophobicContact CE2-CE1 3.37Å; Y14-F32 AromaticContact CE2-CE2 3.87Å; Y14-F32 HydrophobicContact CE2-CE2 3.87Å; Y14-F32 AromaticContact CE2-CG 3.84Å; Y14-F32 HydrophobicContact CE2-CG 3.84Å; Y14-F32 AromaticContact CE2-CZ 3.55Å; Y14-F32 HydrophobicContact CE2-CZ 3.55Å; Y14-F32 HydrophobicContact CG-CB 4.43Å; Y14-F32 AromaticContact CG-CD1 3.33Å; Y14-F32 HydrophobicContact CG-CD1 3.33Å; Y14-F32 AromaticContact CG-CE1 3.76Å; Y14-F32 HydrophobicContact CG-CE1 3.76Å; Y14-F32 HydrophobicContact CG-CG 4.01Å; Y14-F32 AromaticContact CZ-CD1 3.73Å; Y14-F32 AromaticContact CZ-CD2 3.69Å; Y14-F32 AromaticContact CZ-CE2 3.97Å; Y14-F32 AromaticContact CZ-CG 3.56Å; P28-F32 WeakPolarHBondContact O-CB 3.46Å; P28-F32 PolarHBondContact O-N 3.44Å; A29-F32 PolarHBondContact O-N 3.1Å; E30-F32 VanDerWaalsContact C-N 3.3Å; E30-F32 PolarHBondContact O-N 3Å; F32-E34 VanDerWaalsContact C-N 3.28Å; F32-E34 PolarHBondContact O-N 3.34Å; F32-S35 WeakPolarHBondContact CA-OG 3.42Å; F32-S35 PolarHBondContact O-N 2.98Å; F32-S35 PolarHBondContact O-OG 2.98Å; F32-V36 HydrophobicContact CD1-CG2 4.42Å; F32-V36 HydrophobicContact CD2-CG1 4.4Å; F32-V36 HydrophobicContact CE1-CG1 4.03Å; F32-V36 HydrophobicContact CE1-CG2 4.06Å; F32-V36 HydrophobicContact CE2-CG1 3.87Å; F32-V36 HydrophobicContact CZ-CG1 3.67Å; F32-V36 PolarHBondContact O-N 3.45Å; F32-V36 VanDerWaalsContact O-N 3.08Å
33	L	91.4	Very high	89.8	Confident	12 Å²	12	60.9 Å²	60.9	6%	0.063	32%	0.323	C	S	.	.	H	α-helix	trans	-58.1	-41.8	178.9	-68.1	175.4	0	0	0	111.5	L11 L15 T18 A29 E30 V36 E37	L11-L33 HydrophobicContact CD2-CD2 3.9Å; L15-L33 HydrophobicContact CD2-CD1 3.85Å; T18-L33 HydrophobicContact CG2-CD1 3.61Å; A29-L33 WeakPolarHBondContact O-CG 3.49Å; A29-L33 PolarHBondContact O-N 2.93Å; E30-L33 PolarHBondContact O-N 3.45Å; L33-V36 PolarHBondContact O-N 3.44Å; L33-E37 WeakPolarHBondContact O-CB 3.49Å; L33-E37 PolarHBondContact O-N 3.38Å; L33-E37 VanDerWaalsContact O-N 3.11Å
34	E	87	Confident	90.5	Very high	114 Å²	114	59.1 Å²	59.1	53%	0.533	31%	0.31	S	S	.	.	H	α-helix	trans	-62.2	-39.4	173.3	-72.9	175	175.6	0	0	112.7	E30 F32 V36 E37	E30-E34 WeakPolarHBondContact O-CG 2.93Å; E30-E34 PolarHBondContact O-N 2.88Å; F32-E34 VanDerWaalsContact C-N 3.28Å; F32-E34 PolarHBondContact O-N 3.34Å; E34-V36 VanDerWaalsContact C-N 3.32Å; E34-V36 PolarHBondContact O-N 3.49Å; E34-E37 WeakPolarHBondContact O-CG 3.27Å
35	S	88.2	Confident	90.9	Very high	89 Å²	89	55.8 Å²	55.8	62%	0.622	28%	0.282	S	S	*	.	H	α-helix	trans	-71.8	-25.5	-179.1	69.6	0	0	0	0	113.7	K31 F32	K31-S35 WeakPolarHBondContact O-CB 3.38Å; K31-S35 PolarHBondContact O-N 2.98Å; K31-S35 PolarHBondContact O-OG 3.38Å; F32-S35 WeakPolarHBondContact CA-OG 3.42Å; F32-S35 PolarHBondContact O-N 2.98Å; F32-S35 PolarHBondContact O-OG 2.98Å
36	V	90.6	Very high	91.3	Very high	17 Å²	17	52.7 Å²	52.7	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-98.6	-10.6	-179.8	-57.3	0	0	0	0	114.1	M1 L11 F32 L33 E34 G38 N39 Y42	M1-V36 HydrophobicContact SD-CB 4.17Å; M1-V36 HydrophobicContact SD-CG2 4.42Å; L11-V36 HydrophobicContact CD2-CG2 4.46Å; F32-V36 HydrophobicContact CD1-CG2 4.42Å; F32-V36 HydrophobicContact CD2-CG1 4.4Å; F32-V36 HydrophobicContact CE1-CG1 4.03Å; F32-V36 HydrophobicContact CE1-CG2 4.06Å; F32-V36 HydrophobicContact CE2-CG1 3.87Å; F32-V36 HydrophobicContact CZ-CG1 3.67Å; F32-V36 PolarHBondContact O-N 3.45Å; F32-V36 VanDerWaalsContact O-N 3.08Å; L33-V36 PolarHBondContact O-N 3.44Å; E34-V36 VanDerWaalsContact C-N 3.32Å; E34-V36 PolarHBondContact O-N 3.49Å; V36-G38 PolarHBondContact O-N 3.18Å; V36-G38 VanDerWaalsContact O-N 3.15Å; V36-N39 WeakPolarHBondContact CA-ND2 3.38Å; V36-N39 WeakPolarHBondContact O-CB 3.49Å; V36-N39 PolarHBondContact O-N 3.04Å; V36-N39 VanDerWaalsContact O-N 3.09Å; V36-N39 PolarHBondContact O-ND2 3.44Å; V36-Y42 HydrophobicContact CG2-CD2 4.1Å; V36-Y42 HydrophobicContact CG2-CE2 3.84Å
37	E	89.8	Confident	91.5	Very high	7 Å²	7	49.1 Å²	49.1	3%	0.033	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.9	-173.3	80.1	176.7	-169.1	0	0	113.7	L33 E34 N39 Y42 Y69 R72 N73 K83	L33-E37 WeakPolarHBondContact O-CB 3.49Å; L33-E37 PolarHBondContact O-N 3.38Å; L33-E37 VanDerWaalsContact O-N 3.11Å; E34-E37 WeakPolarHBondContact O-CG 3.27Å; E37-N39 VanDerWaalsContact C-N 3.25Å; E37-N39 PolarHBondContact O-N 2.97Å; E37-Y42 HydrophobicContact CB-CD1 4.01Å; E37-Y42 HydrophobicContact CB-CE1 3.73Å; E37-Y69 HydrophobicContact CB-CD2 3.79Å; E37-Y69 HydrophobicContact CB-CE2 3.76Å; E37-Y69 HydrophobicContact CG-CD2 4.17Å; E37-Y69 HydrophobicContact CG-CE2 4.07Å; E37-Y69 WeakPolarHBondContact O-CE2 3.35Å; E37-Y69 PolarHBondContact O-OH 2.93Å; E37-R72 IonicContact OE2-CZ 2.8Å; E37-R72 IonicContact OE2-NE 2.74Å; E37-R72 IonicContact OE2-NH2 3.41Å; E37-R72 PolarHBondContact OE2-NH2 3Å; E37-N73 PolarHBondContact OE1-ND2 3.32Å; E37-N73 VanDerWaalsContact OE1-ND2 3.15Å; E37-K83 HydrophobicContact CG-CD 4.23Å; E37-K83 IonicContact OE1-NZ 2.84Å; E37-K83 PolarHBondContact OE1-NZ 3.4Å
38	G	87.2	Confident	91.9	Very high	46 Å²	46	42.7 Å²	42.7	47%	0.474	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-1.6	177.4	0	0	0	0	0	115.1	V36	V36-G38 PolarHBondContact O-N 3.18Å; V36-G38 VanDerWaalsContact O-N 3.15Å
39	N	91.7	Very high	92.1	Very high	68 Å²	68	39.6 Å²	39.6	36%	0.364	21%	0.212	S	C	.	.	S	Bend	trans	-82.3	137.6	179.2	-69.5	-57.2	0	0	0	111.9	M1 V36 E37 Y42	M1-N39 HydrophobicContact CB-CB 4.38Å; M1-N39 HydrophobicContact CG-CB 3.73Å; M1-N39 HydrophobicContact SD-CB 4.3Å; V36-N39 WeakPolarHBondContact CA-ND2 3.38Å; V36-N39 WeakPolarHBondContact O-CB 3.49Å; V36-N39 PolarHBondContact O-N 3.04Å; V36-N39 VanDerWaalsContact O-N 3.09Å; V36-N39 PolarHBondContact O-ND2 3.44Å; E37-N39 VanDerWaalsContact C-N 3.25Å; E37-N39 PolarHBondContact O-N 2.97Å; N39-Y42 WeakPolarHBondContact O-CB 3.39Å; N39-Y42 PolarHBondContact O-N 3.03Å; N39-Y42 VanDerWaalsContact O-N 3.12Å
40	Q	92.6	Very high	92.2	Very high	105 Å²	105	39.7 Å²	39.7	49%	0.491	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	143.6	171	179.3	172.3	2.7	0	0	112.3	M1 Y42 D88	M1-Q40 PolarHBondContact N-O 3.4Å; Q40-Y42 PolarHBondContact O-N 3.34Å; Q40-D88 WeakPolarHBondContact CA-OD2 3.36Å
41	N	94.5	Very high	92.2	Very high	34 Å²	34	42 Å²	42	18%	0.182	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	0.5	-172.7	-40.1	-61.6	0	0	0	116.2	M1 L3 L44 L45 D88	M1-N41 VanDerWaalsContact O-CB 3.32Å; M1-N41 WeakPolarHBondContact O-CB 3.49Å; M1-N41 PolarHBondContact O-ND2 2.97Å; L3-N41 HydrophobicContact CD2-CB 4.28Å; L3-N41 HydrophobicContact CG-CB 4.04Å; N41-L44 HydrophobicContact CB-CB 4.35Å; N41-L44 HydrophobicContact CB-CD1 4.39Å; N41-L44 PolarHBondContact O-N 3.39Å; N41-L44 VanDerWaalsContact O-N 3.1Å; N41-L45 WeakPolarHBondContact O-CG 3.19Å; N41-L45 PolarHBondContact O-N 3.32Å; N41-D88 WeakPolarHBondContact CA-OD1 3.5Å; N41-D88 VanDerWaalsContact N-CG 3.34Å; N41-D88 PolarHBondContact N-OD1 2.58Å; N41-D88 VanDerWaalsContact N-OD1 3.12Å; N41-D88 PolarHBondContact N-OD2 2.94Å; N41-D88 PolarHBondContact OD1-OD1 3.38Å
42	Y	94.7	Very high	92.2	Very high	1 Å²	1	41.7 Å²	41.7	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-50.6	-51.4	172.8	173.9	-98.9	0	0	0	113.1	M1 L11 V36 E37 N39 Q40 L44 L45 L46 T65 Y69	M1-Y42 HydrophobicContact SD-CD2 4.24Å; L11-Y42 HydrophobicContact CD1-CD2 4.42Å; L11-Y42 HydrophobicContact CD1-CE2 4.46Å; L11-Y42 HydrophobicContact CD2-CD2 4.21Å; L11-Y42 HydrophobicContact CD2-CE2 3.72Å; V36-Y42 HydrophobicContact CG2-CD2 4.1Å; V36-Y42 HydrophobicContact CG2-CE2 3.84Å; E37-Y42 HydrophobicContact CB-CD1 4.01Å; E37-Y42 HydrophobicContact CB-CE1 3.73Å; N39-Y42 WeakPolarHBondContact O-CB 3.39Å; N39-Y42 PolarHBondContact O-N 3.03Å; N39-Y42 VanDerWaalsContact O-N 3.12Å; Q40-Y42 PolarHBondContact O-N 3.34Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; Y42-L44 PolarHBondContact O-N 3.47Å; Y42-L45 WeakPolarHBondContact O-CB 3.49Å; Y42-L45 PolarHBondContact O-N 3.38Å; Y42-L46 HydrophobicContact CD1-CD1 4.29Å; Y42-L46 HydrophobicContact CE1-CD1 3.63Å; Y42-L46 HydrophobicContact CE1-CG 4.36Å; Y42-L46 PolarHBondContact O-N 2.91Å; Y42-L46 VanDerWaalsContact O-N 3.17Å; Y42-T65 WeakPolarHBondContact OH-CG2 3.22Å; Y42-Y69 HydrophobicContact CD1-CD2 4.11Å; Y42-Y69 AromaticContact CD1-CE2 3.95Å; Y42-Y69 HydrophobicContact CD1-CE2 3.95Å; Y42-Y69 HydrophobicContact CD1-CG 4.48Å; Y42-Y69 AromaticContact CE1-CD2 3.91Å; Y42-Y69 HydrophobicContact CE1-CD2 3.91Å; Y42-Y69 HydrophobicContact CE1-CE2 4.22Å; Y42-Y69 HydrophobicContact CE1-CG 4.21Å
43	P	95.2	Very high	92	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-34.9	176.9	22.9	-33.6	0	0	0	112.8	L46 L47 F66 Y69 D88 I92	P43-L46 WeakPolarHBondContact O-CB 3.5Å; P43-L46 PolarHBondContact O-N 3.43Å; P43-L47 WeakPolarHBondContact O-CG 3.27Å; P43-L47 PolarHBondContact O-N 2.97Å; P43-F66 HydrophobicContact CB-CD2 4.18Å; P43-F66 HydrophobicContact CB-CE2 3.87Å; P43-Y69 HydrophobicContact CB-CD1 4.15Å; P43-Y69 HydrophobicContact CB-CE1 3.7Å; P43-Y69 HydrophobicContact CG-CE1 3.84Å; P43-D88 HydrophobicContact CG-CB 4.07Å; P43-I92 HydrophobicContact CB-CD1 3.63Å; P43-I92 HydrophobicContact CB-CG1 4.21Å; P43-I92 HydrophobicContact CG-CD1 3.73Å; P43-I92 HydrophobicContact CG-CG1 4.49Å
44	L	95.6	Very high	91.8	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.094	26%	0.259	C	S	.	.	H	α-helix	trans	-68.8	-34	178	-59.3	-178.8	0	0	0	112.2	L3 N41 Y42 L46 L47 T48 A91 I92	L3-L44 HydrophobicContact CD1-CD1 4.49Å; L3-L44 HydrophobicContact CD2-CB 3.94Å; N41-L44 HydrophobicContact CB-CB 4.35Å; N41-L44 HydrophobicContact CB-CD1 4.39Å; N41-L44 PolarHBondContact O-N 3.39Å; N41-L44 VanDerWaalsContact O-N 3.1Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; Y42-L44 PolarHBondContact O-N 3.47Å; L44-L46 VanDerWaalsContact C-N 3.35Å; L44-L47 HydrophobicContact CD2-CD1 4.37Å; L44-L47 PolarHBondContact O-N 3.1Å; L44-T48 WeakPolarHBondContact O-CB 3.33Å; L44-T48 PolarHBondContact O-N 3.01Å; L44-T48 PolarHBondContact O-OG1 2.91Å; L44-A91 HydrophobicContact CD1-CB 3.71Å; L44-A91 HydrophobicContact CD2-CB 3.59Å; L44-A91 HydrophobicContact CG-CB 4.27Å; L44-I92 HydrophobicContact CD2-CG1 3.96Å
45	L	95.7	Very high	92	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-41.5	170.8	-73.5	164.6	0	0	0	111	M1 L3 N7 L8 L11 N41 Y42 T48 L49	M1-L45 HydrophobicContact CB-CD1 3.77Å; M1-L45 HydrophobicContact CE-CD1 3.91Å; M1-L45 HydrophobicContact SD-CD1 4.3Å; L3-L45 HydrophobicContact CD2-CD2 3.92Å; L3-L45 HydrophobicContact CD2-CG 3.98Å; N7-L45 HydrophobicContact CB-CD1 3.91Å; N7-L45 HydrophobicContact CB-CD2 4.04Å; L8-L45 HydrophobicContact CD2-CB 4.23Å; L8-L45 HydrophobicContact CD2-CD2 3.56Å; L8-L45 WeakPolarHBondContact CD2-O 3.44Å; L8-L45 HydrophobicContact CG-CD2 3.82Å; L11-L45 HydrophobicContact CD1-CB 3.53Å; L11-L45 HydrophobicContact CD1-CD1 3.88Å; L11-L45 HydrophobicContact CD1-CG 4.28Å; N41-L45 WeakPolarHBondContact O-CG 3.19Å; N41-L45 PolarHBondContact O-N 3.32Å; Y42-L45 WeakPolarHBondContact O-CB 3.49Å; Y42-L45 PolarHBondContact O-N 3.38Å; L45-T48 PolarHBondContact O-N 2.85Å; L45-L49 WeakPolarHBondContact O-CG 2.88Å; L45-L49 PolarHBondContact O-N 2.98Å
46	L	95.7	Very high	92	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-45.8	174.4	-64.6	177.1	0	0	0	111.5	L15 Y42 P43 L44 T48 L49 L50 A62 T65 F66	L15-L46 HydrophobicContact CD1-CD2 4.23Å; Y42-L46 HydrophobicContact CD1-CD1 4.29Å; Y42-L46 HydrophobicContact CE1-CD1 3.63Å; Y42-L46 HydrophobicContact CE1-CG 4.36Å; Y42-L46 PolarHBondContact O-N 2.91Å; Y42-L46 VanDerWaalsContact O-N 3.17Å; P43-L46 WeakPolarHBondContact O-CB 3.5Å; P43-L46 PolarHBondContact O-N 3.43Å; L44-L46 VanDerWaalsContact C-N 3.35Å; L46-T48 VanDerWaalsContact C-N 3.3Å; L46-T48 PolarHBondContact O-N 3.36Å; L46-L49 WeakPolarHBondContact O-CB 3.39Å; L46-L49 PolarHBondContact O-N 2.98Å; L46-L50 WeakPolarHBondContact O-CG 3.35Å; L46-L50 PolarHBondContact O-N 3.03Å; L46-A62 HydrophobicContact CD2-CB 4.43Å; L46-T65 HydrophobicContact CD1-CG2 3.94Å; L46-T65 HydrophobicContact CD2-CG2 4.35Å; L46-F66 HydrophobicContact CB-CB 4.27Å; L46-F66 HydrophobicContact CB-CD2 4.34Å; L46-F66 HydrophobicContact CD1-CB 4.02Å; L46-F66 HydrophobicContact CD1-CD2 4.46Å
47	L	95.6	Very high	92	Very high	9 Å²	9	49.9 Å²	49.9	5%	0.047	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-38.3	175	-63.9	-176.3	0	0	0	112	P43 L44 L49 L50 E51 F66 I92 L99 L111	P43-L47 WeakPolarHBondContact O-CG 3.27Å; P43-L47 PolarHBondContact O-N 2.97Å; L44-L47 HydrophobicContact CD2-CD1 4.37Å; L44-L47 PolarHBondContact O-N 3.1Å; L47-L49 PolarHBondContact O-N 3.34Å; L47-L50 HydrophobicContact CD2-CD1 4.07Å; L47-L50 WeakPolarHBondContact O-CB 3.24Å; L47-L50 PolarHBondContact O-N 3.41Å; L47-E51 PolarHBondContact O-N 3.5Å; L47-E51 VanDerWaalsContact O-N 3.15Å; L47-F66 HydrophobicContact CD1-CE2 4.14Å; L47-F66 HydrophobicContact CD1-CZ 4.34Å; L47-F66 HydrophobicContact CD2-CD1 4.19Å; L47-F66 HydrophobicContact CD2-CD2 3.86Å; L47-F66 HydrophobicContact CD2-CE1 4.06Å; L47-F66 HydrophobicContact CD2-CE2 3.7Å; L47-F66 HydrophobicContact CD2-CG 4.1Å; L47-F66 HydrophobicContact CD2-CZ 3.82Å; L47-F66 HydrophobicContact CG-CD2 4.14Å; L47-F66 HydrophobicContact CG-CE2 3.83Å; L47-F66 HydrophobicContact CG-CZ 4.3Å; L47-I92 HydrophobicContact CD1-CG1 4.16Å; L47-L99 HydrophobicContact CB-CD2 4.09Å; L47-L99 HydrophobicContact CD2-CD2 3.84Å; L47-L99 HydrophobicContact CG-CD2 4.5Å; L47-L111 HydrophobicContact CD2-CD2 4.35Å
48	T	94.1	Very high	92.1	Very high	27 Å²	27	49.5 Å²	49.5	17%	0.166	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-36.9	176.3	-56.2	0	0	0	0	111.7	L8 L44 L45 L46 E51 K52	L8-T48 HydrophobicContact CD1-CG2 3.87Å; L8-T48 HydrophobicContact CD2-CG2 3.93Å; L44-T48 WeakPolarHBondContact O-CB 3.33Å; L44-T48 PolarHBondContact O-N 3.01Å; L44-T48 PolarHBondContact O-OG1 2.91Å; L45-T48 PolarHBondContact O-N 2.85Å; L46-T48 VanDerWaalsContact C-N 3.3Å; L46-T48 PolarHBondContact O-N 3.36Å; T48-E51 PolarHBondContact O-N 2.91Å; T48-K52 HydrophobicContact CG2-CD 3.74Å; T48-K52 HydrophobicContact CG2-CG 4.18Å; T48-K52 WeakPolarHBondContact O-CB 3.48Å; T48-K52 PolarHBondContact O-N 2.94Å
49	L	93.9	Very high	92.4	Very high	9 Å²	9	49.2 Å²	49.2	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-39.4	173.9	-74.7	177.1	0	0	0	111.9	L8 L11 T12 L15 L45 L46 L47 E51 S53 A62	L8-L49 HydrophobicContact CB-CD2 4Å; L8-L49 HydrophobicContact CD2-CD2 3.8Å; L8-L49 HydrophobicContact CD2-CG 3.75Å; L8-L49 HydrophobicContact CG-CD2 4.47Å; L11-L49 HydrophobicContact CB-CD1 3.85Å; T12-L49 VanDerWaalsContact OG1-CD2 3.28Å; T12-L49 WeakPolarHBondContact OG1-CD2 3.06Å; L15-L49 HydrophobicContact CD1-CD1 3.95Å; L45-L49 WeakPolarHBondContact O-CG 2.88Å; L45-L49 PolarHBondContact O-N 2.98Å; L46-L49 WeakPolarHBondContact O-CB 3.39Å; L46-L49 PolarHBondContact O-N 2.98Å; L47-L49 PolarHBondContact O-N 3.34Å; L49-E51 VanDerWaalsContact C-N 3.29Å; L49-E51 PolarHBondContact O-N 3.34Å; L49-S53 WeakPolarHBondContact O-CB 3.34Å; L49-S53 PolarHBondContact O-N 2.99Å; L49-A62 HydrophobicContact CB-CB 4.21Å
50	L	91.5	Very high	92.4	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-58.7	-43.7	174.3	-68.5	176.9	0	0	0	112.1	L46 L47 K59 A62 L99 I107 L111	L46-L50 WeakPolarHBondContact O-CG 3.35Å; L46-L50 PolarHBondContact O-N 3.03Å; L47-L50 HydrophobicContact CD2-CD1 4.07Å; L47-L50 WeakPolarHBondContact O-CB 3.24Å; L47-L50 PolarHBondContact O-N 3.41Å; L50-K59 HydrophobicContact CD2-CB 4.1Å; L50-K59 WeakPolarHBondContact CD2-O 3.41Å; L50-K59 VanDerWaalsContact O-CD 3.31Å; L50-K59 WeakPolarHBondContact O-CD 3.42Å; L50-K59 WeakPolarHBondContact O-CE 3.47Å; L50-K59 PolarHBondContact O-NZ 3.36Å; L50-A62 HydrophobicContact CD2-CB 3.83Å; L50-A62 HydrophobicContact CG-CB 4.05Å; L50-L99 HydrophobicContact CB-CD1 4.47Å; L50-L99 HydrophobicContact CB-CD2 3.93Å; L50-L99 HydrophobicContact CD1-CD2 3.91Å; L50-I107 HydrophobicContact CD2-CG2 4.18Å; L50-L111 HydrophobicContact CD1-CD1 4.26Å; L50-L111 HydrophobicContact CD1-CD2 3.86Å; L50-L111 HydrophobicContact CD1-CG 4.45Å
51	E	89.9	Confident	92.4	Very high	124 Å²	124	43 Å²	43	58%	0.579	22%	0.218	S	C	*	.	H	α-helix	trans	-73.3	-51.7	-178	-166.7	-178.9	-176.2	0	0	112	L47 T48 L49 L99	L47-E51 PolarHBondContact O-N 3.5Å; L47-E51 VanDerWaalsContact O-N 3.15Å; T48-E51 PolarHBondContact O-N 2.91Å; L49-E51 VanDerWaalsContact C-N 3.29Å; L49-E51 PolarHBondContact O-N 3.34Å; E51-L99 HydrophobicContact CB-CD1 3.86Å; E51-L99 HydrophobicContact CG-CD1 4.21Å
52	K	89.5	Confident	92.4	Very high	142 Å²	142	41.4 Å²	41.4	62%	0.617	21%	0.209	S	C	*	.	H	α-helix	trans	-93.2	-23.7	-167.4	-63.5	-172.4	-178.6	177.3	0	115.4	T48	T48-K52 HydrophobicContact CG2-CD 3.74Å; T48-K52 HydrophobicContact CG2-CG 4.18Å; T48-K52 WeakPolarHBondContact O-CB 3.48Å; T48-K52 PolarHBondContact O-N 2.94Å
53	S	88.2	Confident	92.4	Very high	22 Å²	22	41.3 Å²	41.3	15%	0.154	21%	0.209	C	C	.	.			trans	-61.5	141.5	-177.8	-178.6	0	0	0	0	110.5	L49 D55 K59	L49-S53 WeakPolarHBondContact O-CB 3.34Å; L49-S53 PolarHBondContact O-N 2.99Å; S53-D55 PolarHBondContact OG-N 3.31Å; S53-D55 PolarHBondContact OG-O 3.48Å; S53-K59 WeakPolarHBondContact O-CE 3.05Å; S53-K59 PolarHBondContact O-NZ 2.61Å
54	Q	87	Confident	92.3	Very high	196 Å²	196	43.5 Å²	43.5	92%	0.916	22%	0.222	S	C	*	.	S	Bend	trans	-89.1	-12.8	168.6	-63.8	-168	-5.6	0	0	112.2
55	D	90	Very high	92.2	Very high	53 Å²	53	43.7 Å²	43.7	28%	0.283	22%	0.224	S	C	.	.			trans	-90.5	108.1	-178.2	-173.9	-20.7	0	0	0	110.1	K16 S53 V57 I58 K59	K16-D55 WeakPolarHBondContact CE-OD2 3.3Å; K16-D55 IonicContact NZ-OD2 2.59Å; K16-D55 PolarHBondContact NZ-OD2 3.29Å; S53-D55 PolarHBondContact OG-N 3.31Å; S53-D55 PolarHBondContact OG-O 3.48Å; D55-V57 PolarHBondContact O-N 2.99Å; D55-V57 VanDerWaalsContact OD1-CB 3.32Å; D55-V57 WeakPolarHBondContact OD1-CB 3.39Å; D55-V57 PolarHBondContact OD1-N 3.32Å; D55-I58 HydrophobicContact CB-CB 4.07Å; D55-I58 HydrophobicContact CB-CG1 3.92Å; D55-I58 WeakPolarHBondContact O-CB 3.48Å; D55-I58 PolarHBondContact O-N 3.07Å; D55-I58 VanDerWaalsContact O-N 3.14Å; D55-I58 PolarHBondContact OD1-N 2.95Å; D55-K59 PolarHBondContact O-N 2.92Å
56	N	89.1	Confident	92.3	Very high	105 Å²	105	43.7 Å²	43.7	56%	0.561	22%	0.224	S	C	*	.	H	α-helix	trans	-60	-32.6	179.8	-82.1	-18.3	0	0	0	112.8	I58 K59 V60	N56-I58 VanDerWaalsContact C-N 3.32Å; N56-I58 PolarHBondContact O-N 3.38Å; N56-K59 PolarHBondContact O-N 2.96Å; N56-V60 WeakPolarHBondContact O-CG2 3.34Å; N56-V60 PolarHBondContact O-N 3.26Å
57	V	90.6	Very high	92.2	Very high	78 Å²	78	45.5 Å²	45.5	47%	0.473	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-44	177.7	178.3	0	0	0	0	109.4	L19 D55 K59 V60 C61	L19-V57 HydrophobicContact CD1-CG1 3.23Å; D55-V57 PolarHBondContact O-N 2.99Å; D55-V57 VanDerWaalsContact OD1-CB 3.32Å; D55-V57 WeakPolarHBondContact OD1-CB 3.39Å; D55-V57 PolarHBondContact OD1-N 3.32Å; V57-K59 VanDerWaalsContact C-N 3.31Å; V57-K59 PolarHBondContact O-N 2.83Å; V57-V60 PolarHBondContact O-N 2.75Å; V57-C61 PolarHBondContact O-N 3.23Å; V57-C61 PolarHBondContact O-SG 3.46Å
58	I	91.5	Very high	92.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-38.1	176	-66.4	-64.3	0	0	0	112	T12 L15 K16 D55 N56 C61 A62	T12-I58 HydrophobicContact CG2-CD1 3.95Å; T12-I58 HydrophobicContact CG2-CG1 4.01Å; T12-I58 HydrophobicContact CG2-CG2 4.26Å; L15-I58 HydrophobicContact CB-CD1 4.16Å; K16-I58 HydrophobicContact CB-CD1 4.48Å; K16-I58 HydrophobicContact CD-CD1 4.08Å; K16-I58 VanDerWaalsContact CE-CD1 3.47Å; K16-I58 VanDerWaalsContact CE-CG1 3.45Å; K16-I58 HydrophobicContact CG-CD1 3.33Å; K16-I58 HydrophobicContact CG-CG1 4.25Å; D55-I58 HydrophobicContact CB-CB 4.07Å; D55-I58 HydrophobicContact CB-CG1 3.92Å; D55-I58 WeakPolarHBondContact O-CB 3.48Å; D55-I58 PolarHBondContact O-N 3.07Å; D55-I58 VanDerWaalsContact O-N 3.14Å; D55-I58 PolarHBondContact OD1-N 2.95Å; N56-I58 VanDerWaalsContact C-N 3.32Å; N56-I58 PolarHBondContact O-N 3.38Å; I58-C61 PolarHBondContact O-N 3.01Å; I58-A62 VanDerWaalsContact O-CB 3.26Å; I58-A62 WeakPolarHBondContact O-CB 3.32Å; I58-A62 PolarHBondContact O-N 2.66Å
59	K	94.2	Very high	92.1	Very high	39 Å²	39	46.3 Å²	46.3	17%	0.17	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-48.5	174.4	-62.9	-171.5	179.5	-162.4	0	111.1	L50 S53 D55 N56 V57 C61 A62 S63 I107	L50-K59 HydrophobicContact CD2-CB 4.1Å; L50-K59 WeakPolarHBondContact CD2-O 3.41Å; L50-K59 VanDerWaalsContact O-CD 3.31Å; L50-K59 WeakPolarHBondContact O-CD 3.42Å; L50-K59 WeakPolarHBondContact O-CE 3.47Å; L50-K59 PolarHBondContact O-NZ 3.36Å; S53-K59 WeakPolarHBondContact O-CE 3.05Å; S53-K59 PolarHBondContact O-NZ 2.61Å; D55-K59 PolarHBondContact O-N 2.92Å; N56-K59 PolarHBondContact O-N 2.96Å; V57-K59 VanDerWaalsContact C-N 3.31Å; V57-K59 PolarHBondContact O-N 2.83Å; K59-C61 PolarHBondContact O-N 3.43Å; K59-A62 PolarHBondContact O-N 2.75Å; K59-S63 PolarHBondContact O-N 3.17Å; K59-S63 PolarHBondContact O-OG 3.49Å; K59-I107 HydrophobicContact CB-CD1 3.51Å; K59-I107 HydrophobicContact CB-CG1 4.43Å; K59-I107 HydrophobicContact CD-CD1 4.08Å; K59-I107 HydrophobicContact CG-CD1 4.45Å
60	V	91.5	Very high	92.1	Very high	30 Å²	30	45.9 Å²	45.9	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-59.2	-48.1	177.9	174.7	0	0	0	0	110.6	N56 V57 A62 S63 V64 Q106 I107	N56-V60 WeakPolarHBondContact O-CG2 3.34Å; N56-V60 PolarHBondContact O-N 3.26Å; V57-V60 PolarHBondContact O-N 2.75Å; V60-A62 PolarHBondContact O-N 2.85Å; V60-S63 PolarHBondContact O-N 3.36Å; V60-S63 VanDerWaalsContact O-N 3.15Å; V60-S63 PolarHBondContact O-OG 2.96Å; V60-V64 HydrophobicContact CG1-CG2 4.38Å; V60-V64 WeakPolarHBondContact O-CG2 3.29Å; V60-V64 PolarHBondContact O-N 3.01Å; V60-Q106 HydrophobicContact CG2-CG 4.38Å; V60-I107 HydrophobicContact CG2-CG1 4.3Å
61	C	91.9	Very high	92.1	Very high	13 Å²	13	51.3 Å²	51.3	9%	0.088	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-46.5	176.9	-67.4	0	0	0	0	112.8	L15 L19 V57 I58 K59 S63 V64 T65	L15-C61 HydrophobicContact CB-CB 4.24Å; L15-C61 HydrophobicContact CD2-CB 4.18Å; L19-C61 VanDerWaalsContact CD1-SG 3.52Å; V57-C61 PolarHBondContact O-N 3.23Å; V57-C61 PolarHBondContact O-SG 3.46Å; I58-C61 PolarHBondContact O-N 3.01Å; K59-C61 PolarHBondContact O-N 3.43Å; C61-S63 VanDerWaalsContact C-N 3.27Å; C61-S63 PolarHBondContact O-N 3.23Å; C61-V64 PolarHBondContact O-N 3.18Å; C61-T65 VanDerWaalsContact O-CB 3.29Å; C61-T65 WeakPolarHBondContact O-CB 3.23Å; C61-T65 PolarHBondContact O-N 3.12Å; C61-T65 PolarHBondContact O-OG1 3.35Å
62	A	94.8	Very high	92	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-38.2	177.5	0	0	0	0	0	111.3	L15 L46 L49 L50 I58 K59 V60 F66	L15-A62 HydrophobicContact CD1-CB 4.1Å; L46-A62 HydrophobicContact CD2-CB 4.43Å; L49-A62 HydrophobicContact CB-CB 4.21Å; L50-A62 HydrophobicContact CD2-CB 3.83Å; L50-A62 HydrophobicContact CG-CB 4.05Å; I58-A62 VanDerWaalsContact O-CB 3.26Å; I58-A62 WeakPolarHBondContact O-CB 3.32Å; I58-A62 PolarHBondContact O-N 2.66Å; K59-A62 PolarHBondContact O-N 2.75Å; V60-A62 PolarHBondContact O-N 2.85Å; A62-F66 WeakPolarHBondContact O-CB 3.48Å; A62-F66 PolarHBondContact O-N 3.26Å
63	S	94.9	Very high	92.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-70.5	-40	180	70.4	0	0	0	0	112.2	K59 V60 C61 K67 Q110	K59-S63 PolarHBondContact O-N 3.17Å; K59-S63 PolarHBondContact O-OG 3.49Å; V60-S63 PolarHBondContact O-N 3.36Å; V60-S63 VanDerWaalsContact O-N 3.15Å; V60-S63 PolarHBondContact O-OG 2.96Å; C61-S63 VanDerWaalsContact C-N 3.27Å; C61-S63 PolarHBondContact O-N 3.23Å; S63-K67 WeakPolarHBondContact O-CB 3.43Å; S63-K67 PolarHBondContact O-N 3.43Å; S63-Q110 WeakPolarHBondContact OG-CG 3.4Å
64	V	93.2	Very high	92.4	Very high	45 Å²	45	44.3 Å²	44.3	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-68.4	-46	176.5	173.6	0	0	0	0	110.3	V60 C61 F66 K67 N68 Q110	V60-V64 HydrophobicContact CG1-CG2 4.38Å; V60-V64 WeakPolarHBondContact O-CG2 3.29Å; V60-V64 PolarHBondContact O-N 3.01Å; C61-V64 PolarHBondContact O-N 3.18Å; V64-F66 VanDerWaalsContact C-N 3.34Å; V64-F66 PolarHBondContact O-N 2.96Å; V64-K67 PolarHBondContact O-N 2.95Å; V64-N68 WeakPolarHBondContact O-CB 3.5Å; V64-N68 VanDerWaalsContact O-CG 3.23Å; V64-N68 PolarHBondContact O-N 3.02Å; V64-N68 PolarHBondContact O-ND2 3.45Å; V64-Q110 HydrophobicContact CG2-CG 4.04Å
65	T	94.3	Very high	92.5	Very high	22 Å²	22	42.7 Å²	42.7	14%	0.135	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-43.8	176.1	-61.9	0	0	0	0	110.9	L15 Y42 L46 C61 N68 Y69	L15-T65 HydrophobicContact CD2-CG2 4.28Å; L15-T65 WeakPolarHBondContact CD2-OG1 3.37Å; Y42-T65 WeakPolarHBondContact OH-CG2 3.22Å; L46-T65 HydrophobicContact CD1-CG2 3.94Å; L46-T65 HydrophobicContact CD2-CG2 4.35Å; C61-T65 VanDerWaalsContact O-CB 3.29Å; C61-T65 WeakPolarHBondContact O-CB 3.23Å; C61-T65 PolarHBondContact O-N 3.12Å; C61-T65 PolarHBondContact O-OG1 3.35Å; T65-N68 PolarHBondContact O-N 3.16Å; T65-Y69 VanDerWaalsContact O-CB 3.25Å; T65-Y69 WeakPolarHBondContact O-CB 3.35Å; T65-Y69 PolarHBondContact O-N 3.33Å
66	F	96.3	Very high	92.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-50.6	175.5	177.7	-93.3	0	0	0	111.4	P43 L46 L47 A62 V64 N68 Y69 I70 I92 I96 L111 A114	P43-F66 HydrophobicContact CB-CD2 4.18Å; P43-F66 HydrophobicContact CB-CE2 3.87Å; L46-F66 HydrophobicContact CB-CB 4.27Å; L46-F66 HydrophobicContact CB-CD2 4.34Å; L46-F66 HydrophobicContact CD1-CB 4.02Å; L46-F66 HydrophobicContact CD1-CD2 4.46Å; L47-F66 HydrophobicContact CD1-CE2 4.14Å; L47-F66 HydrophobicContact CD1-CZ 4.34Å; L47-F66 HydrophobicContact CD2-CD1 4.19Å; L47-F66 HydrophobicContact CD2-CD2 3.86Å; L47-F66 HydrophobicContact CD2-CE1 4.06Å; L47-F66 HydrophobicContact CD2-CE2 3.7Å; L47-F66 HydrophobicContact CD2-CG 4.1Å; L47-F66 HydrophobicContact CD2-CZ 3.82Å; L47-F66 HydrophobicContact CG-CD2 4.14Å; L47-F66 HydrophobicContact CG-CE2 3.83Å; L47-F66 HydrophobicContact CG-CZ 4.3Å; A62-F66 WeakPolarHBondContact O-CB 3.48Å; A62-F66 PolarHBondContact O-N 3.26Å; V64-F66 VanDerWaalsContact C-N 3.34Å; V64-F66 PolarHBondContact O-N 2.96Å; F66-N68 VanDerWaalsContact C-N 3.32Å; F66-N68 PolarHBondContact O-N 2.75Å; F66-Y69 WeakPolarHBondContact O-CB 3.36Å; F66-Y69 PolarHBondContact O-N 3Å; F66-Y69 VanDerWaalsContact O-N 3.17Å; F66-I70 HydrophobicContact CD1-CG1 4.07Å; F66-I70 HydrophobicContact CD2-CG1 4.48Å; F66-I70 HydrophobicContact CE1-CD1 4.19Å; F66-I70 HydrophobicContact CE1-CG1 3.61Å; F66-I70 HydrophobicContact CE2-CD1 3.99Å; F66-I70 HydrophobicContact CE2-CG1 4.07Å; F66-I70 HydrophobicContact CG-CG1 4.47Å; F66-I70 HydrophobicContact CZ-CD1 3.66Å; F66-I70 HydrophobicContact CZ-CG1 3.61Å; F66-I70 VanDerWaalsContact O-CG1 3.28Å; F66-I70 WeakPolarHBondContact O-CG1 3.37Å; F66-I70 PolarHBondContact O-N 3.12Å; F66-I92 HydrophobicContact CE2-CD1 4.33Å; F66-I92 HydrophobicContact CE2-CG1 4.28Å; F66-I92 HydrophobicContact CE2-CG2 4.43Å; F66-I92 HydrophobicContact CZ-CG1 4.46Å; F66-I92 HydrophobicContact CZ-CG2 3.79Å; F66-I96 HydrophobicContact CE1-CD1 3.5Å; F66-I96 VanDerWaalsContact CE1-CD1 3.5Å; F66-I96 HydrophobicContact CE1-CG1 4.4Å; F66-I96 HydrophobicContact CZ-CD1 3.86Å; F66-L111 HydrophobicContact CD1-CD2 3.96Å; F66-L111 HydrophobicContact CE1-CD2 4.25Å; F66-A114 HydrophobicContact CD1-CB 4.04Å; F66-A114 HydrophobicContact CE1-CB 3.76Å
67	K	94.8	Very high	91.7	Very high	39 Å²	39	42.6 Å²	42.6	17%	0.17	21%	0.205	C	C	.	.	H	α-helix	trans	-56.3	-46.4	176.3	-179.9	-159.4	69.4	-173.6	0	111.8	S63 V64 Y69 I70 K71 D113 A114	S63-K67 WeakPolarHBondContact O-CB 3.43Å; S63-K67 PolarHBondContact O-N 3.43Å; V64-K67 PolarHBondContact O-N 2.95Å; K67-Y69 VanDerWaalsContact C-N 3.34Å; K67-Y69 PolarHBondContact O-N 3.4Å; K67-I70 PolarHBondContact O-N 3.19Å; K67-K71 WeakPolarHBondContact O-CB 3.27Å; K67-K71 PolarHBondContact O-N 3.39Å; K67-D113 HydrophobicContact CD-CB 3.74Å; K67-D113 HydrophobicContact CG-CB 4.08Å; K67-A114 HydrophobicContact CB-CB 4.32Å; K67-A114 HydrophobicContact CG-CB 4.41Å
68	N	92.2	Very high	90.8	Very high	52 Å²	52	46.6 Å²	46.6	28%	0.278	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-37	179.6	-70.6	-14	0	0	0	111.9	V64 T65 F66 K71 R72	V64-N68 WeakPolarHBondContact O-CB 3.5Å; V64-N68 VanDerWaalsContact O-CG 3.23Å; V64-N68 PolarHBondContact O-N 3.02Å; V64-N68 PolarHBondContact O-ND2 3.45Å; T65-N68 PolarHBondContact O-N 3.16Å; F66-N68 VanDerWaalsContact C-N 3.32Å; F66-N68 PolarHBondContact O-N 2.75Å; N68-K71 PolarHBondContact O-N 3.43Å; N68-R72 WeakPolarHBondContact O-CG 3.42Å; N68-R72 PolarHBondContact O-N 2.87Å; N68-R72 VanDerWaalsContact O-N 3.1Å
69	Y	94.1	Very high	89.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-47.5	172.7	172	-100.3	0	0	0	111.9	E37 Y42 P43 T65 F66 K67 R72 N73 K83 I84	E37-Y69 HydrophobicContact CB-CD2 3.79Å; E37-Y69 HydrophobicContact CB-CE2 3.76Å; E37-Y69 HydrophobicContact CG-CD2 4.17Å; E37-Y69 HydrophobicContact CG-CE2 4.07Å; E37-Y69 WeakPolarHBondContact O-CE2 3.35Å; E37-Y69 PolarHBondContact O-OH 2.93Å; Y42-Y69 HydrophobicContact CD1-CD2 4.11Å; Y42-Y69 AromaticContact CD1-CE2 3.95Å; Y42-Y69 HydrophobicContact CD1-CE2 3.95Å; Y42-Y69 HydrophobicContact CD1-CG 4.48Å; Y42-Y69 AromaticContact CE1-CD2 3.91Å; Y42-Y69 HydrophobicContact CE1-CD2 3.91Å; Y42-Y69 HydrophobicContact CE1-CE2 4.22Å; Y42-Y69 HydrophobicContact CE1-CG 4.21Å; P43-Y69 HydrophobicContact CB-CD1 4.15Å; P43-Y69 HydrophobicContact CB-CE1 3.7Å; P43-Y69 HydrophobicContact CG-CE1 3.84Å; T65-Y69 VanDerWaalsContact O-CB 3.25Å; T65-Y69 WeakPolarHBondContact O-CB 3.35Å; T65-Y69 PolarHBondContact O-N 3.33Å; F66-Y69 WeakPolarHBondContact O-CB 3.36Å; F66-Y69 PolarHBondContact O-N 3Å; F66-Y69 VanDerWaalsContact O-N 3.17Å; K67-Y69 VanDerWaalsContact C-N 3.34Å; K67-Y69 PolarHBondContact O-N 3.4Å; Y69-R72 PolarHBondContact O-N 3.45Å; Y69-N73 WeakPolarHBondContact CD2-ND2 3.4Å; Y69-N73 HydrophobicContact CE2-CB 4.31Å; Y69-N73 WeakPolarHBondContact CE2-ND2 3.29Å; Y69-N73 WeakPolarHBondContact O-CB 3.48Å; Y69-N73 PolarHBondContact O-N 2.96Å; Y69-N73 PolarHBondContact O-ND2 3.11Å; Y69-K83 PolarHBondContact OH-O 2.96Å; Y69-I84 HydrophobicContact CD1-CD1 4.39Å; Y69-I84 HydrophobicContact CE1-CD1 3.64Å; Y69-I84 HydrophobicContact CE1-CG1 3.92Å; Y69-I84 WeakPolarHBondContact OH-CG1 3.38Å
70	I	95.3	Very high	88.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.7	-46	175.8	-63.9	-63.9	0	0	0	110.4	F66 K67 R72 N73 W74 I84 I92 A114 I117 I118	F66-I70 HydrophobicContact CD1-CG1 4.07Å; F66-I70 HydrophobicContact CD2-CG1 4.48Å; F66-I70 HydrophobicContact CE1-CD1 4.19Å; F66-I70 HydrophobicContact CE1-CG1 3.61Å; F66-I70 HydrophobicContact CE2-CD1 3.99Å; F66-I70 HydrophobicContact CE2-CG1 4.07Å; F66-I70 HydrophobicContact CG-CG1 4.47Å; F66-I70 HydrophobicContact CZ-CD1 3.66Å; F66-I70 HydrophobicContact CZ-CG1 3.61Å; F66-I70 VanDerWaalsContact O-CG1 3.28Å; F66-I70 WeakPolarHBondContact O-CG1 3.37Å; F66-I70 PolarHBondContact O-N 3.12Å; K67-I70 PolarHBondContact O-N 3.19Å; I70-R72 PolarHBondContact O-N 3.28Å; I70-N73 PolarHBondContact O-N 2.77Å; I70-W74 HydrophobicContact CD1-CD2 4.43Å; I70-W74 HydrophobicContact CD1-CE3 3.38Å; I70-W74 HydrophobicContact CD1-CZ3 3.71Å; I70-W74 HydrophobicContact CG2-CB 3.9Å; I70-W74 HydrophobicContact CG2-CD2 4.46Å; I70-W74 HydrophobicContact CG2-CE3 4.35Å; I70-W74 HydrophobicContact CG2-CG 4.28Å; I70-W74 WeakPolarHBondContact O-CB 3.48Å; I70-W74 PolarHBondContact O-N 3.45Å; I70-I84 HydrophobicContact CD1-CD1 4.41Å; I70-I92 HydrophobicContact CD1-CD1 4.33Å; I70-A114 HydrophobicContact CG1-CB 4.44Å; I70-I117 HydrophobicContact CG2-CB 3.98Å; I70-I117 HydrophobicContact CG2-CG2 3.79Å; I70-I118 HydrophobicContact CD1-CD1 4.3Å; I70-I118 HydrophobicContact CG2-CD1 4.24Å; I70-I118 HydrophobicContact CG2-CG1 3.67Å
71	K	90.7	Very high	88.2	Confident	118 Å²	118	60.1 Å²	60.1	51%	0.513	29%	0.294	S	S	.	.	H	α-helix	trans	-55.6	-38.5	177.5	-170.6	178.2	175.2	-176.1	0	112.7	K67 N68 I117	K67-K71 WeakPolarHBondContact O-CB 3.27Å; K67-K71 PolarHBondContact O-N 3.39Å; N68-K71 PolarHBondContact O-N 3.43Å; K71-I117 HydrophobicContact CB-CD1 3.73Å; K71-I117 HydrophobicContact CG-CD1 4.11Å
72	R	88.1	Confident	87.8	Confident	122 Å²	122	63.5 Å²	63.5	46%	0.46	31%	0.31	S	S	.	.	H	α-helix	trans	-82.2	-41.3	-179.3	-70.5	-173.2	-59.9	-100.7	3.2	113.6	E37 N68 Y69 I70	E37-R72 IonicContact OE2-CZ 2.8Å; E37-R72 IonicContact OE2-NE 2.74Å; E37-R72 IonicContact OE2-NH2 3.41Å; E37-R72 PolarHBondContact OE2-NH2 3Å; N68-R72 WeakPolarHBondContact O-CG 3.42Å; N68-R72 PolarHBondContact O-N 2.87Å; N68-R72 VanDerWaalsContact O-N 3.1Å; Y69-R72 PolarHBondContact O-N 3.45Å; I70-R72 PolarHBondContact O-N 3.28Å
73	N	91.4	Very high	87.4	Confident	17 Å²	17	67 Å²	67	9%	0.091	33%	0.326	C	S	.	.	H	α-helix	trans	-116.2	-6.8	-161.4	-60.9	-55.3	0	0	0	114.1	E37 Y69 I70 K83 I84	E37-N73 PolarHBondContact OE1-ND2 3.32Å; E37-N73 VanDerWaalsContact OE1-ND2 3.15Å; Y69-N73 WeakPolarHBondContact CD2-ND2 3.4Å; Y69-N73 HydrophobicContact CE2-CB 4.31Å; Y69-N73 WeakPolarHBondContact CE2-ND2 3.29Å; Y69-N73 WeakPolarHBondContact O-CB 3.48Å; Y69-N73 PolarHBondContact O-N 2.96Å; Y69-N73 PolarHBondContact O-ND2 3.11Å; I70-N73 PolarHBondContact O-N 2.77Å; N73-K83 HydrophobicContact CB-CB 4.26Å; N73-K83 WeakPolarHBondContact OD1-CD 3.38Å; N73-I84 HydrophobicContact CB-CD1 3.99Å; N73-I84 HydrophobicContact CB-CG1 3.91Å
74	W	94	Very high	87.3	Confident	1 Å²	1	67 Å²	67	0%	0.004	33%	0.326	C	S	.	.	S	Bend	trans	-72.2	-46.1	-176.8	-165.9	-90.1	0	0	0	112.9	I70 I76 I84 R89 I92 K93 I117 I118 D122	I70-W74 HydrophobicContact CD1-CD2 4.43Å; I70-W74 HydrophobicContact CD1-CE3 3.38Å; I70-W74 HydrophobicContact CD1-CZ3 3.71Å; I70-W74 HydrophobicContact CG2-CB 3.9Å; I70-W74 HydrophobicContact CG2-CD2 4.46Å; I70-W74 HydrophobicContact CG2-CE3 4.35Å; I70-W74 HydrophobicContact CG2-CG 4.28Å; I70-W74 WeakPolarHBondContact O-CB 3.48Å; I70-W74 PolarHBondContact O-N 3.45Å; W74-I76 PolarHBondContact O-N 3.11Å; W74-I84 HydrophobicContact CE3-CD1 3.67Å; W74-I84 HydrophobicContact CZ3-CD1 4.34Å; W74-R89 HydrophobicContact CH2-CB 4.01Å; W74-R89 HydrophobicContact CH2-CG 4.01Å; W74-R89 HydrophobicContact CZ2-CB 4.43Å; W74-R89 HydrophobicContact CZ2-CG 4.35Å; W74-R89 HydrophobicContact CZ3-CG 4.22Å; W74-R89 VanDerWaalsContact O-CZ 3.27Å; W74-R89 PolarHBondContact O-NH1 3.32Å; W74-R89 PolarHBondContact O-NH2 3.33Å; W74-I92 HydrophobicContact CH2-CB 4.39Å; W74-I92 HydrophobicContact CH2-CG2 4.2Å; W74-I92 HydrophobicContact CZ3-CB 4.35Å; W74-I92 HydrophobicContact CZ3-CD1 3.77Å; W74-I92 HydrophobicContact CZ3-CG2 4.09Å; W74-K93 HydrophobicContact CH2-CG 4.32Å; W74-K93 HydrophobicContact CZ2-CD 4.41Å; W74-K93 HydrophobicContact CZ2-CG 4.4Å; W74-I117 HydrophobicContact CB-CG2 4.41Å; W74-I118 HydrophobicContact CD2-CB 4.35Å; W74-I118 HydrophobicContact CD2-CG1 3.64Å; W74-I118 HydrophobicContact CD2-CG2 4.39Å; W74-I118 HydrophobicContact CE3-CD1 4.3Å; W74-I118 HydrophobicContact CE3-CG1 3.86Å; W74-I118 HydrophobicContact CG-CG1 4.15Å; W74-I118 HydrophobicContact CH2-CD1 4.05Å; W74-I118 HydrophobicContact CH2-CG1 4.03Å; W74-I118 HydrophobicContact CH2-CG2 4Å; W74-I118 HydrophobicContact CZ2-CB 4.12Å; W74-I118 HydrophobicContact CZ2-CD1 4.36Å; W74-I118 HydrophobicContact CZ2-CG1 3.89Å; W74-I118 HydrophobicContact CZ2-CG2 3.3Å; W74-I118 HydrophobicContact CZ3-CD1 4.03Å; W74-I118 HydrophobicContact CZ3-CG1 4.03Å; W74-D122 WeakPolarHBondContact CZ2-OD2 3.07Å; W74-D122 PolarHBondContact NE1-OD1 2.86Å
75	R	89.2	Confident	87.2	Confident	163 Å²	163	66.9 Å²	66.9	62%	0.615	33%	0.327	S	S	*	.	S	Bend	trans	-65.9	128.8	174.4	-178.2	173.2	-178.4	-167.3	1.8	109.1	V77 E121	R75-V77 HydrophobicContact CG-CG2 4.31Å; R75-V77 PolarHBondContact O-N 3.3Å; R75-E121 HydrophobicContact CB-CG 4.22Å
76	I	84.8	Confident	87.1	Confident	97 Å²	97	71.6 Å²	71.6	50%	0.497	35%	0.347	S	S	.	.			trans	-83.4	104.5	173.2	-59.2	175.4	0	0	0	106.9	W74	W74-I76 PolarHBondContact O-N 3.11Å
77	V	77.7	Confident	86.9	Confident	59 Å²	59	74.3 Å²	74.3	36%	0.358	37%	0.37	S	S	.	.			trans	-87.8	128.8	173.7	-176.1	0	0	0	0	108.2	R75 E80	R75-V77 HydrophobicContact CG-CG2 4.31Å; R75-V77 PolarHBondContact O-N 3.3Å; V77-E80 HydrophobicContact CB-CB 4.2Å; V77-E80 HydrophobicContact CB-CG 4.14Å; V77-E80 HydrophobicContact CG1-CG 4.11Å; V77-E80 PolarHBondContact O-N 2.93Å
78	E	71.9	Confident	87	Confident	162 Å²	162	72.5 Å²	72.5	76%	0.757	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	139.4	174.4	-67.3	-172.2	178.2	0	0	110.4	E80	E78-E80 PolarHBondContact O-N 2.71Å
79	D	70.3	Confident	87.1	Confident	120 Å²	120	70.4 Å²	70.4	64%	0.642	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	-3.8	-176.1	-49.3	-41.3	0	0	0	116.5	K741	D79-K741 IonicContact OD1-NZ 3.77Å; D79-K741 PolarHBondContact OD1-NZ 3.15Å; D79-K741 WeakPolarHBondContact OD2-CD 3.35Å; D79-K741 VanDerWaalsContact OD2-CE 3.27Å; D79-K741 WeakPolarHBondContact OD2-CE 3.3Å; D79-K741 IonicContact OD2-NZ 2.72Å; D79-K741 PolarHBondContact OD2-NZ 3.18Å
80	E	75.8	Confident	87.2	Confident	126 Å²	126	74.3 Å²	74.3	59%	0.589	37%	0.374	S	S	*	.	S	Bend	trans	-97.2	145.8	169.7	-65.9	-170.1	-176.9	0	0	111.9	V77 E78 N82	V77-E80 HydrophobicContact CB-CB 4.2Å; V77-E80 HydrophobicContact CB-CG 4.14Å; V77-E80 HydrophobicContact CG1-CG 4.11Å; V77-E80 PolarHBondContact O-N 2.93Å; E78-E80 PolarHBondContact O-N 2.71Å; E80-N82 PolarHBondContact O-N 3.39Å
81	P	77	Confident	87.2	Confident	107 Å²	107	75.5 Å²	75.5	70%	0.695	38%	0.383	S	S	*	.			trans	-67.3	121.3	176.5	27	-32.7	0	0	0	110.6	K83	P81-K83 PolarHBondContact O-N 3.46Å
82	N	83.1	Confident	87.4	Confident	83 Å²	83	69.9 Å²	69.9	44%	0.444	36%	0.359	S	S	.	.			trans	-65.2	109.3	173.8	179.4	19.7	0	0	0	110.3	E80 I84 R89	E80-N82 PolarHBondContact O-N 3.39Å; N82-I84 PolarHBondContact ND2-O 3.27Å; N82-I84 VanDerWaalsContact ND2-O 3.07Å; N82-I84 PolarHBondContact OD1-N 3.01Å; N82-I84 PolarHBondContact OD1-O 3.27Å; N82-I84 VanDerWaalsContact OD1-O 3.05Å; N82-R89 PolarHBondContact OD1-NH2 3.36Å
83	K	86.8	Confident	87.8	Confident	75 Å²	75	64.9 Å²	64.9	33%	0.326	34%	0.341	S	S	.	.			trans	-85.2	-10.6	-178.1	-59.2	-163.3	-159.2	173.5	0	114.5	E37 Y69 N73 P81	E37-K83 HydrophobicContact CG-CD 4.23Å; E37-K83 IonicContact OE1-NZ 2.84Å; E37-K83 PolarHBondContact OE1-NZ 3.4Å; Y69-K83 PolarHBondContact OH-O 2.96Å; N73-K83 HydrophobicContact CB-CB 4.26Å; N73-K83 WeakPolarHBondContact OD1-CD 3.38Å; P81-K83 PolarHBondContact O-N 3.46Å
84	I	91.8	Very high	87.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.363	C	S	.	.	S	Bend	trans	-113	110.9	178.9	-40.2	-170.7	0	0	0	109.1	Y69 I70 N73 W74 N82 D88 R89 I92	Y69-I84 HydrophobicContact CD1-CD1 4.39Å; Y69-I84 HydrophobicContact CE1-CD1 3.64Å; Y69-I84 HydrophobicContact CE1-CG1 3.92Å; Y69-I84 WeakPolarHBondContact OH-CG1 3.38Å; I70-I84 HydrophobicContact CD1-CD1 4.41Å; N73-I84 HydrophobicContact CB-CD1 3.99Å; N73-I84 HydrophobicContact CB-CG1 3.91Å; W74-I84 HydrophobicContact CE3-CD1 3.67Å; W74-I84 HydrophobicContact CZ3-CD1 4.34Å; N82-I84 PolarHBondContact ND2-O 3.27Å; N82-I84 VanDerWaalsContact ND2-O 3.07Å; N82-I84 PolarHBondContact OD1-N 3.01Å; N82-I84 PolarHBondContact OD1-O 3.27Å; N82-I84 VanDerWaalsContact OD1-O 3.05Å; I84-D88 HydrophobicContact CG2-CB 3.93Å; I84-R89 HydrophobicContact CB-CG 4.28Å; I84-R89 HydrophobicContact CG2-CG 3.67Å; I84-R89 PolarHBondContact O-NE 3.11Å; I84-I92 HydrophobicContact CG2-CD1 4.47Å
85	C	91.4	Very high	87.7	Confident	42 Å²	42	71.3 Å²	71.3	28%	0.284	38%	0.384	S	S	.	.			trans	-70	158.1	177.5	77.4	0	0	0	0	111.4	A87 D88 R89	C85-A87 VanDerWaalsContact C-N 3.28Å; C85-A87 PolarHBondContact O-N 3.06Å; C85-D88 PolarHBondContact O-N 3.11Å; C85-D88 VanDerWaalsContact O-N 3.13Å; C85-D88 VanDerWaalsContact SG-CG 3.5Å; C85-D88 PolarHBondContact SG-N 3.41Å; C85-R89 PolarHBondContact O-N 3.41Å; C85-R89 VanDerWaalsContact O-N 3.08Å
86	E	92.1	Very high	87.9	Confident	120 Å²	120	63.6 Å²	63.6	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-61.2	-36.8	-176.1	-171.5	56.9	-153.5	0	0	112.7	D88 R89 V90	E86-D88 VanDerWaalsContact C-N 3.33Å; E86-D88 PolarHBondContact O-N 3.06Å; E86-R89 PolarHBondContact O-N 3.33Å; E86-V90 WeakPolarHBondContact O-CG2 3.11Å; E86-V90 PolarHBondContact O-N 3.07Å
87	A	93.1	Very high	88.1	Confident	58 Å²	58	59 Å²	59	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-41.5	176.4	0	0	0	0	0	112.2	C85 A91	C85-A87 VanDerWaalsContact C-N 3.28Å; C85-A87 PolarHBondContact O-N 3.06Å; A87-A91 WeakPolarHBondContact O-CB 3.24Å; A87-A91 PolarHBondContact O-N 3.33Å
88	D	95.6	Very high	88.7	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-40	176.7	-73.5	-12.1	0	0	0	111.1	Q40 N41 P43 I84 C85 E86 V90 A91 I92	Q40-D88 WeakPolarHBondContact CA-OD2 3.36Å; N41-D88 WeakPolarHBondContact CA-OD1 3.5Å; N41-D88 VanDerWaalsContact N-CG 3.34Å; N41-D88 PolarHBondContact N-OD1 2.58Å; N41-D88 VanDerWaalsContact N-OD1 3.12Å; N41-D88 PolarHBondContact N-OD2 2.94Å; N41-D88 PolarHBondContact OD1-OD1 3.38Å; P43-D88 HydrophobicContact CG-CB 4.07Å; I84-D88 HydrophobicContact CG2-CB 3.93Å; C85-D88 PolarHBondContact O-N 3.11Å; C85-D88 VanDerWaalsContact O-N 3.13Å; C85-D88 VanDerWaalsContact SG-CG 3.5Å; C85-D88 PolarHBondContact SG-N 3.41Å; E86-D88 VanDerWaalsContact C-N 3.33Å; E86-D88 PolarHBondContact O-N 3.06Å; D88-V90 PolarHBondContact O-N 3.24Å; D88-A91 PolarHBondContact O-N 2.91Å; D88-I92 WeakPolarHBondContact O-CB 3.5Å; D88-I92 VanDerWaalsContact O-CD1 3.3Å; D88-I92 WeakPolarHBondContact O-CD1 3.34Å; D88-I92 WeakPolarHBondContact O-CG1 3.31Å; D88-I92 PolarHBondContact O-N 3.42Å
89	R	95.9	Very high	89.6	Confident	8 Å²	8	53.7 Å²	53.7	3%	0.03	30%	0.303	C	S	.	.	H	α-helix	trans	-59.3	-47.1	176.4	-69.3	179	177.9	-93	-0.9	111.8	W74 N82 I84 C85 E86 K93	W74-R89 HydrophobicContact CH2-CB 4.01Å; W74-R89 HydrophobicContact CH2-CG 4.01Å; W74-R89 HydrophobicContact CZ2-CB 4.43Å; W74-R89 HydrophobicContact CZ2-CG 4.35Å; W74-R89 HydrophobicContact CZ3-CG 4.22Å; W74-R89 VanDerWaalsContact O-CZ 3.27Å; W74-R89 PolarHBondContact O-NH1 3.32Å; W74-R89 PolarHBondContact O-NH2 3.33Å; N82-R89 PolarHBondContact OD1-NH2 3.36Å; I84-R89 HydrophobicContact CB-CG 4.28Å; I84-R89 HydrophobicContact CG2-CG 3.67Å; I84-R89 PolarHBondContact O-NE 3.11Å; C85-R89 PolarHBondContact O-N 3.41Å; C85-R89 VanDerWaalsContact O-N 3.08Å; E86-R89 PolarHBondContact O-N 3.33Å; R89-K93 WeakPolarHBondContact O-CE 3.2Å; R89-K93 WeakPolarHBondContact O-CG 3.42Å; R89-K93 PolarHBondContact O-N 2.86Å; R89-K93 VanDerWaalsContact O-N 3.1Å
90	V	95.1	Very high	90.6	Very high	82 Å²	82	48 Å²	48	50%	0.497	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-47.4	177.3	173.3	0	0	0	0	110.7	E86 D88 I92 K93 A94	E86-V90 WeakPolarHBondContact O-CG2 3.11Å; E86-V90 PolarHBondContact O-N 3.07Å; D88-V90 PolarHBondContact O-N 3.24Å; V90-I92 PolarHBondContact O-N 2.95Å; V90-K93 PolarHBondContact O-N 3.15Å; V90-A94 WeakPolarHBondContact O-CB 3.47Å; V90-A94 PolarHBondContact O-N 3.08Å
91	A	94.9	Very high	91.1	Very high	25 Å²	25	42.4 Å²	42.4	21%	0.207	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-36.8	-179.4	0	0	0	0	0	113.1	L44 A87 D88 A94 N95	L44-A91 HydrophobicContact CD1-CB 3.71Å; L44-A91 HydrophobicContact CD2-CB 3.59Å; L44-A91 HydrophobicContact CG-CB 4.27Å; A87-A91 WeakPolarHBondContact O-CB 3.24Å; A87-A91 PolarHBondContact O-N 3.33Å; D88-A91 PolarHBondContact O-N 2.91Å; A91-A94 PolarHBondContact O-N 3.38Å; A91-N95 PolarHBondContact O-N 3.48Å; A91-N95 PolarHBondContact O-ND2 3.25Å
92	I	96.3	Very high	91.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-51.8	173.7	-71.4	159.9	0	0	0	109.8	P43 L44 L47 F66 I70 W74 I84 D88 V90 A94 N95 I96 I118	P43-I92 HydrophobicContact CB-CD1 3.63Å; P43-I92 HydrophobicContact CB-CG1 4.21Å; P43-I92 HydrophobicContact CG-CD1 3.73Å; P43-I92 HydrophobicContact CG-CG1 4.49Å; L44-I92 HydrophobicContact CD2-CG1 3.96Å; L47-I92 HydrophobicContact CD1-CG1 4.16Å; F66-I92 HydrophobicContact CE2-CD1 4.33Å; F66-I92 HydrophobicContact CE2-CG1 4.28Å; F66-I92 HydrophobicContact CE2-CG2 4.43Å; F66-I92 HydrophobicContact CZ-CG1 4.46Å; F66-I92 HydrophobicContact CZ-CG2 3.79Å; I70-I92 HydrophobicContact CD1-CD1 4.33Å; W74-I92 HydrophobicContact CH2-CB 4.39Å; W74-I92 HydrophobicContact CH2-CG2 4.2Å; W74-I92 HydrophobicContact CZ3-CB 4.35Å; W74-I92 HydrophobicContact CZ3-CD1 3.77Å; W74-I92 HydrophobicContact CZ3-CG2 4.09Å; I84-I92 HydrophobicContact CG2-CD1 4.47Å; D88-I92 WeakPolarHBondContact O-CB 3.5Å; D88-I92 VanDerWaalsContact O-CD1 3.3Å; D88-I92 WeakPolarHBondContact O-CD1 3.34Å; D88-I92 WeakPolarHBondContact O-CG1 3.31Å; D88-I92 PolarHBondContact O-N 3.42Å; V90-I92 PolarHBondContact O-N 2.95Å; I92-A94 PolarHBondContact O-N 3.14Å; I92-N95 PolarHBondContact O-N 3.5Å; I92-N95 VanDerWaalsContact O-N 3.1Å; I92-I96 HydrophobicContact CG2-CB 4.34Å; I92-I96 HydrophobicContact CG2-CD1 4.32Å; I92-I96 HydrophobicContact CG2-CG2 4.49Å; I92-I96 VanDerWaalsContact O-CB 3.28Å; I92-I96 WeakPolarHBondContact O-CB 3.49Å; I92-I96 VanDerWaalsContact O-CG2 3.26Å; I92-I96 WeakPolarHBondContact O-CG2 3.42Å; I92-I96 PolarHBondContact O-N 3.06Å; I92-I118 HydrophobicContact CG2-CD1 3.83Å
93	K	94.9	Very high	91.9	Very high	17 Å²	17	37.3 Å²	37.3	7%	0.074	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-35	179.8	-76.1	-175.7	-70.2	-164.5	0	112.6	W74 R89 V90 I118 D122 K126 W127	W74-K93 HydrophobicContact CH2-CG 4.32Å; W74-K93 HydrophobicContact CZ2-CD 4.41Å; W74-K93 HydrophobicContact CZ2-CG 4.4Å; R89-K93 WeakPolarHBondContact O-CE 3.2Å; R89-K93 WeakPolarHBondContact O-CG 3.42Å; R89-K93 PolarHBondContact O-N 2.86Å; R89-K93 VanDerWaalsContact O-N 3.1Å; V90-K93 PolarHBondContact O-N 3.15Å; K93-I118 HydrophobicContact CG-CG2 4.3Å; K93-D122 IonicContact NZ-OD2 2.89Å; K93-D122 PolarHBondContact NZ-OD2 3.49Å; K93-K126 PolarHBondContact NZ-O 3.12Å; K93-W127 HydrophobicContact CB-CD2 4.23Å; K93-W127 HydrophobicContact CB-CG 4.41Å; K93-W127 HydrophobicContact CB-CZ2 4.06Å; K93-W127 HydrophobicContact CD-CB 3.86Å; K93-W127 HydrophobicContact CD-CD2 3.73Å; K93-W127 HydrophobicContact CD-CE3 4.24Å; K93-W127 HydrophobicContact CD-CG 3.58Å; K93-W127 HydrophobicContact CG-CD2 3.72Å; K93-W127 HydrophobicContact CG-CE3 4.16Å; K93-W127 HydrophobicContact CG-CG 4.05Å; K93-W127 HydrophobicContact CG-CH2 4.43Å; K93-W127 HydrophobicContact CG-CZ2 4.03Å
94	A	92	Very high	91.8	Very high	67 Å²	67	37 Å²	37	55%	0.554	23%	0.226	S	C	*	.	H	α-helix	trans	-72.5	-21.6	178.3	0	0	0	0	0	114.8	V90 A91 I92	V90-A94 WeakPolarHBondContact O-CB 3.47Å; V90-A94 PolarHBondContact O-N 3.08Å; A91-A94 PolarHBondContact O-N 3.38Å; I92-A94 PolarHBondContact O-N 3.14Å
95	N	92.4	Very high	91.4	Very high	86 Å²	86	42.7 Å²	42.7	46%	0.46	25%	0.253	S	S	.	.	H	α-helix	trans	-118.2	-29	-171.4	-68.6	-70.3	0	0	0	114.3	A91 I92 V97 H98 L99	A91-N95 PolarHBondContact O-N 3.48Å; A91-N95 PolarHBondContact O-ND2 3.25Å; I92-N95 PolarHBondContact O-N 3.5Å; I92-N95 VanDerWaalsContact O-N 3.1Å; N95-V97 PolarHBondContact O-N 3.38Å; N95-H98 PolarHBondContact O-N 2.86Å; N95-L99 WeakPolarHBondContact O-CB 3.5Å; N95-L99 PolarHBondContact O-N 3.44Å
96	I	93.2	Very high	91	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-38.1	-167.4	-167.9	174.4	0	0	0	113.3	F66 I92 M100 L111 A114 I115 I118 W127	F66-I96 HydrophobicContact CE1-CD1 3.5Å; F66-I96 VanDerWaalsContact CE1-CD1 3.5Å; F66-I96 HydrophobicContact CE1-CG1 4.4Å; F66-I96 HydrophobicContact CZ-CD1 3.86Å; I92-I96 HydrophobicContact CG2-CB 4.34Å; I92-I96 HydrophobicContact CG2-CD1 4.32Å; I92-I96 HydrophobicContact CG2-CG2 4.49Å; I92-I96 VanDerWaalsContact O-CB 3.28Å; I92-I96 WeakPolarHBondContact O-CB 3.49Å; I92-I96 VanDerWaalsContact O-CG2 3.26Å; I92-I96 WeakPolarHBondContact O-CG2 3.42Å; I92-I96 PolarHBondContact O-N 3.06Å; I96-M100 VanDerWaalsContact O-CB 3.25Å; I96-M100 WeakPolarHBondContact O-CB 3.15Å; I96-M100 PolarHBondContact O-N 2.97Å; I96-L111 HydrophobicContact CG1-CD2 4.35Å; I96-A114 HydrophobicContact CD1-CB 4.2Å; I96-I115 HydrophobicContact CD1-CD1 4.47Å; I96-I115 HydrophobicContact CD1-CG1 3.65Å; I96-I115 HydrophobicContact CG1-CD1 4.19Å; I96-I115 HydrophobicContact CG1-CG1 3.87Å; I96-I115 HydrophobicContact CG2-CD1 4.42Å; I96-I115 HydrophobicContact CG2-CG1 3.98Å; I96-I118 HydrophobicContact CD1-CD1 3.89Å; I96-W127 HydrophobicContact CG2-CH2 3.7Å; I96-W127 HydrophobicContact CG2-CZ2 3.83Å
97	V	89.5	Confident	90.9	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-50.1	-179.4	177.9	0	0	0	0	109.9	N95 L99 M100 L101 I115 W127 L130 E133	N95-V97 PolarHBondContact O-N 3.38Å; V97-L99 VanDerWaalsContact C-N 3.33Å; V97-L99 PolarHBondContact O-N 3.14Å; V97-M100 WeakPolarHBondContact O-CB 3.35Å; V97-M100 PolarHBondContact O-N 3.42Å; V97-L101 HydrophobicContact CG1-CD1 4Å; V97-L101 VanDerWaalsContact O-CG 3.27Å; V97-L101 WeakPolarHBondContact O-CG 3.47Å; V97-L101 PolarHBondContact O-N 3.36Å; V97-I115 HydrophobicContact CG2-CD1 4.28Å; V97-W127 HydrophobicContact CG2-CH2 4.3Å; V97-W127 HydrophobicContact CG2-CZ2 3.89Å; V97-L130 HydrophobicContact CG2-CD1 3.69Å; V97-E133 HydrophobicContact CG1-CG 4.16Å
98	H	89.1	Confident	90.6	Very high	96 Å²	96	38.7 Å²	38.7	44%	0.444	22%	0.22	S	C	.	.	H	α-helix	trans	-57.9	-46	176.8	-179.7	58	0	0	0	112.1	N95 M100 L101 S102	N95-H98 PolarHBondContact O-N 2.86Å; H98-M100 PolarHBondContact O-N 2.92Å; H98-L101 PolarHBondContact O-N 3.4Å; H98-S102 PolarHBondContact O-N 3.46Å; H98-S102 PolarHBondContact O-OG 2.94Å
99	L	91.7	Very high	90.1	Very high	13 Å²	13	45.2 Å²	45.2	7%	0.068	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-40.4	178.7	-175.1	65.6	0	0	0	112.3	L47 L50 E51 N95 V97 L101 S102 S103 L111	L47-L99 HydrophobicContact CB-CD2 4.09Å; L47-L99 HydrophobicContact CD2-CD2 3.84Å; L47-L99 HydrophobicContact CG-CD2 4.5Å; L50-L99 HydrophobicContact CB-CD1 4.47Å; L50-L99 HydrophobicContact CB-CD2 3.93Å; L50-L99 HydrophobicContact CD1-CD2 3.91Å; E51-L99 HydrophobicContact CB-CD1 3.86Å; E51-L99 HydrophobicContact CG-CD1 4.21Å; N95-L99 WeakPolarHBondContact O-CB 3.5Å; N95-L99 PolarHBondContact O-N 3.44Å; V97-L99 VanDerWaalsContact C-N 3.33Å; V97-L99 PolarHBondContact O-N 3.14Å; L99-L101 VanDerWaalsContact C-N 3.32Å; L99-L101 PolarHBondContact O-N 2.96Å; L99-S102 PolarHBondContact O-N 2.97Å; L99-S102 PolarHBondContact O-OG 3.06Å; L99-S103 VanDerWaalsContact O-CB 3.26Å; L99-S103 WeakPolarHBondContact O-CB 3.28Å; L99-S103 PolarHBondContact O-N 3.17Å; L99-S103 VanDerWaalsContact O-N 3.12Å; L99-S103 PolarHBondContact O-OG 3.33Å; L99-L111 HydrophobicContact CD2-CD1 4.23Å; L99-L111 HydrophobicContact CG-CD1 4.08Å
100	M	90.2	Very high	89.9	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-43.8	174.8	178.6	-160.3	77.2	0	0	111.2	I96 V97 H98 S103 Q108 L111 I115 T152	I96-M100 VanDerWaalsContact O-CB 3.25Å; I96-M100 WeakPolarHBondContact O-CB 3.15Å; I96-M100 PolarHBondContact O-N 2.97Å; V97-M100 WeakPolarHBondContact O-CB 3.35Å; V97-M100 PolarHBondContact O-N 3.42Å; H98-M100 PolarHBondContact O-N 2.92Å; M100-S103 PolarHBondContact O-N 3.08Å; M100-Q108 HydrophobicContact CG-CB 4.41Å; M100-Q108 HydrophobicContact CG-CG 3.72Å; M100-Q108 HydrophobicContact SD-CG 4.49Å; M100-L111 HydrophobicContact CB-CB 3.82Å; M100-L111 HydrophobicContact CB-CD1 4.02Å; M100-L111 HydrophobicContact CG-CB 3.89Å; M100-I115 HydrophobicContact CB-CD1 4.19Å; M100-I115 HydrophobicContact CE-CD1 4.37Å; M100-I115 HydrophobicContact CG-CD1 4.34Å; M100-I115 HydrophobicContact SD-CD1 3.44Å; M100-I115 WeakPolarHBondContact SD-CD1 3.5Å; M100-T152 WeakPolarHBondContact CE-OG1 3.5Å; M100-T152 PolarHBondContact SD-OG1 3.01Å
101	L	86.7	Confident	89.7	Confident	7 Å²	7	42.3 Å²	42.3	4%	0.037	23%	0.23	C	C	.	.	H	α-helix	trans	-72.5	-29.4	-177	-64.1	173.6	0	0	0	113.2	V97 H98 L99 R137 V145 V149	V97-L101 HydrophobicContact CG1-CD1 4Å; V97-L101 VanDerWaalsContact O-CG 3.27Å; V97-L101 WeakPolarHBondContact O-CG 3.47Å; V97-L101 PolarHBondContact O-N 3.36Å; H98-L101 PolarHBondContact O-N 3.4Å; L99-L101 VanDerWaalsContact C-N 3.32Å; L99-L101 PolarHBondContact O-N 2.96Å; L101-R137 HydrophobicContact CD1-CB 4.35Å; L101-R137 HydrophobicContact CD1-CG 3.69Å; L101-V145 HydrophobicContact CB-CG1 4.45Å; L101-V145 HydrophobicContact CD1-CG1 4.15Å; L101-V145 HydrophobicContact CD2-CG1 4.12Å; L101-V145 WeakPolarHBondContact CD2-O 3.33Å; L101-V145 HydrophobicContact CG-CG1 4.46Å; L101-V149 HydrophobicContact CD1-CG2 4.25Å; L101-V149 HydrophobicContact CD2-CG2 3.8Å
102	S	87.5	Confident	89.3	Confident	76 Å²	76	41.4 Å²	41.4	53%	0.531	22%	0.222	S	C	.	.	H	α-helix	trans	-86.5	-6.1	174.8	62.5	0	0	0	0	113.9	H98 L99	H98-S102 PolarHBondContact O-N 3.46Å; H98-S102 PolarHBondContact O-OG 2.94Å; L99-S102 PolarHBondContact O-N 2.97Å; L99-S102 PolarHBondContact O-OG 3.06Å
103	S	89.6	Confident	88.9	Confident	8 Å²	8	44.2 Å²	44.2	6%	0.056	24%	0.237	C	C	.	.	S	Bend	trans	-87	154.1	-177.2	-72.3	0	0	0	0	113.6	L99 M100 I107 H144	L99-S103 VanDerWaalsContact O-CB 3.26Å; L99-S103 WeakPolarHBondContact O-CB 3.28Å; L99-S103 PolarHBondContact O-N 3.17Å; L99-S103 VanDerWaalsContact O-N 3.12Å; L99-S103 PolarHBondContact O-OG 3.33Å; M100-S103 PolarHBondContact O-N 3.08Å; S103-I107 WeakPolarHBondContact OG-CG2 3.43Å; S103-H144 PolarHBondContact O-NE2 2.99Å
104	P	85.5	Confident	88.8	Confident	69 Å²	69	43.4 Å²	43.4	45%	0.448	23%	0.233	S	C	.	.			trans	-58.4	155	166.2	-21.9	31.7	0	0	0	112.9	Q106 I107 Q108	P104-Q106 VanDerWaalsContact C-N 3.31Å; P104-Q106 PolarHBondContact O-N 3.08Å; P104-Q106 VanDerWaalsContact O-N 3.13Å; P104-I107 HydrophobicContact CG-CD1 4.34Å; P104-I107 PolarHBondContact O-N 2.93Å; P104-Q108 WeakPolarHBondContact O-CB 3.31Å; P104-Q108 PolarHBondContact O-N 2.96Å
105	E	82	Confident	88.8	Confident	119 Å²	119	40.2 Å²	40.2	56%	0.556	21%	0.207	S	C	*	.	H	α-helix	trans	-51.3	-41.5	-172.8	-174.3	172.3	-157.8	0	0	114.3	I107 Q108 K109 R151	E105-I107 PolarHBondContact O-N 3.41Å; E105-Q108 WeakPolarHBondContact O-CB 3.43Å; E105-Q108 PolarHBondContact O-N 3.04Å; E105-K109 PolarHBondContact O-N 3.45Å; E105-R151 IonicContact OE1-NH2 3.86Å; E105-R151 PolarHBondContact OE1-NH2 3.48Å
106	Q	84.8	Confident	88.6	Confident	124 Å²	124	37.1 Å²	37.1	58%	0.579	19%	0.192	S	C	*	.	H	α-helix	trans	-62.7	-42	179.9	-171.9	179.6	10.7	0	0	112.5	V60 P104 Q110	V60-Q106 HydrophobicContact CG2-CG 4.38Å; P104-Q106 VanDerWaalsContact C-N 3.31Å; P104-Q106 PolarHBondContact O-N 3.08Å; P104-Q106 VanDerWaalsContact O-N 3.13Å; Q106-Q110 PolarHBondContact O-N 3.04Å
107	I	89.6	Confident	88.4	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-75.6	-39.5	178.5	-67.3	159.1	0	0	0	109.6	L50 K59 V60 S103 P104 E105 K109 Q110 L111	L50-I107 HydrophobicContact CD2-CG2 4.18Å; K59-I107 HydrophobicContact CB-CD1 3.51Å; K59-I107 HydrophobicContact CB-CG1 4.43Å; K59-I107 HydrophobicContact CD-CD1 4.08Å; K59-I107 HydrophobicContact CG-CD1 4.45Å; V60-I107 HydrophobicContact CG2-CG1 4.3Å; S103-I107 WeakPolarHBondContact OG-CG2 3.43Å; P104-I107 HydrophobicContact CG-CD1 4.34Å; P104-I107 PolarHBondContact O-N 2.93Å; E105-I107 PolarHBondContact O-N 3.41Å; I107-K109 VanDerWaalsContact C-N 3.26Å; I107-K109 PolarHBondContact O-N 3.33Å; I107-Q110 PolarHBondContact O-N 2.83Å; I107-Q110 VanDerWaalsContact O-N 3.11Å; I107-L111 HydrophobicContact CG2-CD1 3.87Å; I107-L111 HydrophobicContact CG2-CG 4.17Å; I107-L111 WeakPolarHBondContact O-CG 3.27Å; I107-L111 PolarHBondContact O-N 2.99Å
108	Q	86.8	Confident	88.7	Confident	7 Å²	7	39.1 Å²	39.1	3%	0.033	20%	0.202	C	C	.	.	H	α-helix	trans	-53.3	-44.6	174.4	-171.9	-176.3	54.7	0	0	111	M100 P104 E105 L111 S112 H144	M100-Q108 HydrophobicContact CG-CB 4.41Å; M100-Q108 HydrophobicContact CG-CG 3.72Å; M100-Q108 HydrophobicContact SD-CG 4.49Å; P104-Q108 WeakPolarHBondContact O-CB 3.31Å; P104-Q108 PolarHBondContact O-N 2.96Å; E105-Q108 WeakPolarHBondContact O-CB 3.43Å; E105-Q108 PolarHBondContact O-N 3.04Å; Q108-L111 PolarHBondContact O-N 2.9Å; Q108-S112 VanDerWaalsContact O-CB 3.25Å; Q108-S112 WeakPolarHBondContact O-CB 3.31Å; Q108-S112 PolarHBondContact O-N 3.05Å; Q108-H144 PolarHBondContact NE2-O 3.27Å
109	K	85	Confident	88.7	Confident	138 Å²	138	34.6 Å²	34.6	60%	0.6	18%	0.181	S	C	*	.	H	α-helix	trans	-60.4	-46.8	175.8	-171.8	177.3	-179.5	178.8	0	112.6	E105 I107 L111 S112 D113	E105-K109 PolarHBondContact O-N 3.45Å; I107-K109 VanDerWaalsContact C-N 3.26Å; I107-K109 PolarHBondContact O-N 3.33Å; K109-L111 PolarHBondContact O-N 2.93Å; K109-S112 PolarHBondContact O-N 3.29Å; K109-D113 PolarHBondContact O-N 3.18Å
110	Q	90.4	Very high	88.5	Confident	30 Å²	30	41.3 Å²	41.3	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-64.4	-40.5	179.3	-59.1	-56.4	-42.1	0	0	112.3	S63 V64 Q106 I107 A114	S63-Q110 WeakPolarHBondContact OG-CG 3.4Å; V64-Q110 HydrophobicContact CG2-CG 4.04Å; Q106-Q110 PolarHBondContact O-N 3.04Å; I107-Q110 PolarHBondContact O-N 2.83Å; I107-Q110 VanDerWaalsContact O-N 3.11Å; Q110-A114 PolarHBondContact O-N 2.8Å; Q110-A114 VanDerWaalsContact O-N 3.11Å
111	L	91.9	Very high	88.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-71.2	-35.4	176.8	-67	179.8	0	0	0	111.9	L47 L50 F66 I96 L99 M100 I107 Q108 K109 A114 I115	L47-L111 HydrophobicContact CD2-CD2 4.35Å; L50-L111 HydrophobicContact CD1-CD1 4.26Å; L50-L111 HydrophobicContact CD1-CD2 3.86Å; L50-L111 HydrophobicContact CD1-CG 4.45Å; F66-L111 HydrophobicContact CD1-CD2 3.96Å; F66-L111 HydrophobicContact CE1-CD2 4.25Å; I96-L111 HydrophobicContact CG1-CD2 4.35Å; L99-L111 HydrophobicContact CD2-CD1 4.23Å; L99-L111 HydrophobicContact CG-CD1 4.08Å; M100-L111 HydrophobicContact CB-CB 3.82Å; M100-L111 HydrophobicContact CB-CD1 4.02Å; M100-L111 HydrophobicContact CG-CB 3.89Å; I107-L111 HydrophobicContact CG2-CD1 3.87Å; I107-L111 HydrophobicContact CG2-CG 4.17Å; I107-L111 WeakPolarHBondContact O-CG 3.27Å; I107-L111 PolarHBondContact O-N 2.99Å; Q108-L111 PolarHBondContact O-N 2.9Å; K109-L111 PolarHBondContact O-N 2.93Å; L111-A114 WeakPolarHBondContact O-CB 3.47Å; L111-A114 PolarHBondContact O-N 3.14Å; L111-I115 VanDerWaalsContact O-CG1 3.24Å; L111-I115 WeakPolarHBondContact O-CG1 3.41Å; L111-I115 PolarHBondContact O-N 2.87Å
112	S	86.9	Confident	88.7	Confident	6 Å²	6	44.8 Å²	44.8	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-42.2	173.7	-168.7	0	0	0	0	111.6	Q108 K109 A114 I115 S116 T152	Q108-S112 VanDerWaalsContact O-CB 3.25Å; Q108-S112 WeakPolarHBondContact O-CB 3.31Å; Q108-S112 PolarHBondContact O-N 3.05Å; K109-S112 PolarHBondContact O-N 3.29Å; S112-A114 VanDerWaalsContact C-N 3.35Å; S112-A114 PolarHBondContact O-N 3.25Å; S112-I115 PolarHBondContact O-N 2.65Å; S112-S116 WeakPolarHBondContact O-CB 3.1Å; S112-S116 PolarHBondContact O-N 2.83Å; S112-S116 PolarHBondContact O-OG 3.41Å; S112-T152 WeakPolarHBondContact OG-CA 3.22Å; S112-T152 PolarHBondContact OG-OG1 3.34Å
113	D	87	Confident	88.9	Confident	58 Å²	58	41.6 Å²	41.6	31%	0.31	20%	0.199	S	C	.	.	H	α-helix	trans	-61.4	-43.4	172.7	-71.3	-9.5	0	0	0	111.3	K67 K109 S116 I117	K67-D113 HydrophobicContact CD-CB 3.74Å; K67-D113 HydrophobicContact CG-CB 4.08Å; K109-D113 PolarHBondContact O-N 3.18Å; D113-S116 WeakPolarHBondContact O-CB 3.46Å; D113-S116 PolarHBondContact O-N 3.18Å; D113-I117 WeakPolarHBondContact O-CG1 3.34Å; D113-I117 PolarHBondContact O-N 2.97Å
114	A	92.8	Very high	88.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-44.2	176.8	0	0	0	0	0	112	F66 K67 I70 I96 Q110 L111 S112 S116 I117 I118	F66-A114 HydrophobicContact CD1-CB 4.04Å; F66-A114 HydrophobicContact CE1-CB 3.76Å; K67-A114 HydrophobicContact CB-CB 4.32Å; K67-A114 HydrophobicContact CG-CB 4.41Å; I70-A114 HydrophobicContact CG1-CB 4.44Å; I96-A114 HydrophobicContact CD1-CB 4.2Å; Q110-A114 PolarHBondContact O-N 2.8Å; Q110-A114 VanDerWaalsContact O-N 3.11Å; L111-A114 WeakPolarHBondContact O-CB 3.47Å; L111-A114 PolarHBondContact O-N 3.14Å; S112-A114 VanDerWaalsContact C-N 3.35Å; S112-A114 PolarHBondContact O-N 3.25Å; A114-S116 PolarHBondContact O-N 2.68Å; A114-I117 PolarHBondContact O-N 3.3Å; A114-I118 VanDerWaalsContact O-CG1 3.28Å; A114-I118 WeakPolarHBondContact O-CG1 3.3Å; A114-I118 PolarHBondContact O-N 3.41Å
115	I	91.9	Very high	89	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-38	173.9	-68	162.8	0	0	0	110.6	I96 V97 M100 L111 S112 I117 I118 G119 W127 T152 L156	I96-I115 HydrophobicContact CD1-CD1 4.47Å; I96-I115 HydrophobicContact CD1-CG1 3.65Å; I96-I115 HydrophobicContact CG1-CD1 4.19Å; I96-I115 HydrophobicContact CG1-CG1 3.87Å; I96-I115 HydrophobicContact CG2-CD1 4.42Å; I96-I115 HydrophobicContact CG2-CG1 3.98Å; V97-I115 HydrophobicContact CG2-CD1 4.28Å; M100-I115 HydrophobicContact CB-CD1 4.19Å; M100-I115 HydrophobicContact CE-CD1 4.37Å; M100-I115 HydrophobicContact CG-CD1 4.34Å; M100-I115 HydrophobicContact SD-CD1 3.44Å; M100-I115 WeakPolarHBondContact SD-CD1 3.5Å; L111-I115 VanDerWaalsContact O-CG1 3.24Å; L111-I115 WeakPolarHBondContact O-CG1 3.41Å; L111-I115 PolarHBondContact O-N 2.87Å; S112-I115 PolarHBondContact O-N 2.65Å; I115-I117 VanDerWaalsContact C-N 3.35Å; I115-I117 PolarHBondContact O-N 2.86Å; I115-I118 PolarHBondContact O-N 3.17Å; I115-G119 PolarHBondContact O-N 3.47Å; I115-W127 HydrophobicContact CG1-CH2 4.27Å; I115-W127 HydrophobicContact CG2-CH2 3.94Å; I115-W127 HydrophobicContact CG2-CZ3 4Å; I115-T152 HydrophobicContact CB-CG2 4.11Å; I115-T152 HydrophobicContact CD1-CG2 4.25Å; I115-T152 HydrophobicContact CG2-CG2 3.46Å; I115-T152 VanDerWaalsContact CG2-CG2 3.46Å; I115-L156 HydrophobicContact CG2-CD1 4.49Å
116	S	88	Confident	89.4	Confident	21 Å²	21	47.6 Å²	47.6	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-38.6	178.8	-55.9	0	0	0	0	112.3	S112 D113 A114 R120 S155	S112-S116 WeakPolarHBondContact O-CB 3.1Å; S112-S116 PolarHBondContact O-N 2.83Å; S112-S116 PolarHBondContact O-OG 3.41Å; D113-S116 WeakPolarHBondContact O-CB 3.46Å; D113-S116 PolarHBondContact O-N 3.18Å; A114-S116 PolarHBondContact O-N 2.68Å; S116-R120 PolarHBondContact O-N 2.91Å; S116-R120 VanDerWaalsContact O-N 3.08Å; S116-S155 WeakPolarHBondContact OG-CB 3.35Å
117	I	90.4	Very high	89.8	Confident	45 Å²	45	42.2 Å²	42.2	23%	0.231	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-47.8	173.4	-64.7	158.4	0	0	0	110.1	I70 K71 W74 D113 A114 I115 G119 R120	I70-I117 HydrophobicContact CG2-CB 3.98Å; I70-I117 HydrophobicContact CG2-CG2 3.79Å; K71-I117 HydrophobicContact CB-CD1 3.73Å; K71-I117 HydrophobicContact CG-CD1 4.11Å; W74-I117 HydrophobicContact CB-CG2 4.41Å; D113-I117 WeakPolarHBondContact O-CG1 3.34Å; D113-I117 PolarHBondContact O-N 2.97Å; A114-I117 PolarHBondContact O-N 3.3Å; I115-I117 VanDerWaalsContact C-N 3.35Å; I115-I117 PolarHBondContact O-N 2.86Å; I117-G119 PolarHBondContact O-N 3.29Å; I117-R120 WeakPolarHBondContact O-CB 3.27Å; I117-R120 PolarHBondContact O-N 2.96Å; I117-R120 VanDerWaalsContact O-N 3.15Å
118	I	94.3	Very high	89.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-48.9	178.6	-65.4	167.6	0	0	0	110.4	I70 W74 I92 K93 I96 A114 I115 R120 E121 D122 W127	I70-I118 HydrophobicContact CD1-CD1 4.3Å; I70-I118 HydrophobicContact CG2-CD1 4.24Å; I70-I118 HydrophobicContact CG2-CG1 3.67Å; W74-I118 HydrophobicContact CD2-CB 4.35Å; W74-I118 HydrophobicContact CD2-CG1 3.64Å; W74-I118 HydrophobicContact CD2-CG2 4.39Å; W74-I118 HydrophobicContact CE3-CD1 4.3Å; W74-I118 HydrophobicContact CE3-CG1 3.86Å; W74-I118 HydrophobicContact CG-CG1 4.15Å; W74-I118 HydrophobicContact CH2-CD1 4.05Å; W74-I118 HydrophobicContact CH2-CG1 4.03Å; W74-I118 HydrophobicContact CH2-CG2 4Å; W74-I118 HydrophobicContact CZ2-CB 4.12Å; W74-I118 HydrophobicContact CZ2-CD1 4.36Å; W74-I118 HydrophobicContact CZ2-CG1 3.89Å; W74-I118 HydrophobicContact CZ2-CG2 3.3Å; W74-I118 HydrophobicContact CZ3-CD1 4.03Å; W74-I118 HydrophobicContact CZ3-CG1 4.03Å; I92-I118 HydrophobicContact CG2-CD1 3.83Å; K93-I118 HydrophobicContact CG-CG2 4.3Å; I96-I118 HydrophobicContact CD1-CD1 3.89Å; A114-I118 VanDerWaalsContact O-CG1 3.28Å; A114-I118 WeakPolarHBondContact O-CG1 3.3Å; A114-I118 PolarHBondContact O-N 3.41Å; I115-I118 PolarHBondContact O-N 3.17Å; I118-R120 PolarHBondContact O-N 3.3Å; I118-E121 PolarHBondContact O-N 3.18Å; I118-D122 HydrophobicContact CG2-CB 4.28Å; I118-D122 WeakPolarHBondContact O-CB 2.91Å; I118-D122 PolarHBondContact O-N 3.37Å; I118-W127 HydrophobicContact CB-CE3 4.37Å; I118-W127 HydrophobicContact CB-CZ3 3.79Å; I118-W127 HydrophobicContact CG2-CD2 4.47Å; I118-W127 HydrophobicContact CG2-CE3 3.44Å; I118-W127 VanDerWaalsContact CG2-CE3 3.44Å; I118-W127 HydrophobicContact CG2-CH2 4.17Å; I118-W127 HydrophobicContact CG2-CZ3 3.26Å
119	G	90.6	Very high	89.9	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-71.5	-8.9	179.9	0	0	0	0	0	114	I115 I117 F123 R159	I115-G119 PolarHBondContact O-N 3.47Å; I117-G119 PolarHBondContact O-N 3.29Å; G119-F123 WeakPolarHBondContact O-CB 3.4Å; G119-R159 PolarHBondContact O-NH1 2.92Å; G119-R159 PolarHBondContact O-NH2 3.34Å; G119-R159 VanDerWaalsContact O-NH2 3.11Å
120	R	86.3	Confident	90.2	Very high	154 Å²	154	44.4 Å²	44.4	58%	0.581	22%	0.217	S	C	*	.	H	α-helix	trans	-73.3	-34.9	165.3	-173.3	178.6	-73.7	-174.7	-6.8	112.2	S116 I117 I118	S116-R120 PolarHBondContact O-N 2.91Å; S116-R120 VanDerWaalsContact O-N 3.08Å; I117-R120 WeakPolarHBondContact O-CB 3.27Å; I117-R120 PolarHBondContact O-N 2.96Å; I117-R120 VanDerWaalsContact O-N 3.15Å; I118-R120 PolarHBondContact O-N 3.3Å
121	E	89.1	Confident	90.2	Very high	75 Å²	75	43.1 Å²	43.1	35%	0.35	21%	0.211	S	C	.	.	H	α-helix	trans	-97.7	-33.9	-174.5	-59.7	-65	150.9	0	0	113	R75 I118	R75-E121 HydrophobicContact CB-CG 4.22Å; I118-E121 PolarHBondContact O-N 3.18Å
122	D	92.6	Very high	90	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.037	23%	0.234	C	C	.	.	S	Bend	trans	-110.1	-29.9	-168.3	-80.4	35.9	0	0	0	113.7	W74 K93 I118 P124 Q125 K126 W127	W74-D122 WeakPolarHBondContact CZ2-OD2 3.07Å; W74-D122 PolarHBondContact NE1-OD1 2.86Å; K93-D122 IonicContact NZ-OD2 2.89Å; K93-D122 PolarHBondContact NZ-OD2 3.49Å; I118-D122 HydrophobicContact CG2-CB 4.28Å; I118-D122 WeakPolarHBondContact O-CB 2.91Å; I118-D122 PolarHBondContact O-N 3.37Å; D122-P124 CarbonylContact O-C 3.41Å; D122-Q125 PolarHBondContact O-N 2.86Å; D122-K126 HydrophobicContact CB-CB 3.83Å; D122-K126 CarbonylContact O-C 3.58Å; D122-K126 WeakPolarHBondContact O-CA 3.33Å; D122-K126 WeakPolarHBondContact O-CB 3.16Å; D122-K126 PolarHBondContact O-N 3.01Å; D122-W127 HydrophobicContact CB-CB 4.25Å; D122-W127 PolarHBondContact O-N 3.12Å; D122-W127 VanDerWaalsContact O-N 3.16Å
123	F	90.8	Very high	90.1	Very high	9 Å²	9	48.7 Å²	48.7	4%	0.039	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	135.1	-177.8	173.6	-95.7	0	0	0	110.4	G119 L130 L131 F157 E172 V176	G119-F123 WeakPolarHBondContact O-CB 3.4Å; F123-L130 HydrophobicContact CB-CD2 4.35Å; F123-L130 HydrophobicContact CD2-CB 4.28Å; F123-L130 HydrophobicContact CD2-CD2 3.95Å; F123-L130 HydrophobicContact CG-CD2 4.28Å; F123-L131 HydrophobicContact CE2-CD1 3.7Å; F123-L131 HydrophobicContact CE2-CD2 4.43Å; F123-L131 HydrophobicContact CE2-CG 3.57Å; F123-L131 HydrophobicContact CZ-CD1 3.53Å; F123-L131 HydrophobicContact CZ-CD2 4.19Å; F123-L131 HydrophobicContact CZ-CG 3.68Å; F123-F157 HydrophobicContact CE1-CE1 4.42Å; F123-E172 HydrophobicContact CD1-CG 4.04Å; F123-E172 HydrophobicContact CE1-CG 3.56Å; F123-E172 HydrophobicContact CZ-CG 4.42Å; F123-V176 HydrophobicContact CE1-CG2 3.69Å; F123-V176 HydrophobicContact CZ-CG2 3.59Å
124	P	88.4	Confident	90.2	Very high	22 Å²	22	46 Å²	46	14%	0.143	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.9	-18.9	2.6	33.9	-31.7	0	0	0	115	D122 K126 W127 P128 E172 L175	D122-P124 CarbonylContact O-C 3.41Å; P124-K126 PolarHBondContact O-N 3.47Å; P124-W127 CarbonylContact O-C 3.48Å; P124-W127 PolarHBondContact O-N 2.77Å; P124-P128 WeakPolarHBondContact O-CA 3.24Å; P124-E172 HydrophobicContact CG-CB 4.18Å; P124-E172 HydrophobicContact CG-CG 4.09Å; P124-L175 HydrophobicContact CB-CD2 3.26Å; P124-L175 HydrophobicContact CG-CD2 3.91Å
125	Q	89.1	Confident	90.2	Very high	174 Å²	174	47 Å²	47	81%	0.813	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-42.7	-165.4	-64.8	-179.5	-7.1	0	0	114	D122	D122-Q125 PolarHBondContact O-N 2.86Å
126	K	90.4	Very high	90.1	Very high	125 Å²	125	51.5 Å²	51.5	54%	0.543	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-4.1	179.9	-59.7	176.3	-176.7	167.5	0	112.5	K93 D122 P124	K93-K126 PolarHBondContact NZ-O 3.12Å; D122-K126 HydrophobicContact CB-CB 3.83Å; D122-K126 CarbonylContact O-C 3.58Å; D122-K126 WeakPolarHBondContact O-CA 3.33Å; D122-K126 WeakPolarHBondContact O-CB 3.16Å; D122-K126 PolarHBondContact O-N 3.01Å; P124-K126 PolarHBondContact O-N 3.47Å
127	W	92.9	Very high	90.2	Very high	12 Å²	12	54.6 Å²	54.6	5%	0.045	27%	0.266	C	S	.	.			trans	-139.7	62.5	176.6	-159.9	2	0	0	0	112.1	K93 I96 V97 I115 I118 D122 P124 D129 L130	K93-W127 HydrophobicContact CB-CD2 4.23Å; K93-W127 HydrophobicContact CB-CG 4.41Å; K93-W127 HydrophobicContact CB-CZ2 4.06Å; K93-W127 HydrophobicContact CD-CB 3.86Å; K93-W127 HydrophobicContact CD-CD2 3.73Å; K93-W127 HydrophobicContact CD-CE3 4.24Å; K93-W127 HydrophobicContact CD-CG 3.58Å; K93-W127 HydrophobicContact CG-CD2 3.72Å; K93-W127 HydrophobicContact CG-CE3 4.16Å; K93-W127 HydrophobicContact CG-CG 4.05Å; K93-W127 HydrophobicContact CG-CH2 4.43Å; K93-W127 HydrophobicContact CG-CZ2 4.03Å; I96-W127 HydrophobicContact CG2-CH2 3.7Å; I96-W127 HydrophobicContact CG2-CZ2 3.83Å; V97-W127 HydrophobicContact CG2-CH2 4.3Å; V97-W127 HydrophobicContact CG2-CZ2 3.89Å; I115-W127 HydrophobicContact CG1-CH2 4.27Å; I115-W127 HydrophobicContact CG2-CH2 3.94Å; I115-W127 HydrophobicContact CG2-CZ3 4Å; I118-W127 HydrophobicContact CB-CE3 4.37Å; I118-W127 HydrophobicContact CB-CZ3 3.79Å; I118-W127 HydrophobicContact CG2-CD2 4.47Å; I118-W127 HydrophobicContact CG2-CE3 3.44Å; I118-W127 VanDerWaalsContact CG2-CE3 3.44Å; I118-W127 HydrophobicContact CG2-CH2 4.17Å; I118-W127 HydrophobicContact CG2-CZ3 3.26Å; D122-W127 HydrophobicContact CB-CB 4.25Å; D122-W127 PolarHBondContact O-N 3.12Å; D122-W127 VanDerWaalsContact O-N 3.16Å; P124-W127 CarbonylContact O-C 3.48Å; P124-W127 PolarHBondContact O-N 2.77Å; W127-D129 PolarHBondContact O-N 2.88Å; W127-L130 HydrophobicContact CD2-CB 3.95Å; W127-L130 HydrophobicContact CD2-CD1 4.39Å; W127-L130 HydrophobicContact CD2-CD2 3.99Å; W127-L130 HydrophobicContact CD2-CG 4.32Å; W127-L130 HydrophobicContact CE3-CD2 3.73Å; W127-L130 HydrophobicContact CE3-CG 4.49Å; W127-L130 HydrophobicContact CG-CB 3.94Å; W127-L130 HydrophobicContact CH2-CD1 4.04Å; W127-L130 HydrophobicContact CH2-CD2 4.46Å; W127-L130 HydrophobicContact CZ2-CD1 3.83Å; W127-L130 HydrophobicContact CZ3-CD1 4.37Å; W127-L130 HydrophobicContact CZ3-CD2 3.97Å; W127-L130 PolarHBondContact O-N 3.28Å
128	P	89.4	Confident	90.2	Very high	77 Å²	77	53.5 Å²	53.5	50%	0.5	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-32.9	-171.7	26.3	-35.2	0	0	0	113.4	P124 L130	P124-P128 WeakPolarHBondContact O-CA 3.24Å; P128-L130 VanDerWaalsContact C-N 3.27Å; P128-L130 PolarHBondContact O-N 3.25Å
129	D	89.3	Confident	89.9	Confident	117 Å²	117	61.4 Å²	61.4	63%	0.626	30%	0.296	S	S	*	.	H	α-helix	trans	-76.1	-11.7	-174.4	-57.1	-47.4	0	0	0	114	W127 L131 T132 E133	W127-D129 PolarHBondContact O-N 2.88Å; D129-L131 PolarHBondContact O-N 3.4Å; D129-T132 PolarHBondContact O-N 2.93Å; D129-E133 PolarHBondContact O-N 3.38Å
130	L	91.1	Very high	89.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.2	-46.5	-173.6	176.9	60.9	0	0	0	112.4	V97 F123 W127 P128 E133 M134 L156	V97-L130 HydrophobicContact CG2-CD1 3.69Å; F123-L130 HydrophobicContact CB-CD2 4.35Å; F123-L130 HydrophobicContact CD2-CB 4.28Å; F123-L130 HydrophobicContact CD2-CD2 3.95Å; F123-L130 HydrophobicContact CG-CD2 4.28Å; W127-L130 HydrophobicContact CD2-CB 3.95Å; W127-L130 HydrophobicContact CD2-CD1 4.39Å; W127-L130 HydrophobicContact CD2-CD2 3.99Å; W127-L130 HydrophobicContact CD2-CG 4.32Å; W127-L130 HydrophobicContact CE3-CD2 3.73Å; W127-L130 HydrophobicContact CE3-CG 4.49Å; W127-L130 HydrophobicContact CG-CB 3.94Å; W127-L130 HydrophobicContact CH2-CD1 4.04Å; W127-L130 HydrophobicContact CH2-CD2 4.46Å; W127-L130 HydrophobicContact CZ2-CD1 3.83Å; W127-L130 HydrophobicContact CZ3-CD1 4.37Å; W127-L130 HydrophobicContact CZ3-CD2 3.97Å; W127-L130 PolarHBondContact O-N 3.28Å; P128-L130 VanDerWaalsContact C-N 3.27Å; P128-L130 PolarHBondContact O-N 3.25Å; L130-E133 PolarHBondContact O-N 3.44Å; L130-M134 HydrophobicContact CD1-CE 4.39Å; L130-M134 HydrophobicContact CD1-CG 4.25Å; L130-M134 HydrophobicContact CD1-SD 4.22Å; L130-M134 HydrophobicContact CG-CE 3.94Å; L130-M134 HydrophobicContact CG-SD 4.4Å; L130-M134 WeakPolarHBondContact O-CB 3.5Å; L130-M134 VanDerWaalsContact O-CG 3.31Å; L130-M134 WeakPolarHBondContact O-CG 3.41Å; L130-M134 PolarHBondContact O-N 3.24Å; L130-L156 HydrophobicContact CD2-CD1 3.86Å
131	L	90.1	Very high	89.7	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-47	179.3	-80.3	172.5	0	0	0	111.6	F123 D129 E133 M134 V135 F157 L175 V176 A179 F180	F123-L131 HydrophobicContact CE2-CD1 3.7Å; F123-L131 HydrophobicContact CE2-CD2 4.43Å; F123-L131 HydrophobicContact CE2-CG 3.57Å; F123-L131 HydrophobicContact CZ-CD1 3.53Å; F123-L131 HydrophobicContact CZ-CD2 4.19Å; F123-L131 HydrophobicContact CZ-CG 3.68Å; D129-L131 PolarHBondContact O-N 3.4Å; L131-E133 VanDerWaalsContact C-N 3.31Å; L131-E133 PolarHBondContact O-N 2.84Å; L131-M134 HydrophobicContact CD2-CE 3.89Å; L131-M134 PolarHBondContact O-N 2.7Å; L131-V135 WeakPolarHBondContact O-CB 3.35Å; L131-V135 VanDerWaalsContact O-CG2 3.28Å; L131-V135 WeakPolarHBondContact O-CG2 3.44Å; L131-V135 PolarHBondContact O-N 2.59Å; L131-F157 HydrophobicContact CD2-CZ 3.95Å; L131-L175 HydrophobicContact CD1-CD2 4.14Å; L131-L175 HydrophobicContact CD1-CG 4.14Å; L131-V176 HydrophobicContact CD1-CB 4.49Å; L131-V176 HydrophobicContact CD1-CG2 4.07Å; L131-V176 HydrophobicContact CD2-CG1 4.4Å; L131-V176 HydrophobicContact CD2-CG2 4.26Å; L131-A179 HydrophobicContact CB-CB 4.3Å; L131-A179 HydrophobicContact CD1-CB 4.14Å; L131-F180 HydrophobicContact CD2-CD2 4.09Å
132	T	89.4	Confident	89.7	Confident	79 Å²	79	59.8 Å²	59.8	49%	0.485	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-41.9	-179.6	-53	0	0	0	0	110.8	D129 N136	D129-T132 PolarHBondContact O-N 2.93Å; T132-N136 WeakPolarHBondContact O-CB 3.39Å; T132-N136 PolarHBondContact O-N 3.01Å; T132-N136 PolarHBondContact O-ND2 2.9Å
133	E	88.3	Confident	89.6	Confident	44 Å²	44	61 Å²	61	21%	0.206	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-48.1	175	-170.8	178.1	-177	0	0	111.5	V97 D129 L130 L131 V135 N136 R137	V97-E133 HydrophobicContact CG1-CG 4.16Å; D129-E133 PolarHBondContact O-N 3.38Å; L130-E133 PolarHBondContact O-N 3.44Å; L131-E133 VanDerWaalsContact C-N 3.31Å; L131-E133 PolarHBondContact O-N 2.84Å; E133-V135 PolarHBondContact O-N 3.14Å; E133-N136 PolarHBondContact O-N 3.18Å; E133-R137 VanDerWaalsContact O-CG 3.23Å; E133-R137 WeakPolarHBondContact O-CG 3.27Å; E133-R137 PolarHBondContact O-N 3.02Å; E133-R137 IonicContact OE1-NH2 2.65Å
134	M	89.6	Confident	89.4	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-59.7	-47.1	178.3	-77	-169.1	-53.4	0	0	112.3	L130 L131 N136 R137 V149 T152 L156	L130-M134 HydrophobicContact CD1-CE 4.39Å; L130-M134 HydrophobicContact CD1-CG 4.25Å; L130-M134 HydrophobicContact CD1-SD 4.22Å; L130-M134 HydrophobicContact CG-CE 3.94Å; L130-M134 HydrophobicContact CG-SD 4.4Å; L130-M134 WeakPolarHBondContact O-CB 3.5Å; L130-M134 VanDerWaalsContact O-CG 3.31Å; L130-M134 WeakPolarHBondContact O-CG 3.41Å; L130-M134 PolarHBondContact O-N 3.24Å; L131-M134 HydrophobicContact CD2-CE 3.89Å; L131-M134 PolarHBondContact O-N 2.7Å; M134-N136 PolarHBondContact O-N 2.69Å; M134-R137 WeakPolarHBondContact O-CB 3.24Å; M134-R137 PolarHBondContact O-N 3.47Å; M134-V149 HydrophobicContact CB-CG1 3.66Å; M134-V149 HydrophobicContact CG-CG1 4.01Å; M134-V149 HydrophobicContact SD-CG1 4.43Å; M134-T152 HydrophobicContact SD-CG2 4.06Å; M134-L156 HydrophobicContact CE-CD1 4.28Å; M134-L156 HydrophobicContact SD-CD1 4.43Å
135	V	91.5	Very high	89.4	Confident	21 Å²	21	64.1 Å²	64.1	13%	0.127	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-42.5	-178.9	167.4	0	0	0	0	111.8	L131 E133 R137 F138 A179 F180 P183	L131-V135 WeakPolarHBondContact O-CB 3.35Å; L131-V135 VanDerWaalsContact O-CG2 3.28Å; L131-V135 WeakPolarHBondContact O-CG2 3.44Å; L131-V135 PolarHBondContact O-N 2.59Å; E133-V135 PolarHBondContact O-N 3.14Å; V135-R137 PolarHBondContact O-N 3.5Å; V135-F138 WeakPolarHBondContact O-CB 3.48Å; V135-F138 PolarHBondContact O-N 2.95Å; V135-A179 WeakPolarHBondContact CG2-O 3.37Å; V135-F180 HydrophobicContact CG2-CD2 3.56Å; V135-F180 HydrophobicContact CG2-CE2 4.15Å; V135-F180 HydrophobicContact CG2-CG 4.44Å; V135-P183 HydrophobicContact CG1-CB 3.79Å; V135-P183 HydrophobicContact CG1-CG 3.49Å; V135-P183 VanDerWaalsContact CG1-CG 3.49Å; V135-P183 HydrophobicContact CG2-CB 4.49Å; V135-P183 HydrophobicContact CG2-CG 4.33Å
136	N	91.1	Very high	89.5	Confident	93 Å²	93	56 Å²	56	50%	0.497	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-30.5	178.5	-74.4	-19.5	0	0	0	112.2	T132 E133 M134 F138 Q139	T132-N136 WeakPolarHBondContact O-CB 3.39Å; T132-N136 PolarHBondContact O-N 3.01Å; T132-N136 PolarHBondContact O-ND2 2.9Å; E133-N136 PolarHBondContact O-N 3.18Å; M134-N136 PolarHBondContact O-N 2.69Å; N136-F138 VanDerWaalsContact C-N 3.29Å; N136-F138 PolarHBondContact O-N 3.23Å; N136-Q139 PolarHBondContact O-N 3Å
137	R	90.3	Very high	89.5	Confident	87 Å²	87	50.9 Å²	50.9	33%	0.328	28%	0.28	S	S	.	.	H	α-helix	trans	-74.4	-16.5	179.7	-62.8	-71.2	-177.9	-162.8	-0.9	113.4	L101 E133 M134 V135 Q139 S140 V145 V149	L101-R137 HydrophobicContact CD1-CB 4.35Å; L101-R137 HydrophobicContact CD1-CG 3.69Å; E133-R137 VanDerWaalsContact O-CG 3.23Å; E133-R137 WeakPolarHBondContact O-CG 3.27Å; E133-R137 PolarHBondContact O-N 3.02Å; E133-R137 IonicContact OE1-NH2 2.65Å; M134-R137 WeakPolarHBondContact O-CB 3.24Å; M134-R137 PolarHBondContact O-N 3.47Å; V135-R137 PolarHBondContact O-N 3.5Å; R137-Q139 PolarHBondContact O-N 3.18Å; R137-S140 VanDerWaalsContact O-CB 3.3Å; R137-S140 WeakPolarHBondContact O-CB 3.38Å; R137-S140 PolarHBondContact O-N 3.06Å; R137-S140 VanDerWaalsContact O-N 3.16Å; R137-S140 PolarHBondContact O-OG 3.22Å; R137-V145 HydrophobicContact CB-CG1 3.95Å; R137-V145 HydrophobicContact CG-CG1 4.48Å; R137-V149 HydrophobicContact CB-CG2 3.73Å; R137-V149 HydrophobicContact CG-CG2 4.42Å
138	F	89.5	Confident	89.2	Confident	21 Å²	21	50.3 Å²	50.3	9%	0.092	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-63.7	-22.6	171	-66.8	-27.2	0	0	0	113.1	V135 N136 S140 I146 V149 L150 F180 P183 L187	V135-F138 WeakPolarHBondContact O-CB 3.48Å; V135-F138 PolarHBondContact O-N 2.95Å; N136-F138 VanDerWaalsContact C-N 3.29Å; N136-F138 PolarHBondContact O-N 3.23Å; F138-S140 VanDerWaalsContact C-N 3.26Å; F138-S140 PolarHBondContact O-N 2.72Å; F138-I146 HydrophobicContact CD1-CG2 4.24Å; F138-I146 HydrophobicContact CE1-CG2 4.49Å; F138-V149 HydrophobicContact CD1-CB 4.35Å; F138-V149 HydrophobicContact CD1-CG1 4.08Å; F138-V149 HydrophobicContact CE1-CB 3.8Å; F138-V149 HydrophobicContact CE1-CG1 3.34Å; F138-V149 HydrophobicContact CZ-CG1 3.77Å; F138-L150 HydrophobicContact CE1-CD2 3.92Å; F138-L150 HydrophobicContact CE1-CG 4.15Å; F138-L150 HydrophobicContact CZ-CD2 3.88Å; F138-F180 HydrophobicContact CE2-CD2 4.42Å; F138-F180 HydrophobicContact CE2-CE1 4.37Å; F138-F180 AromaticContact CE2-CE2 3.78Å; F138-F180 HydrophobicContact CE2-CE2 3.78Å; F138-F180 AromaticContact CE2-CZ 3.78Å; F138-F180 HydrophobicContact CE2-CZ 3.78Å; F138-F180 HydrophobicContact CZ-CE1 4.25Å; F138-F180 AromaticContact CZ-CE2 3.78Å; F138-F180 HydrophobicContact CZ-CE2 3.78Å; F138-F180 AromaticContact CZ-CZ 3.46Å; F138-F180 HydrophobicContact CZ-CZ 3.46Å; F138-F180 VanDerWaalsContact CZ-CZ 3.46Å; F138-P183 HydrophobicContact CD2-CB 3.92Å; F138-P183 HydrophobicContact CE2-CB 4.34Å; F138-L187 HydrophobicContact CD1-CD2 3.77Å; F138-L187 HydrophobicContact CD2-CD2 4.39Å; F138-L187 HydrophobicContact CE1-CD2 3.79Å; F138-L187 HydrophobicContact CE2-CD2 4.43Å; F138-L187 HydrophobicContact CG-CD2 4.06Å; F138-L187 HydrophobicContact CZ-CD2 4.13Å
139	Q	87.4	Confident	89.2	Confident	166 Å²	166	46.6 Å²	46.6	78%	0.776	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-81.8	-0.5	177.4	-58.3	179	6.2	0	0	113.4	N136 R137 G141	N136-Q139 PolarHBondContact O-N 3Å; R137-Q139 PolarHBondContact O-N 3.18Å; Q139-G141 PolarHBondContact O-N 2.9Å
140	S	88.1	Confident	89.4	Confident	58 Å²	58	41 Å²	41	41%	0.406	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-66	-26	-176.5	67.9	0	0	0	0	113.6	R137 F138 D142	R137-S140 VanDerWaalsContact O-CB 3.3Å; R137-S140 WeakPolarHBondContact O-CB 3.38Å; R137-S140 PolarHBondContact O-N 3.06Å; R137-S140 VanDerWaalsContact O-N 3.16Å; R137-S140 PolarHBondContact O-OG 3.22Å; F138-S140 VanDerWaalsContact C-N 3.26Å; F138-S140 PolarHBondContact O-N 2.72Å; S140-D142 PolarHBondContact O-N 3.43Å; S140-D142 VanDerWaalsContact O-N 3.17Å; S140-D142 PolarHBondContact OG-N 3.48Å; S140-D142 VanDerWaalsContact OG-N 3.08Å; S140-D142 PolarHBondContact OG-O 2.66Å
141	G	85.5	Confident	89.3	Confident	61 Å²	61	45 Å²	45	63%	0.629	24%	0.239	S	C	*	.			trans	69	-2.5	-168.5	0	0	0	0	0	114.2	Q139	Q139-G141 PolarHBondContact O-N 2.9Å
142	D	89.4	Confident	89.1	Confident	76 Å²	76	44.9 Å²	44.9	41%	0.406	24%	0.239	S	C	.	.			trans	-96.5	110	179.4	-178.2	-6.1	0	0	0	110.1	S140 H144 V145 I146	S140-D142 PolarHBondContact O-N 3.43Å; S140-D142 VanDerWaalsContact O-N 3.17Å; S140-D142 PolarHBondContact OG-N 3.48Å; S140-D142 VanDerWaalsContact OG-N 3.08Å; S140-D142 PolarHBondContact OG-O 2.66Å; D142-H144 PolarHBondContact O-N 3.01Å; D142-H144 VanDerWaalsContact OD1-CB 3.26Å; D142-H144 WeakPolarHBondContact OD1-CB 3.47Å; D142-H144 PolarHBondContact OD1-N 3.1Å; D142-V145 HydrophobicContact CB-CB 4.24Å; D142-V145 HydrophobicContact CB-CG2 4.09Å; D142-V145 WeakPolarHBondContact O-CB 3.41Å; D142-V145 PolarHBondContact O-N 3.09Å; D142-V145 VanDerWaalsContact O-N 3.09Å; D142-I146 WeakPolarHBondContact O-CG1 3.39Å; D142-I146 PolarHBondContact O-N 3.48Å
143	F	89.6	Confident	89.2	Confident	33 Å²	33	41.1 Å²	41.1	15%	0.145	22%	0.216	C	C	.	.	H	α-helix	trans	-67.6	-19.7	-179	-84.7	-87.5	0	0	0	114.5	I146 N147 T191 L194 I207 L208 S211	F143-I146 HydrophobicContact CD1-CD1 4.4Å; F143-I146 HydrophobicContact CD2-CD1 4.46Å; F143-I146 HydrophobicContact CE1-CD1 4.43Å; F143-I146 HydrophobicContact CE2-CD1 4.47Å; F143-I146 HydrophobicContact CG-CD1 4.42Å; F143-I146 HydrophobicContact CZ-CD1 4.46Å; F143-N147 WeakPolarHBondContact O-CB 3.5Å; F143-N147 PolarHBondContact O-N 3.4Å; F143-N147 PolarHBondContact O-ND2 2.95Å; F143-T191 HydrophobicContact CE1-CG2 4.12Å; F143-T191 HydrophobicContact CZ-CG2 4.43Å; F143-L194 HydrophobicContact CE2-CD1 3.56Å; F143-L194 HydrophobicContact CZ-CD1 3.63Å; F143-I207 HydrophobicContact CB-CG2 3.35Å; F143-I207 HydrophobicContact CD1-CG2 4.27Å; F143-I207 HydrophobicContact CG-CG2 3.95Å; F143-L208 HydrophobicContact CD1-CD2 4.05Å; F143-L208 HydrophobicContact CD2-CD2 4.12Å; F143-L208 HydrophobicContact CE1-CD2 3.48Å; F143-L208 VanDerWaalsContact CE1-CD2 3.48Å; F143-L208 HydrophobicContact CE2-CD2 3.56Å; F143-L208 HydrophobicContact CG-CD2 4.34Å; F143-L208 HydrophobicContact CZ-CD2 3.21Å; F143-S211 VanDerWaalsContact CD1-OG 3.24Å; F143-S211 WeakPolarHBondContact CD1-OG 3.38Å
144	H	86.4	Confident	89.4	Confident	77 Å²	77	40.2 Å²	40.2	36%	0.356	21%	0.212	S	C	.	.	H	α-helix	trans	-64	-45.6	169.3	-179.7	65.9	0	0	0	110.6	S103 Q108 D142 G148	S103-H144 PolarHBondContact O-NE2 2.99Å; Q108-H144 PolarHBondContact NE2-O 3.27Å; D142-H144 PolarHBondContact O-N 3.01Å; D142-H144 VanDerWaalsContact OD1-CB 3.26Å; D142-H144 WeakPolarHBondContact OD1-CB 3.47Å; D142-H144 PolarHBondContact OD1-N 3.1Å; H144-G148 PolarHBondContact O-N 3.13Å; H144-G148 VanDerWaalsContact O-N 3.1Å
145	V	88.8	Confident	89.2	Confident	20 Å²	20	42.3 Å²	42.3	12%	0.121	23%	0.226	C	C	.	.	H	α-helix	trans	-67.8	-48.1	176.3	175.6	0	0	0	0	110.6	L101 R137 D142 N147 G148 V149	L101-V145 HydrophobicContact CB-CG1 4.45Å; L101-V145 HydrophobicContact CD1-CG1 4.15Å; L101-V145 HydrophobicContact CD2-CG1 4.12Å; L101-V145 WeakPolarHBondContact CD2-O 3.33Å; L101-V145 HydrophobicContact CG-CG1 4.46Å; R137-V145 HydrophobicContact CB-CG1 3.95Å; R137-V145 HydrophobicContact CG-CG1 4.48Å; D142-V145 HydrophobicContact CB-CB 4.24Å; D142-V145 HydrophobicContact CB-CG2 4.09Å; D142-V145 WeakPolarHBondContact O-CB 3.41Å; D142-V145 PolarHBondContact O-N 3.09Å; D142-V145 VanDerWaalsContact O-N 3.09Å; V145-N147 PolarHBondContact O-N 3.24Å; V145-G148 PolarHBondContact O-N 3.32Å; V145-V149 WeakPolarHBondContact O-CG2 3.32Å; V145-V149 PolarHBondContact O-N 2.99Å
146	I	92.4	Very high	89.1	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-48	-179.1	-65.5	164.6	0	0	0	110.8	F138 D142 F143 G148 V149 L150 L187	F138-I146 HydrophobicContact CD1-CG2 4.24Å; F138-I146 HydrophobicContact CE1-CG2 4.49Å; D142-I146 WeakPolarHBondContact O-CG1 3.39Å; D142-I146 PolarHBondContact O-N 3.48Å; F143-I146 HydrophobicContact CD1-CD1 4.4Å; F143-I146 HydrophobicContact CD2-CD1 4.46Å; F143-I146 HydrophobicContact CE1-CD1 4.43Å; F143-I146 HydrophobicContact CE2-CD1 4.47Å; F143-I146 HydrophobicContact CG-CD1 4.42Å; F143-I146 HydrophobicContact CZ-CD1 4.46Å; I146-G148 VanDerWaalsContact C-N 3.29Å; I146-G148 PolarHBondContact O-N 3.35Å; I146-V149 WeakPolarHBondContact O-CB 3.45Å; I146-V149 PolarHBondContact O-N 3.28Å; I146-V149 VanDerWaalsContact O-N 3.15Å; I146-L150 HydrophobicContact CG2-CD1 3.87Å; I146-L150 HydrophobicContact CG2-CG 4.23Å; I146-L150 VanDerWaalsContact O-CG 3.32Å; I146-L150 WeakPolarHBondContact O-CG 3.31Å; I146-L150 PolarHBondContact O-N 3.19Å; I146-L187 HydrophobicContact CD1-CD1 4.26Å; I146-L187 HydrophobicContact CG2-CD1 3.99Å; I146-L187 HydrophobicContact CG2-CD2 3.64Å; I146-L187 HydrophobicContact CG2-CG 4.4Å
147	N	89.5	Confident	89.1	Confident	16 Å²	16	37 Å²	37	9%	0.086	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-37.2	177.2	-78.7	-32	0	0	0	111.9	F143 V145 V149 L150 R151 S211	F143-N147 WeakPolarHBondContact O-CB 3.5Å; F143-N147 PolarHBondContact O-N 3.4Å; F143-N147 PolarHBondContact O-ND2 2.95Å; V145-N147 PolarHBondContact O-N 3.24Å; N147-V149 VanDerWaalsContact C-N 3.35Å; N147-V149 PolarHBondContact O-N 3.48Å; N147-L150 PolarHBondContact O-N 2.95Å; N147-R151 WeakPolarHBondContact O-CB 3.33Å; N147-R151 VanDerWaalsContact O-CG 3.27Å; N147-R151 WeakPolarHBondContact O-CG 3.36Å; N147-R151 PolarHBondContact O-N 3.27Å; N147-S211 VanDerWaalsContact CG-OG 3.3Å; N147-S211 PolarHBondContact ND2-OG 3.04Å; N147-S211 VanDerWaalsContact OD1-CA 3.23Å; N147-S211 WeakPolarHBondContact OD1-CA 3.5Å; N147-S211 VanDerWaalsContact OD1-CB 3.31Å; N147-S211 WeakPolarHBondContact OD1-CB 3.49Å; N147-S211 PolarHBondContact OD1-N 2.96Å; N147-S211 PolarHBondContact OD1-OG 3.48Å
148	G	85.8	Confident	89.1	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.2	-47.7	171.7	0	0	0	0	0	112.8	H144 V145 I146 T152	H144-G148 PolarHBondContact O-N 3.13Å; H144-G148 VanDerWaalsContact O-N 3.1Å; V145-G148 PolarHBondContact O-N 3.32Å; I146-G148 VanDerWaalsContact C-N 3.29Å; I146-G148 PolarHBondContact O-N 3.35Å; G148-T152 PolarHBondContact O-N 3.25Å; G148-T152 VanDerWaalsContact O-N 3.14Å; G148-T152 PolarHBondContact O-OG1 3.47Å
149	V	90.8	Very high	89.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-47.1	176	176.6	0	0	0	0	111.3	L101 M134 R137 F138 V145 I146 N147 R151 T152 A153	L101-V149 HydrophobicContact CD1-CG2 4.25Å; L101-V149 HydrophobicContact CD2-CG2 3.8Å; M134-V149 HydrophobicContact CB-CG1 3.66Å; M134-V149 HydrophobicContact CG-CG1 4.01Å; M134-V149 HydrophobicContact SD-CG1 4.43Å; R137-V149 HydrophobicContact CB-CG2 3.73Å; R137-V149 HydrophobicContact CG-CG2 4.42Å; F138-V149 HydrophobicContact CD1-CB 4.35Å; F138-V149 HydrophobicContact CD1-CG1 4.08Å; F138-V149 HydrophobicContact CE1-CB 3.8Å; F138-V149 HydrophobicContact CE1-CG1 3.34Å; F138-V149 HydrophobicContact CZ-CG1 3.77Å; V145-V149 WeakPolarHBondContact O-CG2 3.32Å; V145-V149 PolarHBondContact O-N 2.99Å; I146-V149 WeakPolarHBondContact O-CB 3.45Å; I146-V149 PolarHBondContact O-N 3.28Å; I146-V149 VanDerWaalsContact O-N 3.15Å; N147-V149 VanDerWaalsContact C-N 3.35Å; N147-V149 PolarHBondContact O-N 3.48Å; V149-R151 PolarHBondContact O-N 2.92Å; V149-T152 PolarHBondContact O-N 2.81Å; V149-A153 WeakPolarHBondContact O-CB 3.37Å; V149-A153 PolarHBondContact O-N 3.19Å
150	L	93.4	Very high	89.4	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-39.8	-178.9	-68.6	172.4	0	0	0	112.3	F138 I146 N147 H154 L184 L187 L214 I215 L218	F138-L150 HydrophobicContact CE1-CD2 3.92Å; F138-L150 HydrophobicContact CE1-CG 4.15Å; F138-L150 HydrophobicContact CZ-CD2 3.88Å; I146-L150 HydrophobicContact CG2-CD1 3.87Å; I146-L150 HydrophobicContact CG2-CG 4.23Å; I146-L150 VanDerWaalsContact O-CG 3.32Å; I146-L150 WeakPolarHBondContact O-CG 3.31Å; I146-L150 PolarHBondContact O-N 3.19Å; N147-L150 PolarHBondContact O-N 2.95Å; L150-H154 VanDerWaalsContact O-CB 3.23Å; L150-H154 WeakPolarHBondContact O-CB 3.46Å; L150-H154 PolarHBondContact O-N 3.28Å; L150-L184 HydrophobicContact CD2-CD1 3.86Å; L150-L187 HydrophobicContact CD1-CD2 4.23Å; L150-L187 HydrophobicContact CD2-CD2 3.97Å; L150-L187 HydrophobicContact CG-CD2 4.36Å; L150-L214 HydrophobicContact CB-CB 3.82Å; L150-L214 HydrophobicContact CB-CD1 3.89Å; L150-L214 HydrophobicContact CB-CG 4.46Å; L150-L214 HydrophobicContact CD1-CB 4.28Å; L150-I215 HydrophobicContact CD1-CD1 4.19Å; L150-I215 HydrophobicContact CD1-CG1 3.78Å; L150-I215 HydrophobicContact CD2-CG1 3.79Å; L150-I215 HydrophobicContact CG-CG1 4.46Å; L150-L218 HydrophobicContact CB-CD1 4.26Å; L150-L218 HydrophobicContact CD2-CD1 3.47Å; L150-L218 VanDerWaalsContact CD2-CD1 3.47Å; L150-L218 HydrophobicContact CG-CD1 4.48Å
151	R	88.1	Confident	89.6	Confident	82 Å²	82	29 Å²	29	31%	0.309	15%	0.153	S	C	.	.	H	α-helix	trans	-61.9	-46.2	174.4	-73.4	-179.5	-169.8	-75.2	13	111	E105 N147 V149 H154 S155 L214	E105-R151 IonicContact OE1-NH2 3.86Å; E105-R151 PolarHBondContact OE1-NH2 3.48Å; N147-R151 WeakPolarHBondContact O-CB 3.33Å; N147-R151 VanDerWaalsContact O-CG 3.27Å; N147-R151 WeakPolarHBondContact O-CG 3.36Å; N147-R151 PolarHBondContact O-N 3.27Å; V149-R151 PolarHBondContact O-N 2.92Å; R151-H154 PolarHBondContact O-N 3.21Å; R151-S155 PolarHBondContact O-N 3.06Å; R151-S155 PolarHBondContact O-OG 3.04Å; R151-S155 VanDerWaalsContact O-OG 3.09Å; R151-L214 HydrophobicContact CG-CD1 3.61Å; R151-L214 HydrophobicContact CG-CD2 4.01Å; R151-L214 HydrophobicContact CG-CG 4.49Å
152	T	86.1	Confident	89.6	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-45.8	178.9	-65.4	0	0	0	0	112.4	M100 S112 I115 M134 G148 V149 H154 S155 L156	M100-T152 WeakPolarHBondContact CE-OG1 3.5Å; M100-T152 PolarHBondContact SD-OG1 3.01Å; S112-T152 WeakPolarHBondContact OG-CA 3.22Å; S112-T152 PolarHBondContact OG-OG1 3.34Å; I115-T152 HydrophobicContact CB-CG2 4.11Å; I115-T152 HydrophobicContact CD1-CG2 4.25Å; I115-T152 HydrophobicContact CG2-CG2 3.46Å; I115-T152 VanDerWaalsContact CG2-CG2 3.46Å; M134-T152 HydrophobicContact SD-CG2 4.06Å; G148-T152 PolarHBondContact O-N 3.25Å; G148-T152 VanDerWaalsContact O-N 3.14Å; G148-T152 PolarHBondContact O-OG1 3.47Å; V149-T152 PolarHBondContact O-N 2.81Å; T152-H154 VanDerWaalsContact C-N 3.31Å; T152-H154 PolarHBondContact O-N 3.38Å; T152-S155 PolarHBondContact O-N 3.41Å; T152-L156 HydrophobicContact CG2-CD1 4.17Å; T152-L156 WeakPolarHBondContact O-CG 3.31Å; T152-L156 PolarHBondContact O-N 2.9Å
153	A	92.1	Very high	89.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.3	-42.1	173.4	0	0	0	0	0	111.2	V149 S155 L156 F157 F180 L218	V149-A153 WeakPolarHBondContact O-CB 3.37Å; V149-A153 PolarHBondContact O-N 3.19Å; A153-S155 PolarHBondContact O-N 3.26Å; A153-L156 PolarHBondContact O-N 3.39Å; A153-F157 HydrophobicContact CB-CD2 4.25Å; A153-F157 HydrophobicContact CB-CE2 3.82Å; A153-F157 HydrophobicContact CB-CZ 4.36Å; A153-F157 WeakPolarHBondContact O-CB 3.03Å; A153-F157 VanDerWaalsContact O-CD2 3.3Å; A153-F157 WeakPolarHBondContact O-CD2 3.43Å; A153-F157 WeakPolarHBondContact O-CG 3.36Å; A153-F157 PolarHBondContact O-N 3.21Å; A153-F180 HydrophobicContact CB-CE1 4.18Å; A153-F180 HydrophobicContact CB-CE2 4.25Å; A153-F180 HydrophobicContact CB-CZ 3.55Å; A153-L218 HydrophobicContact CB-CD1 4.23Å; A153-L218 HydrophobicContact CB-CD2 3.72Å
154	H	92	Very high	89.2	Confident	26 Å²	26	40.5 Å²	40.5	12%	0.12	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-46.3	178.8	174.4	54.7	0	0	0	110.9	L150 R151 T152 L156 F157 K158 L214 L218	L150-H154 VanDerWaalsContact O-CB 3.23Å; L150-H154 WeakPolarHBondContact O-CB 3.46Å; L150-H154 PolarHBondContact O-N 3.28Å; R151-H154 PolarHBondContact O-N 3.21Å; T152-H154 VanDerWaalsContact C-N 3.31Å; T152-H154 PolarHBondContact O-N 3.38Å; H154-L156 VanDerWaalsContact C-N 3.33Å; H154-L156 PolarHBondContact O-N 3.37Å; H154-F157 PolarHBondContact O-N 3Å; H154-K158 WeakPolarHBondContact O-CB 3.3Å; H154-K158 PolarHBondContact O-N 3.41Å; H154-L214 HydrophobicContact CB-CD2 4.5Å; H154-L218 HydrophobicContact CB-CD2 4.29Å; H154-L218 HydrophobicContact CB-CG 4.29Å
155	S	85.9	Confident	89.1	Confident	46 Å²	46	43.2 Å²	43.2	32%	0.322	20%	0.197	S	C	.	.	H	α-helix	trans	-64.9	-35.1	178.7	-60.6	0	0	0	0	112.8	S116 R151 T152 A153	S116-S155 WeakPolarHBondContact OG-CB 3.35Å; R151-S155 PolarHBondContact O-N 3.06Å; R151-S155 PolarHBondContact O-OG 3.04Å; R151-S155 VanDerWaalsContact O-OG 3.09Å; T152-S155 PolarHBondContact O-N 3.41Å; A153-S155 PolarHBondContact O-N 3.26Å
156	L	88.3	Confident	89.1	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-47.4	173.8	-72.9	167.9	0	0	0	112.1	I115 L130 M134 T152 A153 H154 R159	I115-L156 HydrophobicContact CG2-CD1 4.49Å; L130-L156 HydrophobicContact CD2-CD1 3.86Å; M134-L156 HydrophobicContact CE-CD1 4.28Å; M134-L156 HydrophobicContact SD-CD1 4.43Å; T152-L156 HydrophobicContact CG2-CD1 4.17Å; T152-L156 WeakPolarHBondContact O-CG 3.31Å; T152-L156 PolarHBondContact O-N 2.9Å; A153-L156 PolarHBondContact O-N 3.39Å; H154-L156 VanDerWaalsContact C-N 3.33Å; H154-L156 PolarHBondContact O-N 3.37Å; L156-R159 WeakPolarHBondContact O-CG 3.34Å
157	F	92.8	Very high	88.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-90.2	-15.6	-170	-52.4	-23.1	0	0	0	113.4	F123 L131 A153 H154 R159 Y160 V176 F180 L218 S221 L222	F123-F157 HydrophobicContact CE1-CE1 4.42Å; L131-F157 HydrophobicContact CD2-CZ 3.95Å; A153-F157 HydrophobicContact CB-CD2 4.25Å; A153-F157 HydrophobicContact CB-CE2 3.82Å; A153-F157 HydrophobicContact CB-CZ 4.36Å; A153-F157 WeakPolarHBondContact O-CB 3.03Å; A153-F157 VanDerWaalsContact O-CD2 3.3Å; A153-F157 WeakPolarHBondContact O-CD2 3.43Å; A153-F157 WeakPolarHBondContact O-CG 3.36Å; A153-F157 PolarHBondContact O-N 3.21Å; H154-F157 PolarHBondContact O-N 3Å; F157-R159 PolarHBondContact O-N 3.01Å; F157-R159 VanDerWaalsContact O-N 3.15Å; F157-Y160 HydrophobicContact CB-CD2 3.73Å; F157-Y160 HydrophobicContact CB-CE2 3.52Å; F157-Y160 AromaticContact CD1-CE2 3.51Å; F157-Y160 HydrophobicContact CD1-CE2 3.51Å; F157-Y160 AromaticContact CD1-CZ 3.58Å; F157-Y160 VanDerWaalsContact CD1-OH 3.23Å; F157-Y160 WeakPolarHBondContact CD1-OH 3.49Å; F157-Y160 HydrophobicContact CE1-CE2 4.44Å; F157-Y160 HydrophobicContact CG-CD2 4.35Å; F157-Y160 AromaticContact CG-CE2 3.64Å; F157-Y160 HydrophobicContact CG-CE2 3.64Å; F157-Y160 VanDerWaalsContact O-CB 3.27Å; F157-Y160 WeakPolarHBondContact O-CB 3.43Å; F157-Y160 WeakPolarHBondContact O-CD2 3.2Å; F157-Y160 PolarHBondContact O-N 2.89Å; F157-V176 HydrophobicContact CD1-CG1 4.46Å; F157-V176 HydrophobicContact CD1-CG2 4.47Å; F157-V176 HydrophobicContact CD2-CG1 4.2Å; F157-V176 HydrophobicContact CE1-CG1 3.89Å; F157-V176 HydrophobicContact CE1-CG2 3.76Å; F157-V176 HydrophobicContact CE2-CG1 3.6Å; F157-V176 HydrophobicContact CZ-CB 4.42Å; F157-V176 HydrophobicContact CZ-CG1 3.44Å; F157-V176 VanDerWaalsContact CZ-CG1 3.44Å; F157-V176 HydrophobicContact CZ-CG2 4.02Å; F157-F180 HydrophobicContact CE2-CD1 4.1Å; F157-F180 HydrophobicContact CE2-CE1 4.06Å; F157-F180 HydrophobicContact CE2-CG 4.4Å; F157-F180 HydrophobicContact CE2-CZ 4.33Å; F157-L218 HydrophobicContact CD2-CD2 3.54Å; F157-L218 HydrophobicContact CE2-CD2 4.16Å; F157-L218 HydrophobicContact CG-CD2 4.46Å; F157-S221 WeakPolarHBondContact O-CB 3.38Å; F157-L222 HydrophobicContact CD2-CD2 3.9Å; F157-L222 HydrophobicContact CD2-CG 4.45Å; F157-L222 HydrophobicContact CE2-CD2 4.42Å; F157-L222 HydrophobicContact CG-CD2 4.31Å
158	K	90.5	Very high	88.8	Confident	101 Å²	101	56 Å²	56	44%	0.439	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-55.3	-32.2	175.9	-177.6	-178.1	177.9	-174.3	0	112	H154 Y160 R161	H154-K158 WeakPolarHBondContact O-CB 3.3Å; H154-K158 PolarHBondContact O-N 3.41Å; K158-Y160 PolarHBondContact O-N 3.24Å; K158-R161 WeakPolarHBondContact O-CB 3.38Å; K158-R161 WeakPolarHBondContact O-CG 3.32Å; K158-R161 PolarHBondContact O-N 3.23Å; K158-R161 VanDerWaalsContact O-N 3.15Å
159	R	89.6	Confident	89	Confident	27 Å²	27	56.6 Å²	56.6	10%	0.102	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-59.2	-30	177.4	76.9	-176.1	177.6	-140.9	18	112.9	G119 L156 F157 R161 H162 E163 E172	G119-R159 PolarHBondContact O-NH1 2.92Å; G119-R159 PolarHBondContact O-NH2 3.34Å; G119-R159 VanDerWaalsContact O-NH2 3.11Å; L156-R159 WeakPolarHBondContact O-CG 3.34Å; F157-R159 PolarHBondContact O-N 3.01Å; F157-R159 VanDerWaalsContact O-N 3.15Å; R159-R161 PolarHBondContact O-N 3.06Å; R159-H162 PolarHBondContact O-N 3.29Å; R159-E163 HydrophobicContact CB-CG 4.19Å; R159-E163 HydrophobicContact CG-CG 4.16Å; R159-E163 WeakPolarHBondContact O-CG 3.39Å; R159-E163 PolarHBondContact O-N 3.05Å; R159-E172 IonicContact CZ-OE1 3.13Å; R159-E172 IonicContact NE-OE1 3.89Å; R159-E172 VanDerWaalsContact NH2-CD 3.26Å; R159-E172 IonicContact NH2-OE1 3.93Å; R159-E172 PolarHBondContact NH2-OE1 3.34Å; R159-E172 IonicContact NH2-OE2 2.82Å; R159-E172 PolarHBondContact NH2-OE2 3.15Å
160	Y	92.6	Very high	89.1	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-58.8	-19.5	179.4	-54.5	-21	0	0	0	112.5	F157 K158 H162 L169 E172 I173 L222 Q225	F157-Y160 HydrophobicContact CB-CD2 3.73Å; F157-Y160 HydrophobicContact CB-CE2 3.52Å; F157-Y160 AromaticContact CD1-CE2 3.51Å; F157-Y160 HydrophobicContact CD1-CE2 3.51Å; F157-Y160 AromaticContact CD1-CZ 3.58Å; F157-Y160 VanDerWaalsContact CD1-OH 3.23Å; F157-Y160 WeakPolarHBondContact CD1-OH 3.49Å; F157-Y160 HydrophobicContact CE1-CE2 4.44Å; F157-Y160 HydrophobicContact CG-CD2 4.35Å; F157-Y160 AromaticContact CG-CE2 3.64Å; F157-Y160 HydrophobicContact CG-CE2 3.64Å; F157-Y160 VanDerWaalsContact O-CB 3.27Å; F157-Y160 WeakPolarHBondContact O-CB 3.43Å; F157-Y160 WeakPolarHBondContact O-CD2 3.2Å; F157-Y160 PolarHBondContact O-N 2.89Å; K158-Y160 PolarHBondContact O-N 3.24Å; Y160-H162 VanDerWaalsContact C-N 3.29Å; Y160-H162 PolarHBondContact O-N 3.4Å; Y160-L169 HydrophobicContact CD1-CD1 3.63Å; Y160-L169 HydrophobicContact CE1-CD1 3.95Å; Y160-E172 WeakPolarHBondContact CE1-OE1 3.41Å; Y160-E172 VanDerWaalsContact CZ-OE1 3.28Å; Y160-E172 PolarHBondContact OH-OE1 3.31Å; Y160-I173 HydrophobicContact CD1-CD1 4.35Å; Y160-I173 HydrophobicContact CD1-CG1 4.25Å; Y160-I173 HydrophobicContact CD2-CD1 4.18Å; Y160-I173 HydrophobicContact CD2-CG1 3.87Å; Y160-I173 HydrophobicContact CE1-CG1 4.23Å; Y160-I173 HydrophobicContact CE2-CG1 3.85Å; Y160-I173 HydrophobicContact CG-CD1 4.04Å; Y160-I173 HydrophobicContact CG-CG1 4.09Å; Y160-L222 HydrophobicContact CE2-CD2 4.3Å; Y160-Q225 VanDerWaalsContact O-CG 3.28Å; Y160-Q225 WeakPolarHBondContact O-CG 3.41Å; Y160-Q225 PolarHBondContact O-NE2 3.13Å
161	R	91.3	Very high	89.1	Confident	36 Å²	36	66.5 Å²	66.5	14%	0.136	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-73.4	-21	176.6	-55.5	169.1	-169.4	-159.8	-4.7	113.8	K158 R159 K217 Y220 S221 F224	K158-R161 WeakPolarHBondContact O-CB 3.38Å; K158-R161 WeakPolarHBondContact O-CG 3.32Å; K158-R161 PolarHBondContact O-N 3.23Å; K158-R161 VanDerWaalsContact O-N 3.15Å; R159-R161 PolarHBondContact O-N 3.06Å; R161-K217 PolarHBondContact NH2-O 3.38Å; R161-Y220 HydrophobicContact CG-CD1 4.2Å; R161-Y220 HydrophobicContact CG-CE1 4.15Å; R161-Y220 VanDerWaalsContact CZ-CD1 3.43Å; R161-S221 PolarHBondContact NE-OG 3.37Å; R161-S221 PolarHBondContact NH2-OG 3.43Å; R161-F224 VanDerWaalsContact CA-CD1 3.45Å; R161-F224 HydrophobicContact CB-CD1 4.17Å; R161-F224 HydrophobicContact CB-CD2 4.23Å; R161-F224 HydrophobicContact CB-CE1 4.33Å; R161-F224 HydrophobicContact CB-CE2 4.38Å; R161-F224 HydrophobicContact CB-CG 4.09Å; R161-F224 HydrophobicContact CB-CZ 4.41Å; R161-F224 HydrophobicContact CG-CB 4.17Å; R161-F224 HydrophobicContact CG-CD2 4.1Å; R161-F224 HydrophobicContact CG-CG 4.02Å; R161-F224 WeakPolarHBondContact O-CE1 3.23Å; R161-F224 WeakPolarHBondContact O-CZ 3.45Å
162	H	86.8	Confident	89.3	Confident	142 Å²	142	63.4 Å²	63.4	66%	0.657	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	-16.9	-168.9	-50.2	-59.7	0	0	0	112.9	R159 Y160	R159-H162 PolarHBondContact O-N 3.29Å; Y160-H162 VanDerWaalsContact C-N 3.29Å; Y160-H162 PolarHBondContact O-N 3.4Å
163	E	84.4	Confident	89.7	Confident	87 Å²	87	64.1 Å²	64.1	41%	0.407	31%	0.308	S	S	.	.	S	Bend	trans	-70.2	142.9	176.1	-70.7	-68.8	174.1	0	0	112.2	R159 L169 Q225	R159-E163 HydrophobicContact CB-CG 4.19Å; R159-E163 HydrophobicContact CG-CG 4.16Å; R159-E163 WeakPolarHBondContact O-CG 3.39Å; R159-E163 PolarHBondContact O-N 3.05Å; E163-L169 HydrophobicContact CB-CD1 4.35Å; E163-L169 HydrophobicContact CB-CD2 3.81Å; E163-Q225 PolarHBondContact O-NE2 2.66Å
164	F	85.9	Confident	89.9	Confident	183 Å²	183	70.5 Å²	70.5	80%	0.803	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-69.9	148.3	173.4	-68.5	-78.3	0	0	0	111	S166 L169	F164-S166 PolarHBondContact O-N 3.32Å; F164-L169 WeakPolarHBondContact O-CD2 3.45Å
165	K	84.8	Confident	90	Very high	135 Å²	135	72.9 Å²	72.9	59%	0.587	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-62.3	124	178	-69.6	179.9	171	-160.6	0	110.3	W170 Q225	K165-W170 HydrophobicContact CB-CZ2 4.31Å; K165-W170 HydrophobicContact CD-CZ2 3.82Å; K165-W170 HydrophobicContact CG-CZ2 4.1Å; K165-Q225 VanDerWaalsContact CG-OE1 3.26Å
166	S	88.1	Confident	90.4	Very high	45 Å²	45	70.7 Å²	70.7	32%	0.315	33%	0.333	S	S	.	.			trans	-145.8	159.4	174.6	72.9	0	0	0	0	111.1	F164 E168 L169 W170	F164-S166 PolarHBondContact O-N 3.32Å; S166-E168 WeakPolarHBondContact CB-OE2 3.26Å; S166-E168 PolarHBondContact O-N 3.05Å; S166-E168 PolarHBondContact OG-OE2 3.37Å; S166-L169 PolarHBondContact O-N 3.46Å; S166-L169 VanDerWaalsContact OG-CB 3.3Å; S166-L169 WeakPolarHBondContact OG-CB 2.87Å; S166-L169 PolarHBondContact OG-N 2.9Å; S166-W170 PolarHBondContact O-N 3.01Å
167	N	88.9	Confident	90.8	Very high	126 Å²	126	71.9 Å²	71.9	67%	0.674	34%	0.34	S	S	*	.	H	α-helix	trans	-63.5	-35.6	176.9	-72.6	-26.4	0	0	0	111.2	T171	N167-T171 VanDerWaalsContact O-CB 3.31Å; N167-T171 WeakPolarHBondContact O-CB 3.17Å; N167-T171 PolarHBondContact O-N 3.42Å; N167-T171 PolarHBondContact O-OG1 3.08Å
168	E	87.8	Confident	90.9	Very high	137 Å²	137	77.8 Å²	77.8	64%	0.64	37%	0.371	S	S	*	.	H	α-helix	trans	-63.2	-49.7	176.2	-62.6	76.1	-164.3	0	0	110.8	S166 W170 T171 E172	S166-E168 WeakPolarHBondContact CB-OE2 3.26Å; S166-E168 PolarHBondContact O-N 3.05Å; S166-E168 PolarHBondContact OG-OE2 3.37Å; E168-W170 PolarHBondContact O-N 3.24Å; E168-T171 PolarHBondContact O-N 2.94Å; E168-E172 PolarHBondContact O-N 3.19Å
169	L	90	Very high	91	Very high	12 Å²	12	74.5 Å²	74.5	6%	0.063	36%	0.363	C	S	.	.	H	α-helix	trans	-60.8	-44.9	179.1	177.9	66	0	0	0	111.2	Y160 E163 F164 S166 E172 I173 Q225	Y160-L169 HydrophobicContact CD1-CD1 3.63Å; Y160-L169 HydrophobicContact CE1-CD1 3.95Å; E163-L169 HydrophobicContact CB-CD1 4.35Å; E163-L169 HydrophobicContact CB-CD2 3.81Å; F164-L169 WeakPolarHBondContact O-CD2 3.45Å; S166-L169 PolarHBondContact O-N 3.46Å; S166-L169 VanDerWaalsContact OG-CB 3.3Å; S166-L169 WeakPolarHBondContact OG-CB 2.87Å; S166-L169 PolarHBondContact OG-N 2.9Å; L169-E172 WeakPolarHBondContact O-CB 3.45Å; L169-E172 PolarHBondContact O-N 3.27Å; L169-I173 HydrophobicContact CD1-CD1 4.02Å; L169-I173 HydrophobicContact CD1-CG1 4.35Å; L169-I173 HydrophobicContact CD2-CD1 4.42Å; L169-I173 HydrophobicContact CG-CD1 3.86Å; L169-I173 HydrophobicContact CG-CG1 4.5Å; L169-I173 WeakPolarHBondContact O-CG1 3.44Å; L169-I173 PolarHBondContact O-N 3.42Å; L169-Q225 HydrophobicContact CD2-CG 4.45Å
170	W	92.1	Very high	91.3	Very high	110 Å²	110	73.2 Å²	73.2	42%	0.417	36%	0.358	S	S	.	.	H	α-helix	trans	-69.9	-35	-179.3	-73.4	4.3	0	0	0	112.9	K165 S166 E168 E172 I173 K174	K165-W170 HydrophobicContact CB-CZ2 4.31Å; K165-W170 HydrophobicContact CD-CZ2 3.82Å; K165-W170 HydrophobicContact CG-CZ2 4.1Å; S166-W170 PolarHBondContact O-N 3.01Å; E168-W170 PolarHBondContact O-N 3.24Å; W170-E172 VanDerWaalsContact C-N 3.32Å; W170-I173 PolarHBondContact O-N 2.99Å; W170-K174 VanDerWaalsContact O-CB 3.31Å; W170-K174 WeakPolarHBondContact O-CB 3.4Å; W170-K174 PolarHBondContact O-N 3.45Å
171	T	93	Very high	91.5	Very high	99 Å²	99	73.2 Å²	73.2	61%	0.607	36%	0.358	S	S	*	.	H	α-helix	trans	-63.6	-41.2	173.1	-58.2	0	0	0	0	110.8	N167 E168 L175	N167-T171 VanDerWaalsContact O-CB 3.31Å; N167-T171 WeakPolarHBondContact O-CB 3.17Å; N167-T171 PolarHBondContact O-N 3.42Å; N167-T171 PolarHBondContact O-OG1 3.08Å; E168-T171 PolarHBondContact O-N 2.94Å; T171-L175 PolarHBondContact O-N 3.21Å; T171-L175 VanDerWaalsContact O-N 3.13Å
172	E	93.4	Very high	91.7	Very high	17 Å²	17	75.7 Å²	75.7	8%	0.079	37%	0.373	C	S	.	.	H	α-helix	trans	-63.3	-51.9	173.6	178.9	-176.2	141.1	0	0	111.7	F123 P124 R159 Y160 E168 L169 W170 K174 L175 V176	F123-E172 HydrophobicContact CD1-CG 4.04Å; F123-E172 HydrophobicContact CE1-CG 3.56Å; F123-E172 HydrophobicContact CZ-CG 4.42Å; P124-E172 HydrophobicContact CG-CB 4.18Å; P124-E172 HydrophobicContact CG-CG 4.09Å; R159-E172 IonicContact CZ-OE1 3.13Å; R159-E172 IonicContact NE-OE1 3.89Å; R159-E172 VanDerWaalsContact NH2-CD 3.26Å; R159-E172 IonicContact NH2-OE1 3.93Å; R159-E172 PolarHBondContact NH2-OE1 3.34Å; R159-E172 IonicContact NH2-OE2 2.82Å; R159-E172 PolarHBondContact NH2-OE2 3.15Å; Y160-E172 WeakPolarHBondContact CE1-OE1 3.41Å; Y160-E172 VanDerWaalsContact CZ-OE1 3.28Å; Y160-E172 PolarHBondContact OH-OE1 3.31Å; E168-E172 PolarHBondContact O-N 3.19Å; L169-E172 WeakPolarHBondContact O-CB 3.45Å; L169-E172 PolarHBondContact O-N 3.27Å; W170-E172 VanDerWaalsContact C-N 3.32Å; E172-K174 VanDerWaalsContact C-N 3.26Å; E172-K174 PolarHBondContact O-N 3.01Å; E172-L175 WeakPolarHBondContact O-CB 3.5Å; E172-L175 PolarHBondContact O-N 3.48Å; E172-L175 VanDerWaalsContact O-N 3.13Å; E172-V176 HydrophobicContact CG-CG2 4.5Å; E172-V176 WeakPolarHBondContact O-CG2 3.45Å; E172-V176 PolarHBondContact O-N 2.91Å
173	I	94.3	Very high	92.2	Very high	17 Å²	17	70.4 Å²	70.4	9%	0.087	35%	0.352	C	S	.	.	H	α-helix	trans	-57.4	-43.1	179.7	-71.8	171.1	0	0	0	110.2	Y160 L169 W170 L175 V176 L177 Q225	Y160-I173 HydrophobicContact CD1-CD1 4.35Å; Y160-I173 HydrophobicContact CD1-CG1 4.25Å; Y160-I173 HydrophobicContact CD2-CD1 4.18Å; Y160-I173 HydrophobicContact CD2-CG1 3.87Å; Y160-I173 HydrophobicContact CE1-CG1 4.23Å; Y160-I173 HydrophobicContact CE2-CG1 3.85Å; Y160-I173 HydrophobicContact CG-CD1 4.04Å; Y160-I173 HydrophobicContact CG-CG1 4.09Å; L169-I173 HydrophobicContact CD1-CD1 4.02Å; L169-I173 HydrophobicContact CD1-CG1 4.35Å; L169-I173 HydrophobicContact CD2-CD1 4.42Å; L169-I173 HydrophobicContact CG-CD1 3.86Å; L169-I173 HydrophobicContact CG-CG1 4.5Å; L169-I173 WeakPolarHBondContact O-CG1 3.44Å; L169-I173 PolarHBondContact O-N 3.42Å; W170-I173 PolarHBondContact O-N 2.99Å; I173-L175 PolarHBondContact O-N 3.23Å; I173-V176 WeakPolarHBondContact O-CB 3.42Å; I173-V176 PolarHBondContact O-N 3.45Å; I173-L177 HydrophobicContact CG2-CD1 3.6Å; I173-L177 HydrophobicContact CG2-CG 4.12Å; I173-L177 WeakPolarHBondContact O-CB 3.43Å; I173-L177 WeakPolarHBondContact O-CD1 3.36Å; I173-L177 WeakPolarHBondContact O-CG 3.2Å; I173-L177 PolarHBondContact O-N 3.12Å; I173-Q225 HydrophobicContact CD1-CB 4.2Å; I173-Q225 HydrophobicContact CD1-CG 3.98Å
174	K	94.8	Very high	92.8	Very high	133 Å²	133	66.3 Å²	66.3	58%	0.578	33%	0.332	S	S	*	.	H	α-helix	trans	-58.9	-47.5	176.4	-172.2	-178.4	178.4	-171.3	0	112.2	W170 E172 V176 L177 D178	W170-K174 VanDerWaalsContact O-CB 3.31Å; W170-K174 WeakPolarHBondContact O-CB 3.4Å; W170-K174 PolarHBondContact O-N 3.45Å; E172-K174 VanDerWaalsContact C-N 3.26Å; E172-K174 PolarHBondContact O-N 3.01Å; K174-V176 VanDerWaalsContact C-N 3.28Å; K174-V176 PolarHBondContact O-N 2.94Å; K174-L177 PolarHBondContact O-N 3.48Å; K174-L177 VanDerWaalsContact O-N 3.15Å; K174-D178 VanDerWaalsContact O-CG 3.31Å; K174-D178 PolarHBondContact O-N 3.22Å
175	L	94.2	Very high	93.4	Very high	76 Å²	76	57.6 Å²	57.6	40%	0.398	29%	0.294	S	S	.	.	H	α-helix	trans	-58.7	-41.7	175.9	-175	81.9	0	0	0	111.7	P124 L131 T171 E172 I173 A179	P124-L175 HydrophobicContact CB-CD2 3.26Å; P124-L175 HydrophobicContact CG-CD2 3.91Å; L131-L175 HydrophobicContact CD1-CD2 4.14Å; L131-L175 HydrophobicContact CD1-CG 4.14Å; T171-L175 PolarHBondContact O-N 3.21Å; T171-L175 VanDerWaalsContact O-N 3.13Å; E172-L175 WeakPolarHBondContact O-CB 3.5Å; E172-L175 PolarHBondContact O-N 3.48Å; E172-L175 VanDerWaalsContact O-N 3.13Å; I173-L175 PolarHBondContact O-N 3.23Å; L175-A179 PolarHBondContact O-N 3.36Å
176	V	95.7	Very high	94	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-46	175.4	174.7	0	0	0	0	110.6	F123 L131 F157 E172 I173 K174 A179 F180 L222	F123-V176 HydrophobicContact CE1-CG2 3.69Å; F123-V176 HydrophobicContact CZ-CG2 3.59Å; L131-V176 HydrophobicContact CD1-CB 4.49Å; L131-V176 HydrophobicContact CD1-CG2 4.07Å; L131-V176 HydrophobicContact CD2-CG1 4.4Å; L131-V176 HydrophobicContact CD2-CG2 4.26Å; F157-V176 HydrophobicContact CD1-CG1 4.46Å; F157-V176 HydrophobicContact CD1-CG2 4.47Å; F157-V176 HydrophobicContact CD2-CG1 4.2Å; F157-V176 HydrophobicContact CE1-CG1 3.89Å; F157-V176 HydrophobicContact CE1-CG2 3.76Å; F157-V176 HydrophobicContact CE2-CG1 3.6Å; F157-V176 HydrophobicContact CZ-CB 4.42Å; F157-V176 HydrophobicContact CZ-CG1 3.44Å; F157-V176 VanDerWaalsContact CZ-CG1 3.44Å; F157-V176 HydrophobicContact CZ-CG2 4.02Å; E172-V176 HydrophobicContact CG-CG2 4.5Å; E172-V176 WeakPolarHBondContact O-CG2 3.45Å; E172-V176 PolarHBondContact O-N 2.91Å; I173-V176 WeakPolarHBondContact O-CB 3.42Å; I173-V176 PolarHBondContact O-N 3.45Å; K174-V176 VanDerWaalsContact C-N 3.28Å; K174-V176 PolarHBondContact O-N 2.94Å; V176-A179 PolarHBondContact O-N 3.14Å; V176-F180 HydrophobicContact CG1-CB 4.06Å; V176-F180 WeakPolarHBondContact O-CA 3.46Å; V176-F180 WeakPolarHBondContact O-CB 3.35Å; V176-F180 PolarHBondContact O-N 2.95Å; V176-L222 HydrophobicContact CG1-CD2 3.63Å
177	L	96	Very high	94.4	Very high	27 Å²	27	53.6 Å²	53.6	14%	0.141	28%	0.276	C	S	.	.	H	α-helix	trans	-61.8	-47.2	-179.6	-69.3	163.1	0	0	0	111.7	I173 K174 A179 F180 A181 L222 P228 F231	I173-L177 HydrophobicContact CG2-CD1 3.6Å; I173-L177 HydrophobicContact CG2-CG 4.12Å; I173-L177 WeakPolarHBondContact O-CB 3.43Å; I173-L177 WeakPolarHBondContact O-CD1 3.36Å; I173-L177 WeakPolarHBondContact O-CG 3.2Å; I173-L177 PolarHBondContact O-N 3.12Å; K174-L177 PolarHBondContact O-N 3.48Å; K174-L177 VanDerWaalsContact O-N 3.15Å; L177-A179 PolarHBondContact O-N 3.36Å; L177-F180 PolarHBondContact O-N 2.79Å; L177-A181 HydrophobicContact CD2-CB 4.34Å; L177-A181 WeakPolarHBondContact O-CB 3.34Å; L177-A181 PolarHBondContact O-N 3.42Å; L177-L222 HydrophobicContact CD2-CB 4.36Å; L177-P228 HydrophobicContact CD1-CB 3.64Å; L177-P228 HydrophobicContact CD1-CG 3.66Å; L177-P228 HydrophobicContact CD2-CB 3.65Å; L177-P228 HydrophobicContact CD2-CG 3.51Å; L177-P228 HydrophobicContact CG-CB 4.22Å; L177-P228 HydrophobicContact CG-CG 4.22Å; L177-F231 HydrophobicContact CD2-CD2 4.12Å; L177-F231 HydrophobicContact CD2-CE2 3.63Å
178	D	94.7	Very high	94.8	Very high	124 Å²	124	47.6 Å²	47.6	66%	0.663	24%	0.244	S	C	*	.	H	α-helix	trans	-58	-36.9	179.9	-71.2	-18.4	0	0	0	112	K174	K174-D178 VanDerWaalsContact O-CG 3.31Å; K174-D178 PolarHBondContact O-N 3.22Å
179	A	93.2	Very high	95.3	Very high	32 Å²	32	45 Å²	45	26%	0.264	23%	0.23	S	C	.	.	H	α-helix	trans	-93	-31.2	-178.2	0	0	0	0	0	114.1	L131 V135 L175 V176 L177 P183	L131-A179 HydrophobicContact CB-CB 4.3Å; L131-A179 HydrophobicContact CD1-CB 4.14Å; V135-A179 WeakPolarHBondContact CG2-O 3.37Å; L175-A179 PolarHBondContact O-N 3.36Å; V176-A179 PolarHBondContact O-N 3.14Å; L177-A179 PolarHBondContact O-N 3.36Å; A179-P183 WeakPolarHBondContact O-CD 3.32Å; A179-P183 WeakPolarHBondContact O-CG 3.39Å
180	F	94.9	Very high	95.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-114	-27.5	-161.3	-154.1	-97.2	0	0	0	113.8	L131 V135 F138 A153 F157 V176 L177 L182 P183 L184 L218 L222	L131-F180 HydrophobicContact CD2-CD2 4.09Å; V135-F180 HydrophobicContact CG2-CD2 3.56Å; V135-F180 HydrophobicContact CG2-CE2 4.15Å; V135-F180 HydrophobicContact CG2-CG 4.44Å; F138-F180 HydrophobicContact CE2-CD2 4.42Å; F138-F180 HydrophobicContact CE2-CE1 4.37Å; F138-F180 AromaticContact CE2-CE2 3.78Å; F138-F180 HydrophobicContact CE2-CE2 3.78Å; F138-F180 AromaticContact CE2-CZ 3.78Å; F138-F180 HydrophobicContact CE2-CZ 3.78Å; F138-F180 HydrophobicContact CZ-CE1 4.25Å; F138-F180 AromaticContact CZ-CE2 3.78Å; F138-F180 HydrophobicContact CZ-CE2 3.78Å; F138-F180 AromaticContact CZ-CZ 3.46Å; F138-F180 HydrophobicContact CZ-CZ 3.46Å; F138-F180 VanDerWaalsContact CZ-CZ 3.46Å; A153-F180 HydrophobicContact CB-CE1 4.18Å; A153-F180 HydrophobicContact CB-CE2 4.25Å; A153-F180 HydrophobicContact CB-CZ 3.55Å; F157-F180 HydrophobicContact CE2-CD1 4.1Å; F157-F180 HydrophobicContact CE2-CE1 4.06Å; F157-F180 HydrophobicContact CE2-CG 4.4Å; F157-F180 HydrophobicContact CE2-CZ 4.33Å; V176-F180 HydrophobicContact CG1-CB 4.06Å; V176-F180 WeakPolarHBondContact O-CA 3.46Å; V176-F180 WeakPolarHBondContact O-CB 3.35Å; V176-F180 PolarHBondContact O-N 2.95Å; L177-F180 PolarHBondContact O-N 2.79Å; F180-L182 PolarHBondContact O-N 3.02Å; F180-P183 WeakPolarHBondContact O-CD 3.47Å; F180-L184 HydrophobicContact CD1-CB 4.08Å; F180-L184 HydrophobicContact CD1-CD2 4.28Å; F180-L184 HydrophobicContact CE1-CB 4.23Å; F180-L184 HydrophobicContact CE1-CD1 4.07Å; F180-L184 HydrophobicContact CE1-CD2 4.23Å; F180-L184 HydrophobicContact CE1-CG 4.41Å; F180-L184 WeakPolarHBondContact O-CB 3.42Å; F180-L184 PolarHBondContact O-N 2.84Å; F180-L218 HydrophobicContact CE1-CD1 4.28Å; F180-L218 HydrophobicContact CE1-CD2 4.44Å; F180-L222 HydrophobicContact CD1-CD1 4.35Å
181	A	96.6	Very high	95.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.4	-44.8	-172.3	0	0	0	0	0	112.9	L177 T185 F230 F231	L177-A181 HydrophobicContact CD2-CB 4.34Å; L177-A181 WeakPolarHBondContact O-CB 3.34Å; L177-A181 PolarHBondContact O-N 3.42Å; A181-T185 WeakPolarHBondContact O-CB 3.27Å; A181-T185 PolarHBondContact O-N 2.92Å; A181-T185 PolarHBondContact O-OG1 2.98Å; A181-F230 HydrophobicContact CB-CB 4.21Å; A181-F230 HydrophobicContact CB-CD1 3.43Å; A181-F230 VanDerWaalsContact CB-CD1 3.43Å; A181-F230 HydrophobicContact CB-CE1 4.01Å; A181-F230 HydrophobicContact CB-CG 3.78Å; A181-F230 WeakPolarHBondContact O-CE1 3.48Å; A181-F231 HydrophobicContact CB-CE2 4.13Å; A181-F231 HydrophobicContact CB-CZ 3.97Å
182	L	97	Very high	95.8	Very high	88 Å²	88	37.6 Å²	37.6	46%	0.461	20%	0.201	S	C	.	.	H	α-helix	trans	-66.3	-51.9	176.3	173.2	65.5	0	0	0	112.5	F180 L184 T185 N186 F230	F180-L182 PolarHBondContact O-N 3.02Å; L182-L184 VanDerWaalsContact C-N 3.32Å; L182-L184 PolarHBondContact O-N 3.49Å; L182-T185 PolarHBondContact O-N 3.35Å; L182-N186 PolarHBondContact O-N 3.11Å; L182-F230 HydrophobicContact CB-CE2 3.65Å; L182-F230 HydrophobicContact CB-CZ 3.71Å; L182-F230 HydrophobicContact CD1-CE2 3.98Å; L182-F230 HydrophobicContact CD1-CZ 3.82Å; L182-F230 HydrophobicContact CG-CE2 4.37Å; L182-F230 HydrophobicContact CG-CZ 4.4Å
183	P	96.4	Very high	95.9	Very high	31 Å²	31	43.2 Å²	43.2	20%	0.201	23%	0.227	C	C	.	.	H	α-helix	trans	-57.8	-41.1	175.5	-27.4	35.7	0	0	0	113.7	V135 F138 A179 F180 T185 N186 L187	V135-P183 HydrophobicContact CG1-CB 3.79Å; V135-P183 HydrophobicContact CG1-CG 3.49Å; V135-P183 VanDerWaalsContact CG1-CG 3.49Å; V135-P183 HydrophobicContact CG2-CB 4.49Å; V135-P183 HydrophobicContact CG2-CG 4.33Å; F138-P183 HydrophobicContact CD2-CB 3.92Å; F138-P183 HydrophobicContact CE2-CB 4.34Å; A179-P183 WeakPolarHBondContact O-CD 3.32Å; A179-P183 WeakPolarHBondContact O-CG 3.39Å; F180-P183 WeakPolarHBondContact O-CD 3.47Å; P183-T185 VanDerWaalsContact C-N 3.35Å; P183-T185 PolarHBondContact O-N 3.11Å; P183-N186 PolarHBondContact O-N 3.29Å; P183-L187 VanDerWaalsContact O-CB 3.32Å; P183-L187 WeakPolarHBondContact O-CB 3.45Å; P183-L187 PolarHBondContact O-N 2.99Å
184	L	97.4	Very high	95.9	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-42	177	-176.2	67.6	0	0	0	111.5	L150 F180 L182 L187 F188 I215 L218 L222 W238	L150-L184 HydrophobicContact CD2-CD1 3.86Å; F180-L184 HydrophobicContact CD1-CB 4.08Å; F180-L184 HydrophobicContact CD1-CD2 4.28Å; F180-L184 HydrophobicContact CE1-CB 4.23Å; F180-L184 HydrophobicContact CE1-CD1 4.07Å; F180-L184 HydrophobicContact CE1-CD2 4.23Å; F180-L184 HydrophobicContact CE1-CG 4.41Å; F180-L184 WeakPolarHBondContact O-CB 3.42Å; F180-L184 PolarHBondContact O-N 2.84Å; L182-L184 VanDerWaalsContact C-N 3.32Å; L182-L184 PolarHBondContact O-N 3.49Å; L184-L187 PolarHBondContact O-N 3.13Å; L184-F188 WeakPolarHBondContact O-CB 3.12Å; L184-F188 PolarHBondContact O-N 3.45Å; L184-I215 HydrophobicContact CD1-CB 4.34Å; L184-I215 HydrophobicContact CD1-CG1 3.97Å; L184-I215 HydrophobicContact CD1-CG2 4.03Å; L184-I215 HydrophobicContact CG-CG2 4.32Å; L184-L218 HydrophobicContact CD1-CB 4.48Å; L184-L218 HydrophobicContact CD1-CD1 4Å; L184-L218 HydrophobicContact CD2-CB 3.92Å; L184-L222 HydrophobicContact CD2-CD1 3.96Å; L184-W238 HydrophobicContact CG-CH2 4.35Å
185	T	97.9	Very high	95.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.9	-39.1	178.3	-59.5	0	0	0	0	111.9	A181 L182 P183 F188 K189 F230 T237 W238	A181-T185 WeakPolarHBondContact O-CB 3.27Å; A181-T185 PolarHBondContact O-N 2.92Å; A181-T185 PolarHBondContact O-OG1 2.98Å; L182-T185 PolarHBondContact O-N 3.35Å; P183-T185 VanDerWaalsContact C-N 3.35Å; P183-T185 PolarHBondContact O-N 3.11Å; T185-F188 WeakPolarHBondContact O-CB 3.11Å; T185-F188 PolarHBondContact O-N 3.44Å; T185-K189 WeakPolarHBondContact O-CG 3.47Å; T185-K189 PolarHBondContact O-N 3.14Å; T185-K189 VanDerWaalsContact O-N 3.09Å; T185-F230 HydrophobicContact CG2-CE1 4.45Å; T185-F230 WeakPolarHBondContact OG1-CE1 3.22Å; T185-T237 HydrophobicContact CG2-CG2 4.13Å; T185-W238 HydrophobicContact CG2-CZ2 4.36Å; T185-W238 VanDerWaalsContact OG1-CZ2 3.29Å; T185-W238 WeakPolarHBondContact OG1-CZ2 3.33Å; T185-W238 PolarHBondContact OG1-NE1 3.29Å; T185-W238 VanDerWaalsContact OG1-NE1 3.09Å
186	N	97.1	Very high	95.5	Very high	82 Å²	82	39.9 Å²	39.9	44%	0.439	22%	0.223	S	C	.	.	H	α-helix	trans	-65.7	-42.1	174.1	-71	-19.4	0	0	0	111.4	L182 P183 F188 K189 A190	L182-N186 PolarHBondContact O-N 3.11Å; P183-N186 PolarHBondContact O-N 3.29Å; N186-F188 VanDerWaalsContact C-N 3.34Å; N186-F188 PolarHBondContact O-N 3.36Å; N186-K189 PolarHBondContact O-N 2.61Å; N186-A190 WeakPolarHBondContact O-CB 3.46Å; N186-A190 PolarHBondContact O-N 3.49Å
187	L	96.8	Very high	95.3	Very high	15 Å²	15	44.6 Å²	44.6	8%	0.079	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-40.7	175.1	-180	64.6	0	0	0	111.6	F138 I146 L150 P183 L184 A190 T191 I215	F138-L187 HydrophobicContact CD1-CD2 3.77Å; F138-L187 HydrophobicContact CD2-CD2 4.39Å; F138-L187 HydrophobicContact CE1-CD2 3.79Å; F138-L187 HydrophobicContact CE2-CD2 4.43Å; F138-L187 HydrophobicContact CG-CD2 4.06Å; F138-L187 HydrophobicContact CZ-CD2 4.13Å; I146-L187 HydrophobicContact CD1-CD1 4.26Å; I146-L187 HydrophobicContact CG2-CD1 3.99Å; I146-L187 HydrophobicContact CG2-CD2 3.64Å; I146-L187 HydrophobicContact CG2-CG 4.4Å; L150-L187 HydrophobicContact CD1-CD2 4.23Å; L150-L187 HydrophobicContact CD2-CD2 3.97Å; L150-L187 HydrophobicContact CG-CD2 4.36Å; P183-L187 VanDerWaalsContact O-CB 3.32Å; P183-L187 WeakPolarHBondContact O-CB 3.45Å; P183-L187 PolarHBondContact O-N 2.99Å; L184-L187 PolarHBondContact O-N 3.13Å; L187-A190 PolarHBondContact O-N 3.39Å; L187-T191 VanDerWaalsContact O-CB 3.27Å; L187-T191 WeakPolarHBondContact O-CB 3.27Å; L187-T191 PolarHBondContact O-N 2.84Å; L187-T191 PolarHBondContact O-OG1 3.27Å; L187-I215 HydrophobicContact CD2-CD1 4.12Å; L187-I215 HydrophobicContact CG-CD1 4.01Å
188	F	97.9	Very high	94.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.7	-51.6	175.1	178.4	-122.8	0	0	0	111.7	L184 T185 N186 T191 I192 L212 I215 W238 N241 F242 L245	L184-F188 WeakPolarHBondContact O-CB 3.12Å; L184-F188 PolarHBondContact O-N 3.45Å; T185-F188 WeakPolarHBondContact O-CB 3.11Å; T185-F188 PolarHBondContact O-N 3.44Å; N186-F188 VanDerWaalsContact C-N 3.34Å; N186-F188 PolarHBondContact O-N 3.36Å; F188-T191 PolarHBondContact O-N 2.73Å; F188-I192 HydrophobicContact CD1-CD1 4.2Å; F188-I192 HydrophobicContact CD2-CD1 3.94Å; F188-I192 HydrophobicContact CE1-CD1 3.81Å; F188-I192 HydrophobicContact CE2-CD1 3.54Å; F188-I192 HydrophobicContact CE2-CG1 4.33Å; F188-I192 HydrophobicContact CG-CD1 4.27Å; F188-I192 HydrophobicContact CZ-CD1 3.47Å; F188-I192 VanDerWaalsContact CZ-CD1 3.47Å; F188-I192 WeakPolarHBondContact O-CG1 3.38Å; F188-I192 PolarHBondContact O-N 2.74Å; F188-I192 VanDerWaalsContact O-N 3.09Å; F188-L212 HydrophobicContact CD2-CD2 3.79Å; F188-L212 HydrophobicContact CE2-CD2 3.98Å; F188-I215 HydrophobicContact CB-CG2 3.86Å; F188-I215 HydrophobicContact CD2-CG2 3.73Å; F188-I215 HydrophobicContact CG-CG2 4.09Å; F188-W238 HydrophobicContact CB-CH2 3.8Å; F188-W238 HydrophobicContact CB-CZ2 4.3Å; F188-W238 HydrophobicContact CB-CZ3 4.1Å; F188-W238 AromaticContact CD1-CD2 3.99Å; F188-W238 HydrophobicContact CD1-CD2 3.99Å; F188-W238 AromaticContact CD1-CE3 3.55Å; F188-W238 HydrophobicContact CD1-CE3 3.55Å; F188-W238 AromaticContact CD1-CH2 3.97Å; F188-W238 HydrophobicContact CD1-CH2 3.97Å; F188-W238 HydrophobicContact CD1-CZ2 4.34Å; F188-W238 AromaticContact CD1-CZ3 3.55Å; F188-W238 HydrophobicContact CD1-CZ3 3.55Å; F188-W238 HydrophobicContact CD2-CE3 4.45Å; F188-W238 HydrophobicContact CD2-CH2 4.34Å; F188-W238 AromaticContact CD2-CZ3 3.81Å; F188-W238 HydrophobicContact CD2-CZ3 3.81Å; F188-W238 HydrophobicContact CE1-CD2 4.04Å; F188-W238 AromaticContact CE1-CE3 3.44Å; F188-W238 HydrophobicContact CE1-CE3 3.44Å; F188-W238 VanDerWaalsContact CE1-CE3 3.44Å; F188-W238 AromaticContact CE1-CZ3 3.78Å; F188-W238 HydrophobicContact CE1-CZ3 3.78Å; F188-W238 HydrophobicContact CE2-CE3 4.36Å; F188-W238 HydrophobicContact CE2-CZ3 4.03Å; F188-W238 HydrophobicContact CG-CE3 4.07Å; F188-W238 AromaticContact CG-CH2 3.79Å; F188-W238 HydrophobicContact CG-CH2 3.79Å; F188-W238 HydrophobicContact CG-CZ2 4.46Å; F188-W238 AromaticContact CG-CZ3 3.55Å; F188-W238 HydrophobicContact CG-CZ3 3.55Å; F188-W238 AromaticContact CZ-CE3 3.86Å; F188-W238 HydrophobicContact CZ-CE3 3.86Å; F188-W238 HydrophobicContact CZ-CZ3 4.01Å; F188-N241 HydrophobicContact CE1-CB 3.45Å; F188-N241 VanDerWaalsContact CE1-CB 3.45Å; F188-N241 HydrophobicContact CZ-CB 3.57Å; F188-F242 HydrophobicContact CE2-CD1 4.15Å; F188-F242 AromaticContact CE2-CE1 3.82Å; F188-F242 HydrophobicContact CE2-CE1 3.82Å; F188-F242 AromaticContact CZ-CD1 3.65Å; F188-F242 HydrophobicContact CZ-CD1 3.65Å; F188-F242 AromaticContact CZ-CE1 3.63Å; F188-F242 HydrophobicContact CZ-CE1 3.63Å; F188-L245 HydrophobicContact CE2-CD1 3.96Å; F188-L245 HydrophobicContact CZ-CD1 4.18Å
189	K	97.2	Very high	94.3	Very high	82 Å²	82	42.9 Å²	42.9	36%	0.357	25%	0.246	S	C	.	.	H	α-helix	trans	-57.8	-50.8	176.4	-69.5	176.6	-175.9	178.5	0	111.5	T185 N186 T191 I192 E193 T237	T185-K189 WeakPolarHBondContact O-CG 3.47Å; T185-K189 PolarHBondContact O-N 3.14Å; T185-K189 VanDerWaalsContact O-N 3.09Å; N186-K189 PolarHBondContact O-N 2.61Å; K189-T191 VanDerWaalsContact C-N 3.33Å; K189-T191 PolarHBondContact O-N 3.03Å; K189-I192 PolarHBondContact O-N 2.78Å; K189-E193 PolarHBondContact O-N 2.97Å; K189-T237 HydrophobicContact CD-CG2 4.19Å; K189-T237 WeakPolarHBondContact CE-OG1 3.06Å; K189-T237 HydrophobicContact CG-CG2 4.03Å; K189-T237 PolarHBondContact NZ-OG1 3.38Å
190	A	95.7	Very high	94	Very high	42 Å²	42	48.8 Å²	48.8	35%	0.347	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-39.8	-179	0	0	0	0	0	112.2	N186 L187 I192 E193 L194	N186-A190 WeakPolarHBondContact O-CB 3.46Å; N186-A190 PolarHBondContact O-N 3.49Å; L187-A190 PolarHBondContact O-N 3.39Å; A190-I192 PolarHBondContact O-N 3.49Å; A190-E193 PolarHBondContact O-N 2.8Å; A190-L194 WeakPolarHBondContact O-CB 3.35Å; A190-L194 VanDerWaalsContact O-CG 3.28Å; A190-L194 WeakPolarHBondContact O-CG 3.23Å; A190-L194 PolarHBondContact O-N 2.8Å
191	T	96.1	Very high	93.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-40	178	-54.8	0	0	0	0	111.2	F143 L187 F188 K189 L194 C195 L208 L212	F143-T191 HydrophobicContact CE1-CG2 4.12Å; F143-T191 HydrophobicContact CZ-CG2 4.43Å; L187-T191 VanDerWaalsContact O-CB 3.27Å; L187-T191 WeakPolarHBondContact O-CB 3.27Å; L187-T191 PolarHBondContact O-N 2.84Å; L187-T191 PolarHBondContact O-OG1 3.27Å; F188-T191 PolarHBondContact O-N 2.73Å; K189-T191 VanDerWaalsContact C-N 3.33Å; K189-T191 PolarHBondContact O-N 3.03Å; T191-L194 PolarHBondContact O-N 2.86Å; T191-C195 PolarHBondContact O-N 3.24Å; T191-C195 PolarHBondContact O-SG 3.48Å; T191-L208 HydrophobicContact CG2-CB 4.13Å; T191-L208 HydrophobicContact CG2-CD2 3.98Å; T191-L212 HydrophobicContact CG2-CD1 4.49Å; T191-L212 HydrophobicContact CG2-CD2 3.7Å; T191-L212 HydrophobicContact CG2-CG 3.76Å
192	I	95.4	Very high	93.2	Very high	23 Å²	23	53.3 Å²	53.3	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-41.7	175.3	-69	168	0	0	0	111.6	F188 K189 A190 L194 C195 S196 L212 N241 L245	F188-I192 HydrophobicContact CD1-CD1 4.2Å; F188-I192 HydrophobicContact CD2-CD1 3.94Å; F188-I192 HydrophobicContact CE1-CD1 3.81Å; F188-I192 HydrophobicContact CE2-CD1 3.54Å; F188-I192 HydrophobicContact CE2-CG1 4.33Å; F188-I192 HydrophobicContact CG-CD1 4.27Å; F188-I192 HydrophobicContact CZ-CD1 3.47Å; F188-I192 VanDerWaalsContact CZ-CD1 3.47Å; F188-I192 WeakPolarHBondContact O-CG1 3.38Å; F188-I192 PolarHBondContact O-N 2.74Å; F188-I192 VanDerWaalsContact O-N 3.09Å; K189-I192 PolarHBondContact O-N 2.78Å; A190-I192 PolarHBondContact O-N 3.49Å; I192-L194 VanDerWaalsContact C-N 3.32Å; I192-L194 PolarHBondContact O-N 2.82Å; I192-C195 WeakPolarHBondContact O-CB 3.37Å; I192-C195 PolarHBondContact O-N 3.02Å; I192-S196 PolarHBondContact O-N 3.18Å; I192-S196 VanDerWaalsContact O-N 3.11Å; I192-S196 PolarHBondContact O-OG 2.9Å; I192-L212 HydrophobicContact CG1-CD1 4.43Å; I192-L212 HydrophobicContact CG1-CD2 3.86Å; I192-N241 HydrophobicContact CD1-CB 3.55Å; I192-N241 WeakPolarHBondContact CD1-OD1 3.42Å; I192-L245 HydrophobicContact CD1-CD1 4.01Å; I192-L245 HydrophobicContact CG1-CD1 4.27Å
193	E	94.8	Very high	92.8	Very high	135 Å²	135	52.7 Å²	52.7	63%	0.631	31%	0.305	S	S	*	.	H	α-helix	trans	-63.1	-40.1	175.8	-173.3	175.7	-172.5	0	0	111.5	K189 A190 S196 T197	K189-E193 PolarHBondContact O-N 2.97Å; A190-E193 PolarHBondContact O-N 2.8Å; E193-S196 WeakPolarHBondContact O-CB 3.38Å; E193-S196 PolarHBondContact O-N 3.23Å; E193-T197 PolarHBondContact O-N 2.91Å; E193-T197 PolarHBondContact O-OG1 3.38Å
194	L	93.9	Very high	92.5	Very high	56 Å²	56	52.1 Å²	52.1	29%	0.293	30%	0.303	S	S	.	.	H	α-helix	trans	-65	-38.2	173.2	-72.8	171.1	0	0	0	112.2	F143 A190 T191 I192 S196 T197 H198 L208	F143-L194 HydrophobicContact CE2-CD1 3.56Å; F143-L194 HydrophobicContact CZ-CD1 3.63Å; A190-L194 WeakPolarHBondContact O-CB 3.35Å; A190-L194 VanDerWaalsContact O-CG 3.28Å; A190-L194 WeakPolarHBondContact O-CG 3.23Å; A190-L194 PolarHBondContact O-N 2.8Å; T191-L194 PolarHBondContact O-N 2.86Å; I192-L194 VanDerWaalsContact C-N 3.32Å; I192-L194 PolarHBondContact O-N 2.82Å; L194-S196 PolarHBondContact O-N 3.02Å; L194-T197 PolarHBondContact O-N 3.47Å; L194-T197 VanDerWaalsContact O-N 3.16Å; L194-H198 WeakPolarHBondContact O-CB 3.3Å; L194-H198 PolarHBondContact O-CD2 2.71Å; L194-H198 VanDerWaalsContact O-CD2 3.28Å; L194-H198 PolarHBondContact O-N 3.12Å; L194-L208 HydrophobicContact CB-CD1 3.96Å; L194-L208 HydrophobicContact CB-CD2 3.96Å; L194-L208 HydrophobicContact CD1-CD2 4.21Å
195	C	92.2	Very high	92.3	Very high	13 Å²	13	52.2 Å²	52.2	9%	0.088	30%	0.303	C	S	.	.	H	α-helix	trans	-58.7	-39.1	172.9	-72.4	0	0	0	0	111.4	T191 I192 H198 A199 L205 L208 F209	T191-C195 PolarHBondContact O-N 3.24Å; T191-C195 PolarHBondContact O-SG 3.48Å; I192-C195 WeakPolarHBondContact O-CB 3.37Å; I192-C195 PolarHBondContact O-N 3.02Å; C195-H198 CarbonylContact O-C 3.59Å; C195-A199 WeakPolarHBondContact O-CA 3.49Å; C195-A199 PolarHBondContact O-N 3.38Å; C195-A199 VanDerWaalsContact O-N 3.14Å; C195-L205 HydrophobicContact CB-CD2 4.13Å; C195-L208 VanDerWaalsContact SG-CB 3.51Å; C195-F209 HydrophobicContact CB-CE2 4.35Å
196	S	88.6	Confident	92	Very high	87 Å²	87	59.2 Å²	59.2	61%	0.608	33%	0.33	S	S	*	.	H	α-helix	trans	-69.5	-38.8	177.1	-55.4	0	0	0	0	111.7	I192 E193 L194 A199	I192-S196 PolarHBondContact O-N 3.18Å; I192-S196 VanDerWaalsContact O-N 3.11Å; I192-S196 PolarHBondContact O-OG 2.9Å; E193-S196 WeakPolarHBondContact O-CB 3.38Å; E193-S196 PolarHBondContact O-N 3.23Å; L194-S196 PolarHBondContact O-N 3.02Å; S196-A199 WeakPolarHBondContact O-CB 3.38Å
197	T	90.8	Very high	91.7	Very high	100 Å²	100	59.1 Å²	59.1	61%	0.613	33%	0.328	S	S	*	.	H	α-helix	trans	-69.8	-39.1	178.9	-56.2	0	0	0	0	112.3	E193 L194	E193-T197 PolarHBondContact O-N 2.91Å; E193-T197 PolarHBondContact O-OG1 3.38Å; L194-T197 PolarHBondContact O-N 3.47Å; L194-T197 VanDerWaalsContact O-N 3.16Å
198	H	88	Confident	91.6	Very high	75 Å²	75	58.6 Å²	58.6	35%	0.347	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	25.2	-179.2	-65.2	-80.6	0	0	0	112.6	L194 C195 N200 D201 A204 L208	L194-H198 WeakPolarHBondContact O-CB 3.3Å; L194-H198 PolarHBondContact O-CD2 2.71Å; L194-H198 VanDerWaalsContact O-CD2 3.28Å; L194-H198 PolarHBondContact O-N 3.12Å; C195-H198 CarbonylContact O-C 3.59Å; H198-N200 PolarHBondContact O-N 3Å; H198-D201 HydrophobicContact CB-CB 4.38Å; H198-D201 PolarHBondContact O-N 3.45Å; H198-A204 HydrophobicContact CB-CB 3.89Å; H198-L208 HydrophobicContact CB-CD1 4.45Å
199	A	83.3	Confident	91.5	Very high	39 Å²	39	58.7 Å²	58.7	32%	0.322	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.3	-171.5	0	0	0	0	0	115.3	C195 S196 L205 L252	C195-A199 WeakPolarHBondContact O-CA 3.49Å; C195-A199 PolarHBondContact O-N 3.38Å; C195-A199 VanDerWaalsContact O-N 3.14Å; S196-A199 WeakPolarHBondContact O-CB 3.38Å; A199-L205 WeakPolarHBondContact O-CD1 3.45Å; A199-L252 WeakPolarHBondContact O-CD1 3.47Å
200	N	85.3	Confident	91.3	Very high	156 Å²	156	56 Å²	56	83%	0.834	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	0.5	178.2	-62.1	-38.6	0	0	0	113.8	H198	H198-N200 PolarHBondContact O-N 3Å
201	D	89.4	Confident	91.3	Very high	64 Å²	64	54 Å²	54	34%	0.342	30%	0.301	S	S	.	.			trans	-102.8	99	178.6	-177.2	-15.7	0	0	0	109.8	H198 S203 A204 L205	H198-D201 HydrophobicContact CB-CB 4.38Å; H198-D201 PolarHBondContact O-N 3.45Å; D201-S203 PolarHBondContact O-N 2.7Å; D201-S203 WeakPolarHBondContact OD1-CA 3.2Å; D201-S203 WeakPolarHBondContact OD1-CB 3.45Å; D201-S203 PolarHBondContact OD1-N 3.26Å; D201-S203 PolarHBondContact OD1-OG 3.15Å; D201-A204 HydrophobicContact CB-CB 3.91Å; D201-A204 PolarHBondContact O-N 3.29Å; D201-A204 PolarHBondContact OD1-N 3.2Å; D201-L205 WeakPolarHBondContact O-CB 3.31Å; D201-L205 VanDerWaalsContact O-CG 3.3Å; D201-L205 WeakPolarHBondContact O-CG 3.43Å; D201-L205 PolarHBondContact O-N 3.19Å
202	A	86.9	Confident	91.4	Very high	31 Å²	31	54 Å²	54	26%	0.256	30%	0.301	S	S	.	.	H	α-helix	trans	-58.7	-34.3	-179.9	0	0	0	0	0	112.7	R206 L252	A202-R206 VanDerWaalsContact O-CG 3.25Å; A202-R206 WeakPolarHBondContact O-CG 3.4Å; A202-R206 PolarHBondContact O-N 2.88Å; A202-L252 HydrophobicContact CB-CB 4.17Å
203	S	88.2	Confident	91.5	Very high	75 Å²	75	53.6 Å²	53.6	52%	0.524	30%	0.299	S	S	.	.	H	α-helix	trans	-71.4	-45.2	-178.4	71.9	0	0	0	0	111.5	D201 R206 I207	D201-S203 PolarHBondContact O-N 2.7Å; D201-S203 WeakPolarHBondContact OD1-CA 3.2Å; D201-S203 WeakPolarHBondContact OD1-CB 3.45Å; D201-S203 PolarHBondContact OD1-N 3.26Å; D201-S203 PolarHBondContact OD1-OG 3.15Å; S203-R206 PolarHBondContact O-N 3.14Å; S203-I207 WeakPolarHBondContact O-CG1 3.34Å; S203-I207 PolarHBondContact O-N 3.42Å
204	A	90.3	Very high	91.6	Very high	19 Å²	19	47.7 Å²	47.7	16%	0.157	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-45.9	174.4	0	0	0	0	0	111	H198 D201 R206 I207 L208	H198-A204 HydrophobicContact CB-CB 3.89Å; D201-A204 HydrophobicContact CB-CB 3.91Å; D201-A204 PolarHBondContact O-N 3.29Å; D201-A204 PolarHBondContact OD1-N 3.2Å; A204-R206 VanDerWaalsContact C-N 3.33Å; A204-R206 PolarHBondContact O-N 2.9Å; A204-I207 PolarHBondContact O-N 3.47Å; A204-I207 VanDerWaalsContact O-N 3.14Å; A204-L208 VanDerWaalsContact O-CG 3.22Å; A204-L208 WeakPolarHBondContact O-CG 3.2Å; A204-L208 PolarHBondContact O-N 3.34Å
205	L	92.4	Very high	91.8	Very high	2 Å²	2	45 Å²	45	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-41.5	178.9	-74.3	176.3	0	0	0	112.5	C195 A199 D201 I207 L208 F209 N250 L252 L253	C195-L205 HydrophobicContact CB-CD2 4.13Å; A199-L205 WeakPolarHBondContact O-CD1 3.45Å; D201-L205 WeakPolarHBondContact O-CB 3.31Å; D201-L205 VanDerWaalsContact O-CG 3.3Å; D201-L205 WeakPolarHBondContact O-CG 3.43Å; D201-L205 PolarHBondContact O-N 3.19Å; L205-I207 VanDerWaalsContact C-N 3.32Å; L205-I207 PolarHBondContact O-N 3.15Å; L205-L208 PolarHBondContact O-N 3.21Å; L205-F209 HydrophobicContact CD2-CE2 4.17Å; L205-F209 WeakPolarHBondContact O-CB 3.5Å; L205-F209 VanDerWaalsContact O-CD2 3.26Å; L205-F209 WeakPolarHBondContact O-CD2 3.31Å; L205-F209 PolarHBondContact O-N 3.26Å; L205-N250 WeakPolarHBondContact CD1-ND2 3.24Å; L205-L252 HydrophobicContact CD1-CB 4.34Å; L205-L252 HydrophobicContact CD1-CD1 4.09Å; L205-L253 HydrophobicContact CB-CD2 3.96Å; L205-L253 HydrophobicContact CB-CG 4.45Å
206	R	91.1	Very high	92.1	Very high	147 Å²	147	44.4 Å²	44.4	56%	0.555	25%	0.253	S	S	*	.	H	α-helix	trans	-60.2	-42.6	176.4	-74.6	171.9	-177.8	-179.9	-0.5	112.1	A202 S203 A204 S210 L253 L263	A202-R206 VanDerWaalsContact O-CG 3.25Å; A202-R206 WeakPolarHBondContact O-CG 3.4Å; A202-R206 PolarHBondContact O-N 2.88Å; S203-R206 PolarHBondContact O-N 3.14Å; A204-R206 VanDerWaalsContact C-N 3.33Å; A204-R206 PolarHBondContact O-N 2.9Å; R206-S210 WeakPolarHBondContact O-CB 3.38Å; R206-S210 PolarHBondContact O-N 3.48Å; R206-S210 VanDerWaalsContact O-N 3.08Å; R206-L253 HydrophobicContact CG-CD2 4.25Å; R206-L263 HydrophobicContact CB-CD1 3.83Å; R206-L263 HydrophobicContact CG-CD1 3.96Å; R206-L263 VanDerWaalsContact O-CD1 3.27Å; R206-L263 WeakPolarHBondContact O-CD1 3.31Å
207	I	91.9	Very high	92.5	Very high	80 Å²	80	43.4 Å²	43.4	41%	0.41	24%	0.238	S	C	.	.	H	α-helix	trans	-64.8	-47.7	177.7	-66	169.4	0	0	0	110.6	F143 S203 A204 L205 S210 S211	F143-I207 HydrophobicContact CB-CG2 3.35Å; F143-I207 HydrophobicContact CD1-CG2 4.27Å; F143-I207 HydrophobicContact CG-CG2 3.95Å; S203-I207 WeakPolarHBondContact O-CG1 3.34Å; S203-I207 PolarHBondContact O-N 3.42Å; A204-I207 PolarHBondContact O-N 3.47Å; A204-I207 VanDerWaalsContact O-N 3.14Å; L205-I207 VanDerWaalsContact C-N 3.32Å; L205-I207 PolarHBondContact O-N 3.15Å; I207-S210 WeakPolarHBondContact O-CB 3.27Å; I207-S210 PolarHBondContact O-N 3.32Å; I207-S211 PolarHBondContact O-N 3.29Å; I207-S211 VanDerWaalsContact O-N 3.12Å; I207-S211 PolarHBondContact O-OG 3.47Å
208	L	94.9	Very high	92.9	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-65.7	-40.8	-178.3	-64.1	169.6	0	0	0	112	F143 T191 L194 C195 H198 A204 L205 S211 L212	F143-L208 HydrophobicContact CD1-CD2 4.05Å; F143-L208 HydrophobicContact CD2-CD2 4.12Å; F143-L208 HydrophobicContact CE1-CD2 3.48Å; F143-L208 VanDerWaalsContact CE1-CD2 3.48Å; F143-L208 HydrophobicContact CE2-CD2 3.56Å; F143-L208 HydrophobicContact CG-CD2 4.34Å; F143-L208 HydrophobicContact CZ-CD2 3.21Å; T191-L208 HydrophobicContact CG2-CB 4.13Å; T191-L208 HydrophobicContact CG2-CD2 3.98Å; L194-L208 HydrophobicContact CB-CD1 3.96Å; L194-L208 HydrophobicContact CB-CD2 3.96Å; L194-L208 HydrophobicContact CD1-CD2 4.21Å; C195-L208 VanDerWaalsContact SG-CB 3.51Å; H198-L208 HydrophobicContact CB-CD1 4.45Å; A204-L208 VanDerWaalsContact O-CG 3.22Å; A204-L208 WeakPolarHBondContact O-CG 3.2Å; A204-L208 PolarHBondContact O-N 3.34Å; L205-L208 PolarHBondContact O-N 3.21Å; L208-S211 WeakPolarHBondContact O-CA 3.33Å; L208-S211 VanDerWaalsContact O-CB 3.27Å; L208-S211 WeakPolarHBondContact O-CB 3.13Å; L208-S211 PolarHBondContact O-N 3.24Å; L208-S211 VanDerWaalsContact O-N 3.15Å; L208-L212 WeakPolarHBondContact O-CG 3.39Å; L208-L212 PolarHBondContact O-N 3.41Å
209	F	94.9	Very high	93.4	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-36.1	177	-88.8	-110.2	0	0	0	112.2	C195 L205 S211 L212 I213 L248 L253 L263 L264 L267	C195-F209 HydrophobicContact CB-CE2 4.35Å; L205-F209 HydrophobicContact CD2-CE2 4.17Å; L205-F209 WeakPolarHBondContact O-CB 3.5Å; L205-F209 VanDerWaalsContact O-CD2 3.26Å; L205-F209 WeakPolarHBondContact O-CD2 3.31Å; L205-F209 PolarHBondContact O-N 3.26Å; F209-S211 VanDerWaalsContact C-N 3.25Å; F209-S211 PolarHBondContact O-N 3.35Å; F209-L212 HydrophobicContact CD2-CD1 4.46Å; F209-L212 HydrophobicContact CE2-CD1 4.49Å; F209-L212 PolarHBondContact O-N 2.99Å; F209-I213 VanDerWaalsContact O-CG1 3.28Å; F209-I213 WeakPolarHBondContact O-CG1 3.46Å; F209-I213 PolarHBondContact O-N 3.15Å; F209-L248 HydrophobicContact CE1-CD2 4.27Å; F209-L248 HydrophobicContact CZ-CD2 3.59Å; F209-L253 HydrophobicContact CD1-CD1 3.61Å; F209-L253 HydrophobicContact CD2-CD1 3.58Å; F209-L253 HydrophobicContact CD2-CD2 4.38Å; F209-L253 HydrophobicContact CE1-CD1 3.44Å; F209-L253 VanDerWaalsContact CE1-CD1 3.44Å; F209-L253 HydrophobicContact CE2-CD1 3.41Å; F209-L253 VanDerWaalsContact CE2-CD1 3.41Å; F209-L253 HydrophobicContact CG-CD1 3.68Å; F209-L253 HydrophobicContact CG-CD2 4.32Å; F209-L253 HydrophobicContact CZ-CD1 3.34Å; F209-L263 HydrophobicContact CB-CB 4.02Å; F209-L263 HydrophobicContact CB-CD1 4.27Å; F209-L264 HydrophobicContact CE1-CD1 3.81Å; F209-L267 HydrophobicContact CD1-CD2 3.66Å; F209-L267 HydrophobicContact CE1-CD2 3.69Å
210	S	93.6	Very high	94.1	Very high	25 Å²	25	35.3 Å²	35.3	18%	0.175	19%	0.185	C	C	.	.	H	α-helix	trans	-57.1	-42.1	169.5	-172.7	0	0	0	0	111.2	R206 I207 I213 L214	R206-S210 WeakPolarHBondContact O-CB 3.38Å; R206-S210 PolarHBondContact O-N 3.48Å; R206-S210 VanDerWaalsContact O-N 3.08Å; I207-S210 WeakPolarHBondContact O-CB 3.27Å; I207-S210 PolarHBondContact O-N 3.32Å; S210-I213 PolarHBondContact O-N 3.13Å; S210-L214 WeakPolarHBondContact O-CG 3.2Å; S210-L214 PolarHBondContact O-N 2.87Å
211	S	95.6	Very high	94.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63	-46.8	172.7	-50.1	0	0	0	0	112.3	F143 N147 I207 L208 F209 I213 L214 I215	F143-S211 VanDerWaalsContact CD1-OG 3.24Å; F143-S211 WeakPolarHBondContact CD1-OG 3.38Å; N147-S211 VanDerWaalsContact CG-OG 3.3Å; N147-S211 PolarHBondContact ND2-OG 3.04Å; N147-S211 VanDerWaalsContact OD1-CA 3.23Å; N147-S211 WeakPolarHBondContact OD1-CA 3.5Å; N147-S211 VanDerWaalsContact OD1-CB 3.31Å; N147-S211 WeakPolarHBondContact OD1-CB 3.49Å; N147-S211 PolarHBondContact OD1-N 2.96Å; N147-S211 PolarHBondContact OD1-OG 3.48Å; I207-S211 PolarHBondContact O-N 3.29Å; I207-S211 VanDerWaalsContact O-N 3.12Å; I207-S211 PolarHBondContact O-OG 3.47Å; L208-S211 WeakPolarHBondContact O-CA 3.33Å; L208-S211 VanDerWaalsContact O-CB 3.27Å; L208-S211 WeakPolarHBondContact O-CB 3.13Å; L208-S211 PolarHBondContact O-N 3.24Å; L208-S211 VanDerWaalsContact O-N 3.15Å; F209-S211 VanDerWaalsContact C-N 3.25Å; F209-S211 PolarHBondContact O-N 3.35Å; S211-I213 VanDerWaalsContact C-N 3.3Å; S211-I213 PolarHBondContact O-N 3.3Å; S211-L214 PolarHBondContact O-N 2.97Å; S211-L214 VanDerWaalsContact O-N 3.15Å; S211-I215 WeakPolarHBondContact O-CB 3.39Å; S211-I215 WeakPolarHBondContact O-CG1 3.46Å; S211-I215 PolarHBondContact O-N 3.41Å
212	L	98	Very high	95	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61	-37	179.2	-68.9	175.7	0	0	0	112.5	F188 T191 I192 L208 F209 S216 L245 L267	F188-L212 HydrophobicContact CD2-CD2 3.79Å; F188-L212 HydrophobicContact CE2-CD2 3.98Å; T191-L212 HydrophobicContact CG2-CD1 4.49Å; T191-L212 HydrophobicContact CG2-CD2 3.7Å; T191-L212 HydrophobicContact CG2-CG 3.76Å; I192-L212 HydrophobicContact CG1-CD1 4.43Å; I192-L212 HydrophobicContact CG1-CD2 3.86Å; L208-L212 WeakPolarHBondContact O-CG 3.39Å; L208-L212 PolarHBondContact O-N 3.41Å; F209-L212 HydrophobicContact CD2-CD1 4.46Å; F209-L212 HydrophobicContact CE2-CD1 4.49Å; F209-L212 PolarHBondContact O-N 2.99Å; L212-S216 VanDerWaalsContact O-CB 3.27Å; L212-S216 WeakPolarHBondContact O-CB 3.49Å; L212-S216 PolarHBondContact O-N 3.22Å; L212-S216 PolarHBondContact O-OG 3.29Å; L212-L245 HydrophobicContact CD1-CD1 4.29Å; L212-L245 HydrophobicContact CD1-CD2 3.93Å; L212-L267 HydrophobicContact CB-CD1 4.02Å; L212-L267 HydrophobicContact CB-CD2 3.92Å; L212-L267 HydrophobicContact CD1-CD2 4.13Å
213	I	97.5	Very high	95.6	Very high	14 Å²	14	23.6 Å²	23.6	7%	0.072	12%	0.118	C	C	.	.	H	α-helix	trans	-62.2	-48.8	174.2	-67.7	162.3	0	0	0	110	F209 S210 S211 S216 K217 L263 L266 L267	F209-I213 VanDerWaalsContact O-CG1 3.28Å; F209-I213 WeakPolarHBondContact O-CG1 3.46Å; F209-I213 PolarHBondContact O-N 3.15Å; S210-I213 PolarHBondContact O-N 3.13Å; S211-I213 VanDerWaalsContact C-N 3.3Å; S211-I213 PolarHBondContact O-N 3.3Å; I213-S216 PolarHBondContact O-N 2.98Å; I213-K217 HydrophobicContact CG2-CD 4.14Å; I213-K217 WeakPolarHBondContact O-CB 3.3Å; I213-K217 WeakPolarHBondContact O-CG 3.03Å; I213-K217 PolarHBondContact O-N 3.43Å; I213-L263 HydrophobicContact CD1-CB 4.3Å; I213-L263 HydrophobicContact CD1-CD2 3.71Å; I213-L266 HydrophobicContact CD1-CB 3.82Å; I213-L266 HydrophobicContact CD1-CD1 4.48Å; I213-L266 HydrophobicContact CG1-CB 4.45Å; I213-L267 HydrophobicContact CG1-CB 3.8Å; I213-L267 HydrophobicContact CG1-CD1 4.18Å
214	L	96.6	Very high	95.9	Very high	11 Å²	11	22 Å²	22	6%	0.058	10%	0.102	C	C	.	.	H	α-helix	trans	-64.8	-41.9	179.7	-67.6	167.7	0	0	0	112	L150 R151 H154 S210 S211 S216 K217 L218	L150-L214 HydrophobicContact CB-CB 3.82Å; L150-L214 HydrophobicContact CB-CD1 3.89Å; L150-L214 HydrophobicContact CB-CG 4.46Å; L150-L214 HydrophobicContact CD1-CB 4.28Å; R151-L214 HydrophobicContact CG-CD1 3.61Å; R151-L214 HydrophobicContact CG-CD2 4.01Å; R151-L214 HydrophobicContact CG-CG 4.49Å; H154-L214 HydrophobicContact CB-CD2 4.5Å; S210-L214 WeakPolarHBondContact O-CG 3.2Å; S210-L214 PolarHBondContact O-N 2.87Å; S211-L214 PolarHBondContact O-N 2.97Å; S211-L214 VanDerWaalsContact O-N 3.15Å; L214-S216 VanDerWaalsContact C-N 3.33Å; L214-S216 PolarHBondContact O-N 3.42Å; L214-K217 PolarHBondContact O-N 3.13Å; L214-L218 WeakPolarHBondContact O-CB 3.24Å; L214-L218 VanDerWaalsContact O-CG 3.32Å; L214-L218 WeakPolarHBondContact O-CG 3.43Å; L214-L218 PolarHBondContact O-N 3.29Å
215	I	98.5	Very high	96.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.3	-44.1	174.5	-69.2	166.4	0	0	0	110.4	L150 L184 L187 F188 S211 K217 L218 F219 W238	L150-I215 HydrophobicContact CD1-CD1 4.19Å; L150-I215 HydrophobicContact CD1-CG1 3.78Å; L150-I215 HydrophobicContact CD2-CG1 3.79Å; L150-I215 HydrophobicContact CG-CG1 4.46Å; L184-I215 HydrophobicContact CD1-CB 4.34Å; L184-I215 HydrophobicContact CD1-CG1 3.97Å; L184-I215 HydrophobicContact CD1-CG2 4.03Å; L184-I215 HydrophobicContact CG-CG2 4.32Å; L187-I215 HydrophobicContact CD2-CD1 4.12Å; L187-I215 HydrophobicContact CG-CD1 4.01Å; F188-I215 HydrophobicContact CB-CG2 3.86Å; F188-I215 HydrophobicContact CD2-CG2 3.73Å; F188-I215 HydrophobicContact CG-CG2 4.09Å; S211-I215 WeakPolarHBondContact O-CB 3.39Å; S211-I215 WeakPolarHBondContact O-CG1 3.46Å; S211-I215 PolarHBondContact O-N 3.41Å; I215-K217 PolarHBondContact O-N 3.31Å; I215-L218 WeakPolarHBondContact O-CB 3.49Å; I215-L218 PolarHBondContact O-N 2.99Å; I215-F219 WeakPolarHBondContact O-CB 3.38Å; I215-F219 PolarHBondContact O-N 3.11Å; I215-W238 HydrophobicContact CG2-CH2 3.61Å; I215-W238 HydrophobicContact CG2-CZ3 3.86Å
216	S	98.5	Very high	96.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.7	-36.9	178.4	-56.9	0	0	0	0	112	L212 I213 L214 F219 Y220 F242 L267 N274	L212-S216 VanDerWaalsContact O-CB 3.27Å; L212-S216 WeakPolarHBondContact O-CB 3.49Å; L212-S216 PolarHBondContact O-N 3.22Å; L212-S216 PolarHBondContact O-OG 3.29Å; I213-S216 PolarHBondContact O-N 2.98Å; L214-S216 VanDerWaalsContact C-N 3.33Å; L214-S216 PolarHBondContact O-N 3.42Å; S216-F219 WeakPolarHBondContact O-CB 3.48Å; S216-F219 PolarHBondContact O-N 2.99Å; S216-Y220 PolarHBondContact O-N 3Å; S216-F242 WeakPolarHBondContact OG-CE1 3.34Å; S216-L267 WeakPolarHBondContact OG-CD1 3.49Å; S216-N274 PolarHBondContact O-ND2 3.12Å; S216-N274 PolarHBondContact O-OD1 2.96Å
217	K	97.8	Very high	96.4	Very high	67 Å²	67	20.5 Å²	20.5	29%	0.291	10%	0.102	S	C	.	.	H	α-helix	trans	-66.3	-38.3	172.2	-77.7	176.3	178.7	-176.6	0	112.5	R161 I213 L214 I215 Y220 S221 Q270	R161-K217 PolarHBondContact NH2-O 3.38Å; I213-K217 HydrophobicContact CG2-CD 4.14Å; I213-K217 WeakPolarHBondContact O-CB 3.3Å; I213-K217 WeakPolarHBondContact O-CG 3.03Å; I213-K217 PolarHBondContact O-N 3.43Å; L214-K217 PolarHBondContact O-N 3.13Å; I215-K217 PolarHBondContact O-N 3.31Å; K217-Y220 WeakPolarHBondContact O-CB 3.21Å; K217-Y220 PolarHBondContact O-N 3.36Å; K217-S221 PolarHBondContact O-N 2.82Å; K217-S221 PolarHBondContact O-OG 3.12Å; K217-Q270 HydrophobicContact CG-CG 3.91Å
218	L	97.8	Very high	96.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66	-46.2	174.9	-79.8	163.6	0	0	0	111	L150 A153 H154 F157 F180 L184 L214 I215 Y220 S221 L222	L150-L218 HydrophobicContact CB-CD1 4.26Å; L150-L218 HydrophobicContact CD2-CD1 3.47Å; L150-L218 VanDerWaalsContact CD2-CD1 3.47Å; L150-L218 HydrophobicContact CG-CD1 4.48Å; A153-L218 HydrophobicContact CB-CD1 4.23Å; A153-L218 HydrophobicContact CB-CD2 3.72Å; H154-L218 HydrophobicContact CB-CD2 4.29Å; H154-L218 HydrophobicContact CB-CG 4.29Å; F157-L218 HydrophobicContact CD2-CD2 3.54Å; F157-L218 HydrophobicContact CE2-CD2 4.16Å; F157-L218 HydrophobicContact CG-CD2 4.46Å; F180-L218 HydrophobicContact CE1-CD1 4.28Å; F180-L218 HydrophobicContact CE1-CD2 4.44Å; L184-L218 HydrophobicContact CD1-CB 4.48Å; L184-L218 HydrophobicContact CD1-CD1 4Å; L184-L218 HydrophobicContact CD2-CB 3.92Å; L214-L218 WeakPolarHBondContact O-CB 3.24Å; L214-L218 VanDerWaalsContact O-CG 3.32Å; L214-L218 WeakPolarHBondContact O-CG 3.43Å; L214-L218 PolarHBondContact O-N 3.29Å; I215-L218 WeakPolarHBondContact O-CB 3.49Å; I215-L218 PolarHBondContact O-N 2.99Å; L218-Y220 VanDerWaalsContact C-N 3.29Å; L218-Y220 PolarHBondContact O-N 3.38Å; L218-S221 PolarHBondContact O-N 2.84Å; L218-S221 VanDerWaalsContact O-N 3.15Å; L218-L222 WeakPolarHBondContact O-CB 3.5Å; L218-L222 VanDerWaalsContact O-CG 3.3Å; L218-L222 WeakPolarHBondContact O-CG 3.43Å; L218-L222 PolarHBondContact O-N 3.07Å
219	F	98.5	Very high	96.7	Very high	1 Å²	1	24.6 Å²	24.6	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-52.5	-49.4	172.1	178	-87	0	0	0	110.8	I215 S216 S221 L222 N223 F231 W238 M239 F242 N274 Y278	I215-F219 WeakPolarHBondContact O-CB 3.38Å; I215-F219 PolarHBondContact O-N 3.11Å; S216-F219 WeakPolarHBondContact O-CB 3.48Å; S216-F219 PolarHBondContact O-N 2.99Å; F219-S221 PolarHBondContact O-N 3.34Å; F219-L222 PolarHBondContact O-N 3.18Å; F219-N223 WeakPolarHBondContact O-CB 3.11Å; F219-N223 PolarHBondContact O-N 3Å; F219-N223 PolarHBondContact O-ND2 3.2Å; F219-F231 AromaticContact CD2-CD1 3.84Å; F219-F231 HydrophobicContact CD2-CD1 3.84Å; F219-F231 AromaticContact CD2-CE1 3.83Å; F219-F231 HydrophobicContact CD2-CE1 3.83Å; F219-F231 AromaticContact CE2-CD1 3.71Å; F219-F231 HydrophobicContact CE2-CD1 3.71Å; F219-F231 HydrophobicContact CE2-CE1 4.2Å; F219-F231 HydrophobicContact CE2-CG 4.24Å; F219-W238 HydrophobicContact CB-CH2 4.27Å; F219-W238 HydrophobicContact CB-CZ3 4.06Å; F219-W238 AromaticContact CD2-CD2 3.51Å; F219-W238 HydrophobicContact CD2-CD2 3.51Å; F219-W238 AromaticContact CD2-CE2 3.75Å; F219-W238 AromaticContact CD2-CE3 3.57Å; F219-W238 HydrophobicContact CD2-CE3 3.57Å; F219-W238 HydrophobicContact CD2-CG 4.03Å; F219-W238 HydrophobicContact CD2-CH2 4.05Å; F219-W238 HydrophobicContact CD2-CZ2 4.02Å; F219-W238 AromaticContact CD2-CZ3 3.84Å; F219-W238 HydrophobicContact CD2-CZ3 3.84Å; F219-W238 HydrophobicContact CE2-CB 3.92Å; F219-W238 AromaticContact CE2-CD1 3.98Å; F219-W238 AromaticContact CE2-CD2 3.58Å; F219-W238 HydrophobicContact CE2-CD2 3.58Å; F219-W238 AromaticContact CE2-CE3 3.97Å; F219-W238 HydrophobicContact CE2-CE3 3.97Å; F219-W238 AromaticContact CE2-CG 3.57Å; F219-W238 HydrophobicContact CE2-CG 3.57Å; F219-W238 HydrophobicContact CG-CE3 4.15Å; F219-W238 HydrophobicContact CG-CZ3 4.19Å; F219-W238 HydrophobicContact CZ-CB 4.31Å; F219-W238 HydrophobicContact CZ-CG 4.41Å; F219-M239 HydrophobicContact CE1-CE 4.32Å; F219-M239 HydrophobicContact CZ-CE 3.84Å; F219-F242 HydrophobicContact CB-CZ 4.24Å; F219-F242 AromaticContact CD1-CE2 3.69Å; F219-F242 HydrophobicContact CD1-CE2 3.69Å; F219-F242 AromaticContact CD1-CZ 3.96Å; F219-F242 HydrophobicContact CD1-CZ 3.96Å; F219-F242 HydrophobicContact CD2-CE2 4.39Å; F219-F242 HydrophobicContact CD2-CZ 4.43Å; F219-F242 AromaticContact CE1-CE2 3.69Å; F219-F242 HydrophobicContact CE1-CE2 3.69Å; F219-F242 HydrophobicContact CE1-CZ 4.41Å; F219-F242 HydrophobicContact CE2-CE2 4.4Å; F219-F242 HydrophobicContact CG-CE2 4.04Å; F219-F242 AromaticContact CG-CZ 3.95Å; F219-F242 HydrophobicContact CG-CZ 3.95Å; F219-F242 HydrophobicContact CZ-CE2 4.04Å; F219-N274 HydrophobicContact CD1-CB 4.31Å; F219-N274 WeakPolarHBondContact CD1-ND2 3.27Å; F219-N274 HydrophobicContact CE1-CB 4.37Å; F219-Y278 HydrophobicContact CE1-CD2 4.1Å; F219-Y278 AromaticContact CE1-CE2 3.34Å; F219-Y278 HydrophobicContact CE1-CE2 3.34Å; F219-Y278 AromaticContact CE1-CZ 3.88Å; F219-Y278 HydrophobicContact CZ-CD2 4.46Å; F219-Y278 HydrophobicContact CZ-CE1 4.5Å; F219-Y278 AromaticContact CZ-CE2 3.47Å; F219-Y278 HydrophobicContact CZ-CE2 3.47Å; F219-Y278 VanDerWaalsContact CZ-CE2 3.47Å; F219-Y278 AromaticContact CZ-CZ 3.46Å; F219-Y278 VanDerWaalsContact CZ-CZ 3.46Å; F219-Y278 WeakPolarHBondContact CZ-OH 3.43Å
220	Y	98.1	Very high	96.8	Very high	42 Å²	42	27 Å²	27	17%	0.165	13%	0.131	C	C	.	.	H	α-helix	trans	-55.8	-50	176.1	-170	-89.6	0	0	0	112.5	R161 S216 K217 L218 L222 N223 F224 D273 N274 L277	R161-Y220 HydrophobicContact CG-CD1 4.2Å; R161-Y220 HydrophobicContact CG-CE1 4.15Å; R161-Y220 VanDerWaalsContact CZ-CD1 3.43Å; S216-Y220 PolarHBondContact O-N 3Å; K217-Y220 WeakPolarHBondContact O-CB 3.21Å; K217-Y220 PolarHBondContact O-N 3.36Å; L218-Y220 VanDerWaalsContact C-N 3.29Å; L218-Y220 PolarHBondContact O-N 3.38Å; Y220-L222 PolarHBondContact O-N 2.92Å; Y220-N223 CarbonylContact O-C 3.58Å; Y220-N223 PolarHBondContact O-N 2.7Å; Y220-F224 HydrophobicContact CD1-CD2 4.13Å; Y220-F224 AromaticContact CE1-CD2 3.4Å; Y220-F224 HydrophobicContact CE1-CD2 3.4Å; Y220-F224 VanDerWaalsContact CE1-CD2 3.4Å; Y220-F224 AromaticContact CE1-CE2 3.8Å; Y220-F224 HydrophobicContact CE1-CE2 3.8Å; Y220-F224 HydrophobicContact CE1-CG 4.49Å; Y220-F224 AromaticContact CZ-CD2 3.77Å; Y220-F224 AromaticContact CZ-CE2 3.91Å; Y220-F224 WeakPolarHBondContact O-CB 3.32Å; Y220-F224 PolarHBondContact O-N 3.27Å; Y220-F224 WeakPolarHBondContact OH-CE2 3.42Å; Y220-D273 HydrophobicContact CD2-CB 4.1Å; Y220-D273 HydrophobicContact CE2-CB 3.83Å; Y220-D273 WeakPolarHBondContact CE2-O 3.47Å; Y220-N274 WeakPolarHBondContact CB-OD1 3.5Å; Y220-N274 VanDerWaalsContact CD2-OD1 3.3Å; Y220-N274 WeakPolarHBondContact CD2-OD1 3.4Å; Y220-L277 HydrophobicContact CD2-CB 4.23Å; Y220-L277 HydrophobicContact CD2-CD2 3.79Å; Y220-L277 HydrophobicContact CE2-CB 3.75Å; Y220-L277 HydrophobicContact CE2-CD2 3.88Å; Y220-L277 HydrophobicContact CE2-CG 4.31Å; Y220-L277 HydrophobicContact CG-CD2 4.25Å
221	S	97.3	Very high	97	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-43.4	-179.2	-65.9	0	0	0	0	112.7	F157 R161 K217 L218 F219 N223 F224	F157-S221 WeakPolarHBondContact O-CB 3.38Å; R161-S221 PolarHBondContact NE-OG 3.37Å; R161-S221 PolarHBondContact NH2-OG 3.43Å; K217-S221 PolarHBondContact O-N 2.82Å; K217-S221 PolarHBondContact O-OG 3.12Å; L218-S221 PolarHBondContact O-N 2.84Å; L218-S221 VanDerWaalsContact O-N 3.15Å; F219-S221 PolarHBondContact O-N 3.34Å; S221-N223 VanDerWaalsContact C-N 3.29Å; S221-N223 PolarHBondContact O-N 3.17Å; S221-F224 PolarHBondContact O-N 2.75Å
222	L	97.6	Very high	97.1	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-72.8	-22.5	-177.7	-66.4	175.4	0	0	0	113	F157 Y160 V176 L177 F180 L184 L218 F219 Y220 P228 F231	F157-L222 HydrophobicContact CD2-CD2 3.9Å; F157-L222 HydrophobicContact CD2-CG 4.45Å; F157-L222 HydrophobicContact CE2-CD2 4.42Å; F157-L222 HydrophobicContact CG-CD2 4.31Å; Y160-L222 HydrophobicContact CE2-CD2 4.3Å; V176-L222 HydrophobicContact CG1-CD2 3.63Å; L177-L222 HydrophobicContact CD2-CB 4.36Å; F180-L222 HydrophobicContact CD1-CD1 4.35Å; L184-L222 HydrophobicContact CD2-CD1 3.96Å; L218-L222 WeakPolarHBondContact O-CB 3.5Å; L218-L222 VanDerWaalsContact O-CG 3.3Å; L218-L222 WeakPolarHBondContact O-CG 3.43Å; L218-L222 PolarHBondContact O-N 3.07Å; F219-L222 PolarHBondContact O-N 3.18Å; Y220-L222 PolarHBondContact O-N 2.92Å; L222-P228 WeakPolarHBondContact O-CG 3.48Å; L222-F231 HydrophobicContact CB-CE2 3.8Å; L222-F231 HydrophobicContact CB-CZ 4.3Å; L222-F231 HydrophobicContact CD1-CE2 4.12Å; L222-F231 HydrophobicContact CD1-CZ 3.95Å
223	N	97.6	Very high	97.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	6.4	176.8	-69.5	-96.4	0	0	0	112.4	F219 Y220 S221 D226 P228 F231 L277 Y278 Y282	F219-N223 WeakPolarHBondContact O-CB 3.11Å; F219-N223 PolarHBondContact O-N 3Å; F219-N223 PolarHBondContact O-ND2 3.2Å; Y220-N223 CarbonylContact O-C 3.58Å; Y220-N223 PolarHBondContact O-N 2.7Å; S221-N223 VanDerWaalsContact C-N 3.29Å; S221-N223 PolarHBondContact O-N 3.17Å; N223-D226 CarbonylContact C-O 2.98Å; N223-D226 WeakPolarHBondContact CA-O 3.41Å; N223-P228 VanDerWaalsContact OD1-CD 3.31Å; N223-P228 WeakPolarHBondContact OD1-CD 3.43Å; N223-F231 VanDerWaalsContact ND2-CD2 3.29Å; N223-F231 WeakPolarHBondContact ND2-CD2 3.26Å; N223-F231 WeakPolarHBondContact OD1-CB 3.48Å; N223-L277 HydrophobicContact CB-CD2 4.33Å; N223-Y278 HydrophobicContact CB-CE2 3.91Å; N223-Y278 PolarHBondContact OD1-OH 3.11Å; N223-Y282 HydrophobicContact CB-CE2 4.43Å; N223-Y282 WeakPolarHBondContact O-CE2 3.41Å; N223-Y282 VanDerWaalsContact O-CZ 3.28Å; N223-Y282 PolarHBondContact O-OH 2.92Å
224	F	95.9	Very high	97.1	Very high	42 Å²	42	37.3 Å²	37.3	18%	0.184	18%	0.181	C	C	.	.	S	Bend	trans	-76.5	-42.9	-172.6	-169.4	-87.9	0	0	0	112.9	R161 Y220 S221 L277 K281	R161-F224 VanDerWaalsContact CA-CD1 3.45Å; R161-F224 HydrophobicContact CB-CD1 4.17Å; R161-F224 HydrophobicContact CB-CD2 4.23Å; R161-F224 HydrophobicContact CB-CE1 4.33Å; R161-F224 HydrophobicContact CB-CE2 4.38Å; R161-F224 HydrophobicContact CB-CG 4.09Å; R161-F224 HydrophobicContact CB-CZ 4.41Å; R161-F224 HydrophobicContact CG-CB 4.17Å; R161-F224 HydrophobicContact CG-CD2 4.1Å; R161-F224 HydrophobicContact CG-CG 4.02Å; R161-F224 WeakPolarHBondContact O-CE1 3.23Å; R161-F224 WeakPolarHBondContact O-CZ 3.45Å; Y220-F224 HydrophobicContact CD1-CD2 4.13Å; Y220-F224 AromaticContact CE1-CD2 3.4Å; Y220-F224 HydrophobicContact CE1-CD2 3.4Å; Y220-F224 VanDerWaalsContact CE1-CD2 3.4Å; Y220-F224 AromaticContact CE1-CE2 3.8Å; Y220-F224 HydrophobicContact CE1-CE2 3.8Å; Y220-F224 HydrophobicContact CE1-CG 4.49Å; Y220-F224 AromaticContact CZ-CD2 3.77Å; Y220-F224 AromaticContact CZ-CE2 3.91Å; Y220-F224 WeakPolarHBondContact O-CB 3.32Å; Y220-F224 PolarHBondContact O-N 3.27Å; Y220-F224 WeakPolarHBondContact OH-CE2 3.42Å; S221-F224 PolarHBondContact O-N 2.75Å; F224-L277 HydrophobicContact CD2-CD1 3.93Å; F224-L277 HydrophobicContact CD2-CD2 4.47Å; F224-L277 HydrophobicContact CE2-CD1 4.31Å; F224-K281 PolarHBondContact O-NZ 3.22Å
225	Q	94	Very high	97.1	Very high	23 Å²	23	36.8 Å²	36.8	11%	0.107	18%	0.179	C	C	.	.	S	Bend	trans	-77.7	-38.3	-174.3	-76.3	-70.1	-19.7	0	0	112.7	Y160 E163 K165 L169 I173	Y160-Q225 VanDerWaalsContact O-CG 3.28Å; Y160-Q225 WeakPolarHBondContact O-CG 3.41Å; Y160-Q225 PolarHBondContact O-NE2 3.13Å; E163-Q225 PolarHBondContact O-NE2 2.66Å; K165-Q225 VanDerWaalsContact CG-OE1 3.26Å; L169-Q225 HydrophobicContact CD2-CG 4.45Å; I173-Q225 HydrophobicContact CD1-CB 4.2Å; I173-Q225 HydrophobicContact CD1-CG 3.98Å
226	D	94	Very high	97.1	Very high	95 Å²	95	42.3 Å²	42.3	51%	0.508	20%	0.204	S	C	.	.	S	Bend	trans	-158.1	170.2	178.5	-154.8	-1.3	0	0	0	109.7	N223 P228 Y282	N223-D226 CarbonylContact C-O 2.98Å; N223-D226 WeakPolarHBondContact CA-O 3.41Å; D226-P228 VanDerWaalsContact O-CD 3.27Å; D226-P228 WeakPolarHBondContact O-CD 3.44Å; D226-Y282 VanDerWaalsContact C-CZ 3.42Å; D226-Y282 WeakPolarHBondContact CA-OH 3.22Å; D226-Y282 PolarHBondContact N-OH 2.84Å; D226-Y282 PolarHBondContact O-OH 3.31Å; D226-Y282 VanDerWaalsContact O-OH 3.08Å
227	L	95.8	Very high	97.1	Very high	19 Å²	19	43.7 Å²	43.7	10%	0.099	21%	0.213	C	C	.	.			trans	-90.2	109.4	171.3	177.2	59.8	0	0	0	109.4	F231 E232 Y278 Y282 E285	L227-F231 HydrophobicContact CD1-CB 4.35Å; L227-E232 HydrophobicContact CD1-CB 4.44Å; L227-E232 HydrophobicContact CD2-CB 3.99Å; L227-E232 HydrophobicContact CD2-CG 4Å; L227-E232 HydrophobicContact CG-CB 4.08Å; L227-Y278 HydrophobicContact CD1-CE1 3.86Å; L227-Y278 VanDerWaalsContact CD1-OH 3.26Å; L227-Y278 WeakPolarHBondContact CD1-OH 3.36Å; L227-Y282 HydrophobicContact CB-CD1 3.56Å; L227-Y282 HydrophobicContact CB-CD2 4.11Å; L227-Y282 HydrophobicContact CB-CE1 3.63Å; L227-Y282 HydrophobicContact CB-CE2 4.17Å; L227-Y282 HydrophobicContact CB-CG 3.84Å; L227-Y282 HydrophobicContact CD1-CD2 4.33Å; L227-Y282 HydrophobicContact CD2-CD1 4.45Å; L227-Y282 HydrophobicContact CD2-CG 4.19Å; L227-Y282 HydrophobicContact CG-CG 4.42Å; L227-Y282 PolarHBondContact N-OH 3.17Å; L227-E285 HydrophobicContact CD2-CB 4.22Å; L227-E285 HydrophobicContact CD2-CG 3.8Å
228	P	96.4	Very high	97.1	Very high	14 Å²	14	40.5 Å²	40.5	9%	0.091	20%	0.199	C	C	.	.			trans	-71.5	138.9	178.1	-23.3	39.2	0	0	0	112	L177 L222 N223 D226 F230 F231 E232	L177-P228 HydrophobicContact CD1-CB 3.64Å; L177-P228 HydrophobicContact CD1-CG 3.66Å; L177-P228 HydrophobicContact CD2-CB 3.65Å; L177-P228 HydrophobicContact CD2-CG 3.51Å; L177-P228 HydrophobicContact CG-CB 4.22Å; L177-P228 HydrophobicContact CG-CG 4.22Å; L222-P228 WeakPolarHBondContact O-CG 3.48Å; N223-P228 VanDerWaalsContact OD1-CD 3.31Å; N223-P228 WeakPolarHBondContact OD1-CD 3.43Å; D226-P228 VanDerWaalsContact O-CD 3.27Å; D226-P228 WeakPolarHBondContact O-CD 3.44Å; P228-F230 PolarHBondContact O-N 3.04Å; P228-F231 HydrophobicContact CB-CD2 3.87Å; P228-F231 HydrophobicContact CG-CD2 3.73Å; P228-F231 HydrophobicContact CG-CE2 4.34Å; P228-F231 PolarHBondContact O-N 3.13Å; P228-E232 PolarHBondContact O-N 2.85Å
229	E	96.5	Very high	97.1	Very high	157 Å²	157	40.6 Å²	40.6	73%	0.734	20%	0.2	S	C	*	.	H	α-helix	trans	-45.8	-43.8	177.5	-64	176.4	-175.7	0	0	112	F231 E232 D233	E229-F231 PolarHBondContact O-N 2.89Å; E229-E232 WeakPolarHBondContact O-CB 3.42Å; E229-E232 PolarHBondContact O-N 3.5Å; E229-D233 WeakPolarHBondContact O-CB 3.31Å; E229-D233 PolarHBondContact O-N 2.85Å
230	F	97.8	Very high	97.1	Very high	53 Å²	53	42.8 Å²	42.8	23%	0.232	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-42.6	178.6	-176.9	-83.5	0	0	0	113.2	A181 L182 T185 P228 N234	A181-F230 HydrophobicContact CB-CB 4.21Å; A181-F230 HydrophobicContact CB-CD1 3.43Å; A181-F230 VanDerWaalsContact CB-CD1 3.43Å; A181-F230 HydrophobicContact CB-CE1 4.01Å; A181-F230 HydrophobicContact CB-CG 3.78Å; A181-F230 WeakPolarHBondContact O-CE1 3.48Å; L182-F230 HydrophobicContact CB-CE2 3.65Å; L182-F230 HydrophobicContact CB-CZ 3.71Å; L182-F230 HydrophobicContact CD1-CE2 3.98Å; L182-F230 HydrophobicContact CD1-CZ 3.82Å; L182-F230 HydrophobicContact CG-CE2 4.37Å; L182-F230 HydrophobicContact CG-CZ 4.4Å; T185-F230 HydrophobicContact CG2-CE1 4.45Å; T185-F230 WeakPolarHBondContact OG1-CE1 3.22Å; P228-F230 PolarHBondContact O-N 3.04Å; F230-N234 HydrophobicContact CE1-CB 4.31Å; F230-N234 VanDerWaalsContact CZ-ND2 3.35Å; F230-N234 WeakPolarHBondContact CZ-ND2 3.31Å; F230-N234 WeakPolarHBondContact O-CB 3.47Å; F230-N234 PolarHBondContact O-N 2.97Å; F230-N234 PolarHBondContact O-ND2 3.36Å
231	F	98	Very high	97.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-76.5	-30.3	179.7	-71.5	-63.2	0	0	0	111.8	L177 A181 F219 L222 N223 L227 P228 E229 N234 M235 W238	L177-F231 HydrophobicContact CD2-CD2 4.12Å; L177-F231 HydrophobicContact CD2-CE2 3.63Å; A181-F231 HydrophobicContact CB-CE2 4.13Å; A181-F231 HydrophobicContact CB-CZ 3.97Å; F219-F231 AromaticContact CD2-CD1 3.84Å; F219-F231 HydrophobicContact CD2-CD1 3.84Å; F219-F231 AromaticContact CD2-CE1 3.83Å; F219-F231 HydrophobicContact CD2-CE1 3.83Å; F219-F231 AromaticContact CE2-CD1 3.71Å; F219-F231 HydrophobicContact CE2-CD1 3.71Å; F219-F231 HydrophobicContact CE2-CE1 4.2Å; F219-F231 HydrophobicContact CE2-CG 4.24Å; L222-F231 HydrophobicContact CB-CE2 3.8Å; L222-F231 HydrophobicContact CB-CZ 4.3Å; L222-F231 HydrophobicContact CD1-CE2 4.12Å; L222-F231 HydrophobicContact CD1-CZ 3.95Å; N223-F231 VanDerWaalsContact ND2-CD2 3.29Å; N223-F231 WeakPolarHBondContact ND2-CD2 3.26Å; N223-F231 WeakPolarHBondContact OD1-CB 3.48Å; L227-F231 HydrophobicContact CD1-CB 4.35Å; P228-F231 HydrophobicContact CB-CD2 3.87Å; P228-F231 HydrophobicContact CG-CD2 3.73Å; P228-F231 HydrophobicContact CG-CE2 4.34Å; P228-F231 PolarHBondContact O-N 3.13Å; E229-F231 PolarHBondContact O-N 2.89Å; F231-N234 CarbonylContact O-C 3.58Å; F231-N234 PolarHBondContact O-N 2.92Å; F231-M235 VanDerWaalsContact O-CA 3.23Å; F231-M235 WeakPolarHBondContact O-CA 3.38Å; F231-M235 WeakPolarHBondContact O-CB 3.47Å; F231-M235 PolarHBondContact O-N 3.26Å; F231-W238 HydrophobicContact CD1-CZ2 4.46Å; F231-W238 AromaticContact CD1-NE1 3.53Å; F231-W238 AromaticContact CE1-CE2 3.85Å; F231-W238 AromaticContact CE1-CZ2 3.82Å; F231-W238 HydrophobicContact CE1-CZ2 3.82Å; F231-W238 AromaticContact CE1-NE1 3.71Å
232	E	97.4	Very high	97.1	Very high	84 Å²	84	42.7 Å²	42.7	39%	0.393	21%	0.213	S	C	.	.	H	α-helix	trans	-61.3	-51.3	169.3	-170.2	-176.8	171.8	0	0	111.1	L227 P228 E229 N234 M235 E285	L227-E232 HydrophobicContact CD1-CB 4.44Å; L227-E232 HydrophobicContact CD2-CB 3.99Å; L227-E232 HydrophobicContact CD2-CG 4Å; L227-E232 HydrophobicContact CG-CB 4.08Å; P228-E232 PolarHBondContact O-N 2.85Å; E229-E232 WeakPolarHBondContact O-CB 3.42Å; E229-E232 PolarHBondContact O-N 3.5Å; E232-N234 VanDerWaalsContact C-N 3.25Å; E232-N234 PolarHBondContact O-N 3.46Å; E232-M235 WeakPolarHBondContact O-CB 3.22Å; E232-M235 PolarHBondContact O-N 3.14Å; E232-M235 VanDerWaalsContact O-N 3.11Å; E232-E285 HydrophobicContact CG-CG 4.36Å
233	D	97.4	Very high	97.1	Very high	133 Å²	133	43.9 Å²	43.9	71%	0.711	22%	0.219	S	C	*	.	H	α-helix	trans	-60.9	-34.5	177.5	-77.3	-19.8	0	0	0	112.4	E229	E229-D233 WeakPolarHBondContact O-CB 3.31Å; E229-D233 PolarHBondContact O-N 2.85Å
234	N	97.6	Very high	97.1	Very high	37 Å²	37	47.3 Å²	47.3	20%	0.198	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	13.6	-179.8	-69.4	-90.4	0	0	0	113.1	F230 F231 E232 E236 T237 W238	F230-N234 HydrophobicContact CE1-CB 4.31Å; F230-N234 VanDerWaalsContact CZ-ND2 3.35Å; F230-N234 WeakPolarHBondContact CZ-ND2 3.31Å; F230-N234 WeakPolarHBondContact O-CB 3.47Å; F230-N234 PolarHBondContact O-N 2.97Å; F230-N234 PolarHBondContact O-ND2 3.36Å; F231-N234 CarbonylContact O-C 3.58Å; F231-N234 PolarHBondContact O-N 2.92Å; E232-N234 VanDerWaalsContact C-N 3.25Å; E232-N234 PolarHBondContact O-N 3.46Å; N234-E236 PolarHBondContact O-N 3.11Å; N234-T237 VanDerWaalsContact O-CB 3.26Å; N234-T237 WeakPolarHBondContact O-CB 3.3Å; N234-T237 PolarHBondContact O-N 3.33Å; N234-W238 PolarHBondContact O-N 3.26Å; N234-W238 VanDerWaalsContact O-N 3.17Å
235	M	97.4	Very high	97.1	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-36.3	-173.2	-169.3	177.7	-173.7	0	0	112	F231 E232 T237 W238 M239 Y278 E285 F286 Y289	F231-M235 VanDerWaalsContact O-CA 3.23Å; F231-M235 WeakPolarHBondContact O-CA 3.38Å; F231-M235 WeakPolarHBondContact O-CB 3.47Å; F231-M235 PolarHBondContact O-N 3.26Å; E232-M235 WeakPolarHBondContact O-CB 3.22Å; E232-M235 PolarHBondContact O-N 3.14Å; E232-M235 VanDerWaalsContact O-N 3.11Å; M235-T237 VanDerWaalsContact C-N 3.31Å; M235-T237 PolarHBondContact O-N 2.95Å; M235-W238 PolarHBondContact O-N 3.31Å; M235-M239 HydrophobicContact CE-CE 4.17Å; M235-M239 HydrophobicContact CE-CG 4.28Å; M235-M239 HydrophobicContact CG-CE 4.19Å; M235-M239 HydrophobicContact CG-CG 3.76Å; M235-M239 VanDerWaalsContact O-CB 3.31Å; M235-M239 WeakPolarHBondContact O-CB 3.45Å; M235-M239 VanDerWaalsContact O-CG 3.24Å; M235-M239 WeakPolarHBondContact O-CG 3.28Å; M235-M239 PolarHBondContact O-N 3.49Å; M235-Y278 HydrophobicContact CE-CD1 3.4Å; M235-Y278 VanDerWaalsContact CE-CD1 3.4Å; M235-Y278 HydrophobicContact CE-CE1 3.58Å; M235-Y278 HydrophobicContact CG-CE1 4.44Å; M235-Y278 HydrophobicContact SD-CE1 4.33Å; M235-E285 HydrophobicContact CE-CB 4.1Å; M235-E285 WeakPolarHBondContact CE-O 3.48Å; M235-E285 HydrophobicContact SD-CB 3.77Å; M235-F286 VanDerWaalsContact CE-CA 3.41Å; M235-F286 HydrophobicContact CE-CB 3.76Å; M235-F286 HydrophobicContact CE-CD2 3.73Å; M235-F286 HydrophobicContact CE-CG 4.25Å; M235-Y289 HydrophobicContact CB-CE2 4.47Å; M235-Y289 HydrophobicContact CE-CD2 3.88Å; M235-Y289 HydrophobicContact CE-CE2 3.91Å; M235-Y289 HydrophobicContact CG-CD2 4.42Å; M235-Y289 HydrophobicContact CG-CE2 3.7Å; M235-Y289 HydrophobicContact SD-CD2 4.35Å; M235-Y289 HydrophobicContact SD-CE2 3.77Å
236	E	97.6	Very high	97.2	Very high	115 Å²	115	44.8 Å²	44.8	54%	0.537	23%	0.229	S	C	.	.	H	α-helix	trans	-61.8	-39.4	176.3	-173.9	173.8	177.6	0	0	112.3	N234 N240 Y289	N234-E236 PolarHBondContact O-N 3.11Å; E236-N240 WeakPolarHBondContact CG-ND2 3.3Å; E236-N240 WeakPolarHBondContact O-CB 3.45Å; E236-N240 PolarHBondContact O-N 3.01Å; E236-N240 VanDerWaalsContact O-N 3.13Å; E236-N240 PolarHBondContact O-ND2 3.35Å; E236-N240 VanDerWaalsContact O-ND2 3.1Å; E236-Y289 WeakPolarHBondContact CA-OH 3.38Å; E236-Y289 VanDerWaalsContact CB-OH 3.31Å; E236-Y289 WeakPolarHBondContact CB-OH 3.45Å; E236-Y289 PolarHBondContact N-OH 3.46Å; E236-Y289 VanDerWaalsContact N-OH 3.17Å
237	T	97.7	Very high	97.3	Very high	30 Å²	30	43.9 Å²	43.9	18%	0.184	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-52.7	173.8	-72.7	0	0	0	0	110	T185 K189 N234 M235 N241	T185-T237 HydrophobicContact CG2-CG2 4.13Å; K189-T237 HydrophobicContact CD-CG2 4.19Å; K189-T237 WeakPolarHBondContact CE-OG1 3.06Å; K189-T237 HydrophobicContact CG-CG2 4.03Å; K189-T237 PolarHBondContact NZ-OG1 3.38Å; N234-T237 VanDerWaalsContact O-CB 3.26Å; N234-T237 WeakPolarHBondContact O-CB 3.3Å; N234-T237 PolarHBondContact O-N 3.33Å; M235-T237 VanDerWaalsContact C-N 3.31Å; M235-T237 PolarHBondContact O-N 2.95Å; T237-N241 WeakPolarHBondContact O-CB 3.36Å; T237-N241 PolarHBondContact O-N 2.88Å; T237-N241 PolarHBondContact O-ND2 3.32Å
238	W	98.4	Very high	97.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.3	-49.7	-173.4	-77.4	99.9	0	0	0	111.5	L184 T185 F188 I215 F219 F231 N234 M235 N241 F242	L184-W238 HydrophobicContact CG-CH2 4.35Å; T185-W238 HydrophobicContact CG2-CZ2 4.36Å; T185-W238 VanDerWaalsContact OG1-CZ2 3.29Å; T185-W238 WeakPolarHBondContact OG1-CZ2 3.33Å; T185-W238 PolarHBondContact OG1-NE1 3.29Å; T185-W238 VanDerWaalsContact OG1-NE1 3.09Å; F188-W238 HydrophobicContact CB-CH2 3.8Å; F188-W238 HydrophobicContact CB-CZ2 4.3Å; F188-W238 HydrophobicContact CB-CZ3 4.1Å; F188-W238 AromaticContact CD1-CD2 3.99Å; F188-W238 HydrophobicContact CD1-CD2 3.99Å; F188-W238 AromaticContact CD1-CE3 3.55Å; F188-W238 HydrophobicContact CD1-CE3 3.55Å; F188-W238 AromaticContact CD1-CH2 3.97Å; F188-W238 HydrophobicContact CD1-CH2 3.97Å; F188-W238 HydrophobicContact CD1-CZ2 4.34Å; F188-W238 AromaticContact CD1-CZ3 3.55Å; F188-W238 HydrophobicContact CD1-CZ3 3.55Å; F188-W238 HydrophobicContact CD2-CE3 4.45Å; F188-W238 HydrophobicContact CD2-CH2 4.34Å; F188-W238 AromaticContact CD2-CZ3 3.81Å; F188-W238 HydrophobicContact CD2-CZ3 3.81Å; F188-W238 HydrophobicContact CE1-CD2 4.04Å; F188-W238 AromaticContact CE1-CE3 3.44Å; F188-W238 HydrophobicContact CE1-CE3 3.44Å; F188-W238 VanDerWaalsContact CE1-CE3 3.44Å; F188-W238 AromaticContact CE1-CZ3 3.78Å; F188-W238 HydrophobicContact CE1-CZ3 3.78Å; F188-W238 HydrophobicContact CE2-CE3 4.36Å; F188-W238 HydrophobicContact CE2-CZ3 4.03Å; F188-W238 HydrophobicContact CG-CE3 4.07Å; F188-W238 AromaticContact CG-CH2 3.79Å; F188-W238 HydrophobicContact CG-CH2 3.79Å; F188-W238 HydrophobicContact CG-CZ2 4.46Å; F188-W238 AromaticContact CG-CZ3 3.55Å; F188-W238 HydrophobicContact CG-CZ3 3.55Å; F188-W238 AromaticContact CZ-CE3 3.86Å; F188-W238 HydrophobicContact CZ-CE3 3.86Å; F188-W238 HydrophobicContact CZ-CZ3 4.01Å; I215-W238 HydrophobicContact CG2-CH2 3.61Å; I215-W238 HydrophobicContact CG2-CZ3 3.86Å; F219-W238 HydrophobicContact CB-CH2 4.27Å; F219-W238 HydrophobicContact CB-CZ3 4.06Å; F219-W238 AromaticContact CD2-CD2 3.51Å; F219-W238 HydrophobicContact CD2-CD2 3.51Å; F219-W238 AromaticContact CD2-CE2 3.75Å; F219-W238 AromaticContact CD2-CE3 3.57Å; F219-W238 HydrophobicContact CD2-CE3 3.57Å; F219-W238 HydrophobicContact CD2-CG 4.03Å; F219-W238 HydrophobicContact CD2-CH2 4.05Å; F219-W238 HydrophobicContact CD2-CZ2 4.02Å; F219-W238 AromaticContact CD2-CZ3 3.84Å; F219-W238 HydrophobicContact CD2-CZ3 3.84Å; F219-W238 HydrophobicContact CE2-CB 3.92Å; F219-W238 AromaticContact CE2-CD1 3.98Å; F219-W238 AromaticContact CE2-CD2 3.58Å; F219-W238 HydrophobicContact CE2-CD2 3.58Å; F219-W238 AromaticContact CE2-CE3 3.97Å; F219-W238 HydrophobicContact CE2-CE3 3.97Å; F219-W238 AromaticContact CE2-CG 3.57Å; F219-W238 HydrophobicContact CE2-CG 3.57Å; F219-W238 HydrophobicContact CG-CE3 4.15Å; F219-W238 HydrophobicContact CG-CZ3 4.19Å; F219-W238 HydrophobicContact CZ-CB 4.31Å; F219-W238 HydrophobicContact CZ-CG 4.41Å; F231-W238 HydrophobicContact CD1-CZ2 4.46Å; F231-W238 AromaticContact CD1-NE1 3.53Å; F231-W238 AromaticContact CE1-CE2 3.85Å; F231-W238 AromaticContact CE1-CZ2 3.82Å; F231-W238 HydrophobicContact CE1-CZ2 3.82Å; F231-W238 AromaticContact CE1-NE1 3.71Å; N234-W238 PolarHBondContact O-N 3.26Å; N234-W238 VanDerWaalsContact O-N 3.17Å; M235-W238 PolarHBondContact O-N 3.31Å; W238-N241 PolarHBondContact O-N 3.17Å; W238-F242 HydrophobicContact CB-CE2 4.49Å; W238-F242 AromaticContact CE3-CE1 3.84Å; W238-F242 HydrophobicContact CE3-CE1 3.84Å; W238-F242 AromaticContact CE3-CE2 3.84Å; W238-F242 HydrophobicContact CE3-CE2 3.84Å; W238-F242 AromaticContact CE3-CZ 3.37Å; W238-F242 HydrophobicContact CE3-CZ 3.37Å; W238-F242 AromaticContact CZ3-CE1 4Å; W238-F242 HydrophobicContact CZ3-CE1 4Å; W238-F242 AromaticContact CZ3-CZ 3.66Å; W238-F242 HydrophobicContact CZ3-CZ 3.66Å; W238-F242 WeakPolarHBondContact O-CB 3.32Å; W238-F242 WeakPolarHBondContact O-CG 3.15Å; W238-F242 PolarHBondContact O-N 3.17Å
239	M	98.2	Very high	96.6	Very high	2 Å²	2	50 Å²	50	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-68.4	-39	-175	-62.7	-52	154.4	0	0	112.8	F219 M235 F242 H243 Y278 F286 Y289 F293	F219-M239 HydrophobicContact CE1-CE 4.32Å; F219-M239 HydrophobicContact CZ-CE 3.84Å; M235-M239 HydrophobicContact CE-CE 4.17Å; M235-M239 HydrophobicContact CE-CG 4.28Å; M235-M239 HydrophobicContact CG-CE 4.19Å; M235-M239 HydrophobicContact CG-CG 3.76Å; M235-M239 VanDerWaalsContact O-CB 3.31Å; M235-M239 WeakPolarHBondContact O-CB 3.45Å; M235-M239 VanDerWaalsContact O-CG 3.24Å; M235-M239 WeakPolarHBondContact O-CG 3.28Å; M235-M239 PolarHBondContact O-N 3.49Å; M239-F242 HydrophobicContact SD-CD2 4.42Å; M239-H243 VanDerWaalsContact O-CB 3.27Å; M239-H243 WeakPolarHBondContact O-CB 3.48Å; M239-H243 PolarHBondContact O-N 3.33Å; M239-Y278 HydrophobicContact CE-CD1 3.56Å; M239-Y278 HydrophobicContact CE-CD2 4.11Å; M239-Y278 HydrophobicContact CE-CE1 3.46Å; M239-Y278 VanDerWaalsContact CE-CE1 3.46Å; M239-Y278 HydrophobicContact CE-CE2 4.08Å; M239-Y278 HydrophobicContact CE-CG 3.85Å; M239-F286 HydrophobicContact CE-CD2 4.45Å; M239-F286 HydrophobicContact CE-CE2 4.48Å; M239-F286 HydrophobicContact CG-CD2 4.44Å; M239-F286 HydrophobicContact CG-CE2 4.32Å; M239-F286 HydrophobicContact SD-CD2 4.05Å; M239-F286 HydrophobicContact SD-CE2 3.62Å; M239-Y289 HydrophobicContact CB-CD1 3.54Å; M239-Y289 HydrophobicContact CB-CD2 4.08Å; M239-Y289 HydrophobicContact CB-CE1 3.79Å; M239-Y289 HydrophobicContact CB-CE2 4.28Å; M239-Y289 HydrophobicContact CB-CG 3.69Å; M239-Y289 HydrophobicContact CG-CD1 4.25Å; M239-Y289 HydrophobicContact CG-CD2 3.85Å; M239-Y289 HydrophobicContact CG-CE1 4.46Å; M239-Y289 HydrophobicContact CG-CE2 4.06Å; M239-Y289 HydrophobicContact CG-CG 3.93Å; M239-F293 HydrophobicContact CB-CE2 4.18Å; M239-F293 HydrophobicContact SD-CE2 4.25Å; M239-F293 HydrophobicContact SD-CZ 4.25Å
240	N	97.7	Very high	96.1	Very high	46 Å²	46	44 Å²	44	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-65.7	-41.8	175.8	-77.6	-36.1	0	0	0	111.9	E236 T244 R292	E236-N240 WeakPolarHBondContact CG-ND2 3.3Å; E236-N240 WeakPolarHBondContact O-CB 3.45Å; E236-N240 PolarHBondContact O-N 3.01Å; E236-N240 VanDerWaalsContact O-N 3.13Å; E236-N240 PolarHBondContact O-ND2 3.35Å; E236-N240 VanDerWaalsContact O-ND2 3.1Å; N240-T244 PolarHBondContact O-N 3.34Å; N240-T244 PolarHBondContact O-OG1 3.45Å; N240-R292 PolarHBondContact OD1-NH1 3.41Å
241	N	97.9	Very high	95.3	Very high	40 Å²	40	49.5 Å²	49.5	21%	0.214	26%	0.255	C	S	.	.	H	α-helix	trans	-72.1	-41.6	179.4	-80.2	-62.8	0	0	0	112.3	F188 I192 T237 W238 H243 T244 L245	F188-N241 HydrophobicContact CE1-CB 3.45Å; F188-N241 VanDerWaalsContact CE1-CB 3.45Å; F188-N241 HydrophobicContact CZ-CB 3.57Å; I192-N241 HydrophobicContact CD1-CB 3.55Å; I192-N241 WeakPolarHBondContact CD1-OD1 3.42Å; T237-N241 WeakPolarHBondContact O-CB 3.36Å; T237-N241 PolarHBondContact O-N 2.88Å; T237-N241 PolarHBondContact O-ND2 3.32Å; W238-N241 PolarHBondContact O-N 3.17Å; N241-H243 VanDerWaalsContact C-N 3.34Å; N241-H243 PolarHBondContact O-N 3.25Å; N241-T244 PolarHBondContact O-N 2.88Å; N241-L245 WeakPolarHBondContact O-CB 3.38Å; N241-L245 VanDerWaalsContact O-CG 3.29Å; N241-L245 WeakPolarHBondContact O-CG 3.45Å; N241-L245 PolarHBondContact O-N 3.07Å
242	F	98.4	Very high	94.7	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-43.5	171.9	-76.7	-21.1	0	0	0	111.8	F188 S216 F219 W238 M239 T244 L245 L246 I271 N274 F293	F188-F242 HydrophobicContact CE2-CD1 4.15Å; F188-F242 AromaticContact CE2-CE1 3.82Å; F188-F242 HydrophobicContact CE2-CE1 3.82Å; F188-F242 AromaticContact CZ-CD1 3.65Å; F188-F242 HydrophobicContact CZ-CD1 3.65Å; F188-F242 AromaticContact CZ-CE1 3.63Å; F188-F242 HydrophobicContact CZ-CE1 3.63Å; S216-F242 WeakPolarHBondContact OG-CE1 3.34Å; F219-F242 HydrophobicContact CB-CZ 4.24Å; F219-F242 AromaticContact CD1-CE2 3.69Å; F219-F242 HydrophobicContact CD1-CE2 3.69Å; F219-F242 AromaticContact CD1-CZ 3.96Å; F219-F242 HydrophobicContact CD1-CZ 3.96Å; F219-F242 HydrophobicContact CD2-CE2 4.39Å; F219-F242 HydrophobicContact CD2-CZ 4.43Å; F219-F242 AromaticContact CE1-CE2 3.69Å; F219-F242 HydrophobicContact CE1-CE2 3.69Å; F219-F242 HydrophobicContact CE1-CZ 4.41Å; F219-F242 HydrophobicContact CE2-CE2 4.4Å; F219-F242 HydrophobicContact CG-CE2 4.04Å; F219-F242 AromaticContact CG-CZ 3.95Å; F219-F242 HydrophobicContact CG-CZ 3.95Å; F219-F242 HydrophobicContact CZ-CE2 4.04Å; W238-F242 HydrophobicContact CB-CE2 4.49Å; W238-F242 AromaticContact CE3-CE1 3.84Å; W238-F242 HydrophobicContact CE3-CE1 3.84Å; W238-F242 AromaticContact CE3-CE2 3.84Å; W238-F242 HydrophobicContact CE3-CE2 3.84Å; W238-F242 AromaticContact CE3-CZ 3.37Å; W238-F242 HydrophobicContact CE3-CZ 3.37Å; W238-F242 AromaticContact CZ3-CE1 4Å; W238-F242 HydrophobicContact CZ3-CE1 4Å; W238-F242 AromaticContact CZ3-CZ 3.66Å; W238-F242 HydrophobicContact CZ3-CZ 3.66Å; W238-F242 WeakPolarHBondContact O-CB 3.32Å; W238-F242 WeakPolarHBondContact O-CG 3.15Å; W238-F242 PolarHBondContact O-N 3.17Å; M239-F242 HydrophobicContact SD-CD2 4.42Å; F242-T244 PolarHBondContact O-N 3.44Å; F242-L245 PolarHBondContact O-N 2.7Å; F242-L246 VanDerWaalsContact O-CB 3.24Å; F242-L246 WeakPolarHBondContact O-CB 3.35Å; F242-L246 PolarHBondContact O-N 2.95Å; F242-I271 HydrophobicContact CB-CG1 4.38Å; F242-I271 HydrophobicContact CB-CG2 3.92Å; F242-I271 HydrophobicContact CD1-CD1 4.24Å; F242-I271 HydrophobicContact CD1-CG1 3.9Å; F242-I271 HydrophobicContact CE1-CG1 4.47Å; F242-I271 HydrophobicContact CG-CG1 4.23Å; F242-I271 HydrophobicContact CG-CG2 4.4Å; F242-N274 HydrophobicContact CE2-CB 4.23Å; F242-N274 WeakPolarHBondContact CZ-ND2 3.19Å; F242-F293 HydrophobicContact CB-CE1 4.35Å; F242-F293 HydrophobicContact CB-CZ 4.07Å
243	H	98.1	Very high	94	Very high	30 Å²	30	49 Å²	49	14%	0.139	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-46.7	173.7	178.1	-72.6	0	0	0	111.4	M239 N241 L245 L246 T247 R292 F293	M239-H243 VanDerWaalsContact O-CB 3.27Å; M239-H243 WeakPolarHBondContact O-CB 3.48Å; M239-H243 PolarHBondContact O-N 3.33Å; N241-H243 VanDerWaalsContact C-N 3.34Å; N241-H243 PolarHBondContact O-N 3.25Å; H243-L245 PolarHBondContact O-N 3.32Å; H243-L246 WeakPolarHBondContact O-CB 3.48Å; H243-L246 PolarHBondContact O-N 3.13Å; H243-T247 PolarHBondContact O-N 3.43Å; H243-T247 PolarHBondContact O-OG1 3.2Å; H243-T247 VanDerWaalsContact O-OG1 3.05Å; H243-R292 PolarHBondContact ND1-NH2 3.36Å; H243-F293 HydrophobicContact CB-CE1 4.48Å; H243-F293 HydrophobicContact CB-CE2 4.33Å; H243-F293 HydrophobicContact CB-CZ 4.05Å
244	T	96.7	Very high	93.3	Very high	72 Å²	72	46.7 Å²	46.7	44%	0.442	24%	0.24	S	C	.	.	H	α-helix	trans	-57.7	-47.9	177.4	-62.8	0	0	0	0	111.6	N240 N241 F242 L246 T247 L248	N240-T244 PolarHBondContact O-N 3.34Å; N240-T244 PolarHBondContact O-OG1 3.45Å; N241-T244 PolarHBondContact O-N 2.88Å; F242-T244 PolarHBondContact O-N 3.44Å; T244-L246 VanDerWaalsContact C-N 3.34Å; T244-L246 PolarHBondContact O-N 3.02Å; T244-T247 PolarHBondContact O-N 3.22Å; T244-T247 PolarHBondContact O-OG1 3Å; T244-T247 VanDerWaalsContact O-OG1 3.05Å; T244-L248 WeakPolarHBondContact O-CB 3.4Å; T244-L248 PolarHBondContact O-N 3.26Å
245	L	96.4	Very high	92.6	Very high	8 Å²	8	47 Å²	47	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-36.5	177.7	-69.6	169.3	0	0	0	112.4	F188 I192 L212 N241 F242 H243 T247 L248 L267 I271	F188-L245 HydrophobicContact CE2-CD1 3.96Å; F188-L245 HydrophobicContact CZ-CD1 4.18Å; I192-L245 HydrophobicContact CD1-CD1 4.01Å; I192-L245 HydrophobicContact CG1-CD1 4.27Å; L212-L245 HydrophobicContact CD1-CD1 4.29Å; L212-L245 HydrophobicContact CD1-CD2 3.93Å; N241-L245 WeakPolarHBondContact O-CB 3.38Å; N241-L245 VanDerWaalsContact O-CG 3.29Å; N241-L245 WeakPolarHBondContact O-CG 3.45Å; N241-L245 PolarHBondContact O-N 3.07Å; F242-L245 PolarHBondContact O-N 2.7Å; H243-L245 PolarHBondContact O-N 3.32Å; L245-T247 VanDerWaalsContact C-N 3.34Å; L245-L248 WeakPolarHBondContact O-CB 3.45Å; L245-L248 PolarHBondContact O-N 3.46Å; L245-L267 HydrophobicContact CB-CD2 4.37Å; L245-L267 HydrophobicContact CD1-CD2 4.28Å; L245-L267 HydrophobicContact CD2-CD2 4.18Å; L245-I271 HydrophobicContact CB-CD1 3.64Å; L245-I271 HydrophobicContact CD1-CD1 4.46Å
246	L	96.5	Very high	91.7	Very high	4 Å²	4	55 Å²	55	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-40	176.6	-175.2	64.7	0	0	0	112	F242 H243 T244 K268 I271 F293 A296 I297 L300	F242-L246 VanDerWaalsContact O-CB 3.24Å; F242-L246 WeakPolarHBondContact O-CB 3.35Å; F242-L246 PolarHBondContact O-N 2.95Å; H243-L246 WeakPolarHBondContact O-CB 3.48Å; H243-L246 PolarHBondContact O-N 3.13Å; T244-L246 VanDerWaalsContact C-N 3.34Å; T244-L246 PolarHBondContact O-N 3.02Å; L246-K268 HydrophobicContact CD1-CB 3.96Å; L246-K268 HydrophobicContact CD1-CG 4.15Å; L246-K268 WeakPolarHBondContact O-CD 3.35Å; L246-K268 WeakPolarHBondContact O-CE 3.42Å; L246-K268 PolarHBondContact O-NZ 2.83Å; L246-I271 HydrophobicContact CB-CG2 4.14Å; L246-I271 HydrophobicContact CD1-CG2 4.27Å; L246-I271 HydrophobicContact CD2-CG2 4.38Å; L246-F293 HydrophobicContact CD2-CD1 3.92Å; L246-F293 HydrophobicContact CD2-CE1 4.23Å; L246-A296 HydrophobicContact CD2-CB 3.94Å; L246-I297 HydrophobicContact CD2-CD1 4.28Å; L246-I297 HydrophobicContact CD2-CG1 3.72Å; L246-L300 HydrophobicContact CD1-CD2 4.33Å
247	T	95	Very high	91.1	Very high	76 Å²	76	52.7 Å²	52.7	47%	0.466	28%	0.277	S	S	.	.	H	α-helix	trans	-86.5	-6.7	178.8	57.2	0	0	0	0	114.1	H243 T244 L245 A296	H243-T247 PolarHBondContact O-N 3.43Å; H243-T247 PolarHBondContact O-OG1 3.2Å; H243-T247 VanDerWaalsContact O-OG1 3.05Å; T244-T247 PolarHBondContact O-N 3.22Å; T244-T247 PolarHBondContact O-OG1 3Å; T244-T247 VanDerWaalsContact O-OG1 3.05Å; L245-T247 VanDerWaalsContact C-N 3.34Å; T247-A296 HydrophobicContact CG2-CB 3.85Å
248	L	91.9	Very high	90.4	Very high	59 Å²	59	57.6 Å²	57.6	31%	0.309	30%	0.298	S	S	.	.			trans	-68.4	136.2	-180	-175.6	73	0	0	0	110.1	F209 T244 L245 K268	F209-L248 HydrophobicContact CE1-CD2 4.27Å; F209-L248 HydrophobicContact CZ-CD2 3.59Å; T244-L248 WeakPolarHBondContact O-CB 3.4Å; T244-L248 PolarHBondContact O-N 3.26Å; L245-L248 WeakPolarHBondContact O-CB 3.45Å; L245-L248 PolarHBondContact O-N 3.46Å; L248-K268 WeakPolarHBondContact O-CE 3.42Å; L248-K268 PolarHBondContact O-NZ 3.44Å
249	D	86.6	Confident	89.7	Confident	103 Å²	103	64.5 Å²	64.5	55%	0.551	33%	0.331	S	S	*	.			trans	-121.1	135.2	163.3	-176.5	28.9	0	0	0	108.7	Q254	D249-Q254 PolarHBondContact OD1-NE2 3.29Å
250	N	84.6	Confident	89.1	Confident	29 Å²	29	71 Å²	71	16%	0.155	36%	0.361	C	S	.	.			trans	-145.7	110.8	178.9	-170.7	-28	0	0	0	110.2	L205 L252 L253 Q254	L205-N250 WeakPolarHBondContact CD1-ND2 3.24Å; N250-L252 PolarHBondContact O-N 3.12Å; N250-L252 VanDerWaalsContact O-N 3.11Å; N250-L252 WeakPolarHBondContact OD1-CB 3.21Å; N250-L252 PolarHBondContact OD1-N 2.84Å; N250-L253 HydrophobicContact CB-CD1 4.18Å; N250-L253 HydrophobicContact CB-CG 4.47Å; N250-L253 PolarHBondContact O-N 2.91Å; N250-Q254 PolarHBondContact O-N 3.5Å
251	K	82	Confident	88.7	Confident	169 Å²	169	70 Å²	70	74%	0.735	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.5	-180	-63.5	-174.6	177.9	-174.9	0	114	L253 Q254	K251-L253 VanDerWaalsContact C-N 3.26Å; K251-L253 PolarHBondContact O-N 2.82Å; K251-Q254 PolarHBondContact O-N 3.36Å
252	L	84.8	Confident	88.4	Confident	66 Å²	66	68.4 Å²	68.4	35%	0.346	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-17.9	179	-59.9	179.1	0	0	0	113.4	A199 A202 L205 N250	A199-L252 WeakPolarHBondContact O-CD1 3.47Å; A202-L252 HydrophobicContact CB-CB 4.17Å; L205-L252 HydrophobicContact CD1-CB 4.34Å; L205-L252 HydrophobicContact CD1-CD1 4.09Å; N250-L252 PolarHBondContact O-N 3.12Å; N250-L252 VanDerWaalsContact O-N 3.11Å; N250-L252 WeakPolarHBondContact OD1-CB 3.21Å; N250-L252 PolarHBondContact OD1-N 2.84Å
253	L	84	Confident	88.1	Confident	9 Å²	9	70.5 Å²	70.5	5%	0.047	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-10	178.7	-67.6	173.1	0	0	0	113	L205 R206 F209 N250 K251 L264	L205-L253 HydrophobicContact CB-CD2 3.96Å; L205-L253 HydrophobicContact CB-CG 4.45Å; R206-L253 HydrophobicContact CG-CD2 4.25Å; F209-L253 HydrophobicContact CD1-CD1 3.61Å; F209-L253 HydrophobicContact CD2-CD1 3.58Å; F209-L253 HydrophobicContact CD2-CD2 4.38Å; F209-L253 HydrophobicContact CE1-CD1 3.44Å; F209-L253 VanDerWaalsContact CE1-CD1 3.44Å; F209-L253 HydrophobicContact CE2-CD1 3.41Å; F209-L253 VanDerWaalsContact CE2-CD1 3.41Å; F209-L253 HydrophobicContact CG-CD1 3.68Å; F209-L253 HydrophobicContact CG-CD2 4.32Å; F209-L253 HydrophobicContact CZ-CD1 3.34Å; N250-L253 HydrophobicContact CB-CD1 4.18Å; N250-L253 HydrophobicContact CB-CG 4.47Å; N250-L253 PolarHBondContact O-N 2.91Å; K251-L253 VanDerWaalsContact C-N 3.26Å; K251-L253 PolarHBondContact O-N 2.82Å; L253-L264 HydrophobicContact CB-CB 4.14Å
254	Q	82.1	Confident	87.8	Confident	84 Å²	84	69.1 Å²	69.1	39%	0.393	36%	0.357	S	S	.	.			trans	-66.2	138.8	174	-68.4	176.9	-1.8	0	0	109	D249 N250 K251	D249-Q254 PolarHBondContact OD1-NE2 3.29Å; N250-Q254 PolarHBondContact O-N 3.5Å; K251-Q254 PolarHBondContact O-N 3.36Å
255	T	82.5	Confident	87.7	Confident	43 Å²	43	66.4 Å²	66.4	26%	0.264	34%	0.339	S	S	.	.			trans	-99.9	138.2	172.8	-178.9	0	0	0	0	109.4	D257 E260 K309	T255-D257 HydrophobicContact CG2-CB 4.41Å; T255-D257 PolarHBondContact O-N 3.23Å; T255-D257 VanDerWaalsContact OG1-CB 3.31Å; T255-D257 WeakPolarHBondContact OG1-CB 3.49Å; T255-D257 PolarHBondContact OG1-N 3.32Å; T255-E260 WeakPolarHBondContact CG2-O 3.32Å; T255-K309 HydrophobicContact CG2-CD 4.24Å; T255-K309 PolarHBondContact O-NZ 3.48Å
256	D	79.5	Confident	87.6	Confident	169 Å²	169	69 Å²	69	90%	0.904	35%	0.353	S	S	*	.	S	Bend	trans	-73.1	-12.9	172.5	-64	-35.7	0	0	0	111.5
257	D	83.8	Confident	87.6	Confident	66 Å²	66	68.8 Å²	68.8	35%	0.353	35%	0.352	S	S	.	.			trans	-69.7	131.4	175.9	-159	-49.7	0	0	0	110.4	T255 E259 E260 K309	T255-D257 HydrophobicContact CG2-CB 4.41Å; T255-D257 PolarHBondContact O-N 3.23Å; T255-D257 VanDerWaalsContact OG1-CB 3.31Å; T255-D257 WeakPolarHBondContact OG1-CB 3.49Å; T255-D257 PolarHBondContact OG1-N 3.32Å; D257-E259 WeakPolarHBondContact OD1-CA 3.43Å; D257-E259 WeakPolarHBondContact OD1-CB 3.36Å; D257-E259 PolarHBondContact OD1-N 2.69Å; D257-E260 HydrophobicContact CB-CB 4.28Å; D257-E260 PolarHBondContact OD1-N 3.11Å; D257-K309 VanDerWaalsContact O-CD 3.25Å; D257-K309 WeakPolarHBondContact O-CD 3.45Å; D257-K309 WeakPolarHBondContact O-CE 3.18Å; D257-K309 PolarHBondContact O-NZ 2.77Å
258	E	82.9	Confident	87.8	Confident	134 Å²	134	66.2 Å²	66.2	63%	0.626	33%	0.334	S	S	*	.	S	Bend	trans	-88.5	-12.1	176.6	-69.3	-174.1	178.6	0	0	112.7	V308 K309	E258-V308 PolarHBondContact O-N 3.48Å; E258-K309 WeakPolarHBondContact O-CB 3.36Å; E258-K309 PolarHBondContact O-N 3.37Å
259	E	83.7	Confident	87.9	Confident	145 Å²	145	63.7 Å²	63.7	68%	0.678	32%	0.321	S	S	*	.	S	Bend	trans	-103.9	-44.4	-178.2	-62.6	-179.6	-167	0	0	112.6	D257 K309	D257-E259 WeakPolarHBondContact OD1-CA 3.43Å; D257-E259 WeakPolarHBondContact OD1-CB 3.36Å; D257-E259 PolarHBondContact OD1-N 2.69Å; E259-K309 WeakPolarHBondContact O-CA 3.5Å; E259-K309 PolarHBondContact O-N 3.16Å
260	E	86.4	Confident	88.5	Confident	138 Å²	138	59.2 Å²	59.2	65%	0.645	30%	0.297	S	S	*	.	S	Bend	trans	-88.7	127.6	-177.4	-166.6	174.1	-172.4	0	0	112.3	T255 D257 K309	T255-E260 WeakPolarHBondContact CG2-O 3.32Å; D257-E260 HydrophobicContact CB-CB 4.28Å; D257-E260 PolarHBondContact OD1-N 3.11Å; E260-K309 WeakPolarHBondContact O-CB 3.39Å
261	A	89.4	Confident	89.1	Confident	24 Å²	24	57.9 Å²	57.9	20%	0.198	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-68.3	131	175.7	0	0	0	0	0	111.8	E265 L266 K309	A261-E265 HydrophobicContact CB-CB 4.18Å; A261-L266 HydrophobicContact CB-CD2 4.03Å; A261-L266 HydrophobicContact CB-CG 4.1Å; A261-K309 VanDerWaalsContact CB-O 3.31Å; A261-K309 WeakPolarHBondContact CB-O 3.48Å
262	G	91	Very high	89.8	Confident	8 Å²	8	49.8 Å²	49.8	8%	0.082	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-70.6	168.8	172.1	0	0	0	0	0	112.7	L264 E265 L266	G262-L264 PolarHBondContact O-N 2.66Å; G262-E265 WeakPolarHBondContact CA-OE2 3.48Å; G262-E265 PolarHBondContact N-OE2 3.36Å; G262-E265 PolarHBondContact O-N 3.44Å; G262-L266 WeakPolarHBondContact O-CG 3.39Å; G262-L266 PolarHBondContact O-N 2.79Å
263	L	91.8	Very high	90.3	Very high	45 Å²	45	48.2 Å²	48.2	24%	0.236	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-29.6	179.1	-67.4	172.7	0	0	0	112.7	R206 F209 I213 L267	R206-L263 HydrophobicContact CB-CD1 3.83Å; R206-L263 HydrophobicContact CG-CD1 3.96Å; R206-L263 VanDerWaalsContact O-CD1 3.27Å; R206-L263 WeakPolarHBondContact O-CD1 3.31Å; F209-L263 HydrophobicContact CB-CB 4.02Å; F209-L263 HydrophobicContact CB-CD1 4.27Å; I213-L263 HydrophobicContact CD1-CB 4.3Å; I213-L263 HydrophobicContact CD1-CD2 3.71Å; L263-L267 WeakPolarHBondContact O-CB 3.33Å; L263-L267 PolarHBondContact O-N 2.87Å
264	L	93.2	Very high	91	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-67.6	-47.7	176.6	-178.4	61.4	0	0	0	110.2	F209 L253 G262 L267 K268	F209-L264 HydrophobicContact CE1-CD1 3.81Å; L253-L264 HydrophobicContact CB-CB 4.14Å; G262-L264 PolarHBondContact O-N 2.66Å; L264-L267 PolarHBondContact O-N 2.78Å; L264-K268 HydrophobicContact CG-CD 4.42Å; L264-K268 VanDerWaalsContact O-CG 3.29Å; L264-K268 WeakPolarHBondContact O-CG 3.39Å; L264-K268 PolarHBondContact O-N 3.32Å
265	E	94.1	Very high	91.7	Very high	14 Å²	14	44 Å²	44	7%	0.065	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-45.4	178.4	-67.2	67.7	-150.3	0	0	111.2	A261 G262 L267 K268 S269 Y310 L313	A261-E265 HydrophobicContact CB-CB 4.18Å; G262-E265 WeakPolarHBondContact CA-OE2 3.48Å; G262-E265 PolarHBondContact N-OE2 3.36Å; G262-E265 PolarHBondContact O-N 3.44Å; E265-L267 VanDerWaalsContact C-N 3.33Å; E265-L267 PolarHBondContact O-N 3.4Å; E265-K268 PolarHBondContact O-N 3.44Å; E265-S269 WeakPolarHBondContact O-CB 3.28Å; E265-S269 PolarHBondContact O-N 2.68Å; E265-Y310 HydrophobicContact CG-CD1 3.75Å; E265-Y310 HydrophobicContact CG-CE1 3.68Å; E265-L313 HydrophobicContact CB-CD2 4.37Å; E265-L313 HydrophobicContact CG-CD2 4.33Å
266	L	94.5	Very high	92.2	Very high	62 Å²	62	42.1 Å²	42.1	33%	0.325	22%	0.216	S	C	.	.	H	α-helix	trans	-60.8	-39.8	176.3	-70.2	175.1	0	0	0	112.5	I213 A261 G262 Q270 L312	I213-L266 HydrophobicContact CD1-CB 3.82Å; I213-L266 HydrophobicContact CD1-CD1 4.48Å; I213-L266 HydrophobicContact CG1-CB 4.45Å; A261-L266 HydrophobicContact CB-CD2 4.03Å; A261-L266 HydrophobicContact CB-CG 4.1Å; G262-L266 WeakPolarHBondContact O-CG 3.39Å; G262-L266 PolarHBondContact O-N 2.79Å; L266-Q270 PolarHBondContact O-N 3.44Å; L266-Q270 VanDerWaalsContact O-N 3.08Å; L266-L312 HydrophobicContact CD2-CD2 4.04Å
267	L	96.9	Very high	92.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.1	-46.1	176.2	179.8	58.5	0	0	0	111.2	F209 L212 I213 S216 L245 L263 L264 E265 S269 Q270 I271	F209-L267 HydrophobicContact CD1-CD2 3.66Å; F209-L267 HydrophobicContact CE1-CD2 3.69Å; L212-L267 HydrophobicContact CB-CD1 4.02Å; L212-L267 HydrophobicContact CB-CD2 3.92Å; L212-L267 HydrophobicContact CD1-CD2 4.13Å; I213-L267 HydrophobicContact CG1-CB 3.8Å; I213-L267 HydrophobicContact CG1-CD1 4.18Å; S216-L267 WeakPolarHBondContact OG-CD1 3.49Å; L245-L267 HydrophobicContact CB-CD2 4.37Å; L245-L267 HydrophobicContact CD1-CD2 4.28Å; L245-L267 HydrophobicContact CD2-CD2 4.18Å; L263-L267 WeakPolarHBondContact O-CB 3.33Å; L263-L267 PolarHBondContact O-N 2.87Å; L264-L267 PolarHBondContact O-N 2.78Å; E265-L267 VanDerWaalsContact C-N 3.33Å; E265-L267 PolarHBondContact O-N 3.4Å; L267-S269 VanDerWaalsContact C-N 3.3Å; L267-S269 PolarHBondContact O-N 3.5Å; L267-Q270 PolarHBondContact O-N 3.25Å; L267-I271 HydrophobicContact CD1-CD1 4.11Å; L267-I271 HydrophobicContact CD1-CG1 4.37Å; L267-I271 HydrophobicContact CG-CD1 3.9Å; L267-I271 VanDerWaalsContact O-CG1 3.29Å; L267-I271 WeakPolarHBondContact O-CG1 3.38Å; L267-I271 PolarHBondContact O-N 2.73Å
268	K	97.3	Very high	93.5	Very high	22 Å²	22	31.1 Å²	31.1	10%	0.096	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-39.6	177.8	-69.8	-174.4	-179.1	-171	0	111.8	L246 L248 L264 E265 I271 C272 L300 L313	L246-K268 HydrophobicContact CD1-CB 3.96Å; L246-K268 HydrophobicContact CD1-CG 4.15Å; L246-K268 WeakPolarHBondContact O-CD 3.35Å; L246-K268 WeakPolarHBondContact O-CE 3.42Å; L246-K268 PolarHBondContact O-NZ 2.83Å; L248-K268 WeakPolarHBondContact O-CE 3.42Å; L248-K268 PolarHBondContact O-NZ 3.44Å; L264-K268 HydrophobicContact CG-CD 4.42Å; L264-K268 VanDerWaalsContact O-CG 3.29Å; L264-K268 WeakPolarHBondContact O-CG 3.39Å; L264-K268 PolarHBondContact O-N 3.32Å; E265-K268 PolarHBondContact O-N 3.44Å; K268-I271 PolarHBondContact O-N 3.07Å; K268-C272 PolarHBondContact O-N 3.39Å; K268-C272 PolarHBondContact O-SG 3.43Å; K268-L300 HydrophobicContact CD-CD1 4.23Å; K268-L313 HydrophobicContact CB-CD1 3.48Å; K268-L313 VanDerWaalsContact CB-CD1 3.48Å; K268-L313 HydrophobicContact CB-CD2 4.3Å; K268-L313 HydrophobicContact CD-CD2 4.46Å
269	S	95.7	Very high	94	Very high	6 Å²	6	24.8 Å²	24.8	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-60.5	-50	175	155.3	0	0	0	0	110.4	E265 L267 I271 C272 D273 L312 L313 N316	E265-S269 WeakPolarHBondContact O-CB 3.28Å; E265-S269 PolarHBondContact O-N 2.68Å; L267-S269 VanDerWaalsContact C-N 3.3Å; L267-S269 PolarHBondContact O-N 3.5Å; S269-I271 VanDerWaalsContact C-N 3.27Å; S269-I271 PolarHBondContact O-N 3.1Å; S269-C272 WeakPolarHBondContact O-CB 3.36Å; S269-C272 PolarHBondContact O-N 2.92Å; S269-D273 PolarHBondContact O-N 2.94Å; S269-D273 VanDerWaalsContact O-N 3.07Å; S269-L312 WeakPolarHBondContact OG-CG 3.33Å; S269-L313 VanDerWaalsContact N-CD1 3.34Å; S269-N316 PolarHBondContact OG-ND2 3.08Å
270	Q	97.3	Very high	94.4	Very high	10 Å²	10	21.5 Å²	21.5	5%	0.047	11%	0.112	C	C	.	.	H	α-helix	trans	-61.9	-35.5	176.9	-174.4	60.7	54.5	0	0	112.3	K217 L266 L267 C272 D273 N274	K217-Q270 HydrophobicContact CG-CG 3.91Å; L266-Q270 PolarHBondContact O-N 3.44Å; L266-Q270 VanDerWaalsContact O-N 3.08Å; L267-Q270 PolarHBondContact O-N 3.25Å; Q270-C272 VanDerWaalsContact C-N 3.34Å; Q270-D273 WeakPolarHBondContact O-CB 3.35Å; Q270-D273 PolarHBondContact O-N 3.38Å; Q270-N274 PolarHBondContact NE2-OD1 3.25Å; Q270-N274 PolarHBondContact O-N 3.47Å; Q270-N274 PolarHBondContact O-OD1 3.26Å
271	I	98.3	Very high	94.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.5	-37.9	175.2	-69.9	164.3	0	0	0	111	F242 L245 L246 L267 K268 S269 D273 N274 A275 F293	F242-I271 HydrophobicContact CB-CG1 4.38Å; F242-I271 HydrophobicContact CB-CG2 3.92Å; F242-I271 HydrophobicContact CD1-CD1 4.24Å; F242-I271 HydrophobicContact CD1-CG1 3.9Å; F242-I271 HydrophobicContact CE1-CG1 4.47Å; F242-I271 HydrophobicContact CG-CG1 4.23Å; F242-I271 HydrophobicContact CG-CG2 4.4Å; L245-I271 HydrophobicContact CB-CD1 3.64Å; L245-I271 HydrophobicContact CD1-CD1 4.46Å; L246-I271 HydrophobicContact CB-CG2 4.14Å; L246-I271 HydrophobicContact CD1-CG2 4.27Å; L246-I271 HydrophobicContact CD2-CG2 4.38Å; L267-I271 HydrophobicContact CD1-CD1 4.11Å; L267-I271 HydrophobicContact CD1-CG1 4.37Å; L267-I271 HydrophobicContact CG-CD1 3.9Å; L267-I271 VanDerWaalsContact O-CG1 3.29Å; L267-I271 WeakPolarHBondContact O-CG1 3.38Å; L267-I271 PolarHBondContact O-N 2.73Å; K268-I271 PolarHBondContact O-N 3.07Å; S269-I271 VanDerWaalsContact C-N 3.27Å; S269-I271 PolarHBondContact O-N 3.1Å; I271-D273 VanDerWaalsContact C-N 3.32Å; I271-D273 PolarHBondContact O-N 3.16Å; I271-N274 PolarHBondContact O-N 3.34Å; I271-A275 WeakPolarHBondContact O-CB 3.5Å; I271-A275 PolarHBondContact O-N 3.31Å; I271-F293 HydrophobicContact CG2-CE1 4.04Å
272	C	97.4	Very high	94.9	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.2	-42.8	173.3	-64.7	0	0	0	0	110.9	K268 S269 Q270 N274 A275 A276 N316	K268-C272 PolarHBondContact O-N 3.39Å; K268-C272 PolarHBondContact O-SG 3.43Å; S269-C272 WeakPolarHBondContact O-CB 3.36Å; S269-C272 PolarHBondContact O-N 2.92Å; Q270-C272 VanDerWaalsContact C-N 3.34Å; C272-N274 PolarHBondContact O-N 3.49Å; C272-A275 PolarHBondContact O-N 3.45Å; C272-A276 VanDerWaalsContact O-CB 3.27Å; C272-A276 WeakPolarHBondContact O-CB 3.44Å; C272-A276 PolarHBondContact O-N 3.12Å; C272-N316 HydrophobicContact CB-CB 3.9Å
273	D	95.3	Very high	94.9	Very high	33 Å²	33	19.9 Å²	19.9	18%	0.176	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-44.7	174.7	-68.9	-10.9	0	0	0	112	Y220 S269 Q270 I271 A275 A276 L277 N316	Y220-D273 HydrophobicContact CD2-CB 4.1Å; Y220-D273 HydrophobicContact CE2-CB 3.83Å; Y220-D273 WeakPolarHBondContact CE2-O 3.47Å; S269-D273 PolarHBondContact O-N 2.94Å; S269-D273 VanDerWaalsContact O-N 3.07Å; Q270-D273 WeakPolarHBondContact O-CB 3.35Å; Q270-D273 PolarHBondContact O-N 3.38Å; I271-D273 VanDerWaalsContact C-N 3.32Å; I271-D273 PolarHBondContact O-N 3.16Å; D273-A275 VanDerWaalsContact C-N 3.34Å; D273-A275 PolarHBondContact O-N 3.44Å; D273-A276 PolarHBondContact O-N 3.15Å; D273-L277 WeakPolarHBondContact O-CB 3.2Å; D273-L277 PolarHBondContact O-N 3.28Å; D273-N316 VanDerWaalsContact CG-ND2 3.34Å; D273-N316 WeakPolarHBondContact OD1-CB 3.33Å; D273-N316 PolarHBondContact OD1-ND2 2.91Å; D273-N316 PolarHBondContact OD2-ND2 3.13Å
274	N	97.4	Very high	95	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-61.9	-44.3	178.7	-66.8	11.8	0	0	0	111	S216 F219 Y220 F242 Q270 I271 C272 L277 Y278	S216-N274 PolarHBondContact O-ND2 3.12Å; S216-N274 PolarHBondContact O-OD1 2.96Å; F219-N274 HydrophobicContact CD1-CB 4.31Å; F219-N274 WeakPolarHBondContact CD1-ND2 3.27Å; F219-N274 HydrophobicContact CE1-CB 4.37Å; Y220-N274 WeakPolarHBondContact CB-OD1 3.5Å; Y220-N274 VanDerWaalsContact CD2-OD1 3.3Å; Y220-N274 WeakPolarHBondContact CD2-OD1 3.4Å; F242-N274 HydrophobicContact CE2-CB 4.23Å; F242-N274 WeakPolarHBondContact CZ-ND2 3.19Å; Q270-N274 PolarHBondContact NE2-OD1 3.25Å; Q270-N274 PolarHBondContact O-N 3.47Å; Q270-N274 PolarHBondContact O-OD1 3.26Å; I271-N274 PolarHBondContact O-N 3.34Å; C272-N274 PolarHBondContact O-N 3.49Å; N274-L277 PolarHBondContact O-N 3.5Å; N274-Y278 WeakPolarHBondContact O-CD2 3.5Å; N274-Y278 PolarHBondContact O-N 3.48Å; N274-Y278 VanDerWaalsContact O-N 3.13Å
275	A	96.9	Very high	95	Very high	2 Å²	2	28.3 Å²	28.3	2%	0.017	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-39.5	176.4	0	0	0	0	0	111.7	I271 C272 D273 Y278 A279 F286 F293 F320	I271-A275 WeakPolarHBondContact O-CB 3.5Å; I271-A275 PolarHBondContact O-N 3.31Å; C272-A275 PolarHBondContact O-N 3.45Å; D273-A275 VanDerWaalsContact C-N 3.34Å; D273-A275 PolarHBondContact O-N 3.44Å; A275-Y278 PolarHBondContact O-N 2.7Å; A275-A279 WeakPolarHBondContact O-CB 3.38Å; A275-A279 PolarHBondContact O-N 3.38Å; A275-F286 HydrophobicContact CB-CZ 4.07Å; A275-F293 HydrophobicContact CB-CD1 3.85Å; A275-F293 HydrophobicContact CB-CE1 4.16Å; A275-F293 HydrophobicContact CB-CG 4.37Å; A275-F320 HydrophobicContact CB-CD2 3.88Å; A275-F320 HydrophobicContact CB-CE2 3.78Å
276	A	94.1	Very high	95.1	Very high	4 Å²	4	27.6 Å²	27.6	3%	0.033	13%	0.132	C	C	.	.	H	α-helix	trans	-66.1	-42.7	177.2	0	0	0	0	0	111.3	C272 D273 Y278 A279 Q280 F320	C272-A276 VanDerWaalsContact O-CB 3.27Å; C272-A276 WeakPolarHBondContact O-CB 3.44Å; C272-A276 PolarHBondContact O-N 3.12Å; D273-A276 PolarHBondContact O-N 3.15Å; A276-Y278 VanDerWaalsContact C-N 3.33Å; A276-Y278 PolarHBondContact O-N 3.38Å; A276-A279 PolarHBondContact O-N 2.93Å; A276-Q280 VanDerWaalsContact O-CB 3.24Å; A276-Q280 WeakPolarHBondContact O-CB 3.39Å; A276-Q280 WeakPolarHBondContact O-CG 3.43Å; A276-Q280 PolarHBondContact O-N 3.02Å; A276-F320 HydrophobicContact CB-CB 4.25Å; A276-F320 HydrophobicContact CB-CD2 4.19Å
277	L	94.6	Very high	95	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-56.2	-48.2	173.8	174.5	66.8	0	0	0	111.2	Y220 N223 F224 D273 N274 Q280 K281 Y282	Y220-L277 HydrophobicContact CD2-CB 4.23Å; Y220-L277 HydrophobicContact CD2-CD2 3.79Å; Y220-L277 HydrophobicContact CE2-CB 3.75Å; Y220-L277 HydrophobicContact CE2-CD2 3.88Å; Y220-L277 HydrophobicContact CE2-CG 4.31Å; Y220-L277 HydrophobicContact CG-CD2 4.25Å; N223-L277 HydrophobicContact CB-CD2 4.33Å; F224-L277 HydrophobicContact CD2-CD1 3.93Å; F224-L277 HydrophobicContact CD2-CD2 4.47Å; F224-L277 HydrophobicContact CE2-CD1 4.31Å; D273-L277 WeakPolarHBondContact O-CB 3.2Å; D273-L277 PolarHBondContact O-N 3.28Å; N274-L277 PolarHBondContact O-N 3.5Å; L277-Q280 PolarHBondContact O-N 2.97Å; L277-K281 HydrophobicContact CD1-CD 3.62Å; L277-K281 HydrophobicContact CD1-CG 4.04Å; L277-K281 WeakPolarHBondContact O-CB 3.35Å; L277-K281 PolarHBondContact O-N 3.29Å; L277-Y282 HydrophobicContact CG-CE2 4.43Å
278	Y	95.8	Very high	94.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67.6	-44	179.9	-91.8	-108.7	0	0	0	112.3	F219 N223 L227 M235 M239 N274 A275 A276 Q280 Y282 D283 F286	F219-Y278 HydrophobicContact CE1-CD2 4.1Å; F219-Y278 AromaticContact CE1-CE2 3.34Å; F219-Y278 HydrophobicContact CE1-CE2 3.34Å; F219-Y278 AromaticContact CE1-CZ 3.88Å; F219-Y278 HydrophobicContact CZ-CD2 4.46Å; F219-Y278 HydrophobicContact CZ-CE1 4.5Å; F219-Y278 AromaticContact CZ-CE2 3.47Å; F219-Y278 HydrophobicContact CZ-CE2 3.47Å; F219-Y278 VanDerWaalsContact CZ-CE2 3.47Å; F219-Y278 AromaticContact CZ-CZ 3.46Å; F219-Y278 VanDerWaalsContact CZ-CZ 3.46Å; F219-Y278 WeakPolarHBondContact CZ-OH 3.43Å; N223-Y278 HydrophobicContact CB-CE2 3.91Å; N223-Y278 PolarHBondContact OD1-OH 3.11Å; L227-Y278 HydrophobicContact CD1-CE1 3.86Å; L227-Y278 VanDerWaalsContact CD1-OH 3.26Å; L227-Y278 WeakPolarHBondContact CD1-OH 3.36Å; M235-Y278 HydrophobicContact CE-CD1 3.4Å; M235-Y278 VanDerWaalsContact CE-CD1 3.4Å; M235-Y278 HydrophobicContact CE-CE1 3.58Å; M235-Y278 HydrophobicContact CG-CE1 4.44Å; M235-Y278 HydrophobicContact SD-CE1 4.33Å; M239-Y278 HydrophobicContact CE-CD1 3.56Å; M239-Y278 HydrophobicContact CE-CD2 4.11Å; M239-Y278 HydrophobicContact CE-CE1 3.46Å; M239-Y278 VanDerWaalsContact CE-CE1 3.46Å; M239-Y278 HydrophobicContact CE-CE2 4.08Å; M239-Y278 HydrophobicContact CE-CG 3.85Å; N274-Y278 WeakPolarHBondContact O-CD2 3.5Å; N274-Y278 PolarHBondContact O-N 3.48Å; N274-Y278 VanDerWaalsContact O-N 3.13Å; A275-Y278 PolarHBondContact O-N 2.7Å; A276-Y278 VanDerWaalsContact C-N 3.33Å; A276-Y278 PolarHBondContact O-N 3.38Å; Y278-Q280 PolarHBondContact O-N 2.89Å; Y278-Y282 AromaticContact CD1-CD2 4Å; Y278-Y282 HydrophobicContact CD1-CD2 4Å; Y278-Y282 AromaticContact CD2-CD2 3.99Å; Y278-Y282 HydrophobicContact CD2-CD2 3.99Å; Y278-Y282 HydrophobicContact CD2-CE2 4.49Å; Y278-Y282 HydrophobicContact CE1-CD2 4.14Å; Y278-Y282 HydrophobicContact CE2-CD2 4.06Å; Y278-Y282 HydrophobicContact CE2-CE2 4.37Å; Y278-Y282 AromaticContact CG-CD2 3.98Å; Y278-Y282 HydrophobicContact CG-CD2 3.98Å; Y278-Y282 CarbonylContact O-C 3.59Å; Y278-Y282 WeakPolarHBondContact O-CA 3.47Å; Y278-Y282 PolarHBondContact O-N 3.32Å; Y278-D283 PolarHBondContact O-N 3.2Å; Y278-F286 HydrophobicContact CD1-CB 4.36Å; Y278-F286 HydrophobicContact CD1-CD2 4.23Å; Y278-F286 HydrophobicContact CG-CD2 4.42Å
279	A	92.7	Very high	94.8	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-29.5	173.4	0	0	0	0	0	112.8	A275 A276 F286 L290 F320 V324	A275-A279 WeakPolarHBondContact O-CB 3.38Å; A275-A279 PolarHBondContact O-N 3.38Å; A276-A279 PolarHBondContact O-N 2.93Å; A279-F286 HydrophobicContact CB-CD1 3.97Å; A279-F286 HydrophobicContact CB-CE1 4.01Å; A279-L290 HydrophobicContact CB-CD1 4.16Å; A279-F320 HydrophobicContact CB-CE2 4.26Å; A279-V324 HydrophobicContact CB-CG2 4.18Å
280	Q	91.7	Very high	94.7	Very high	76 Å²	76	36.8 Å²	36.8	36%	0.355	17%	0.166	S	C	.	.	H	α-helix	trans	-86.6	-40.7	-178.4	-72.7	171.7	25.4	0	0	113.7	A276 L277 Y278 R327	A276-Q280 VanDerWaalsContact O-CB 3.24Å; A276-Q280 WeakPolarHBondContact O-CB 3.39Å; A276-Q280 WeakPolarHBondContact O-CG 3.43Å; A276-Q280 PolarHBondContact O-N 3.02Å; L277-Q280 PolarHBondContact O-N 2.97Å; Y278-Q280 PolarHBondContact O-N 2.89Å; Q280-R327 PolarHBondContact O-NH2 3.16Å
281	K	92.9	Very high	94.4	Very high	94 Å²	94	39.4 Å²	39.4	41%	0.409	18%	0.184	S	C	.	.	H	α-helix	trans	-107.9	-30.6	-171.4	-61.4	-164.6	-171.6	-178.3	0	114	F224 L277	F224-K281 PolarHBondContact O-NZ 3.22Å; L277-K281 HydrophobicContact CD1-CD 3.62Å; L277-K281 HydrophobicContact CD1-CG 4.04Å; L277-K281 WeakPolarHBondContact O-CB 3.35Å; L277-K281 PolarHBondContact O-N 3.29Å
282	Y	94.5	Very high	94.2	Very high	14 Å²	14	44.7 Å²	44.7	6%	0.055	20%	0.204	C	C	.	.			trans	-127.4	47.8	-170.7	-45	-49.1	0	0	0	110.3	N223 D226 L227 L277 Y278 E284 E285 F286	N223-Y282 HydrophobicContact CB-CE2 4.43Å; N223-Y282 WeakPolarHBondContact O-CE2 3.41Å; N223-Y282 VanDerWaalsContact O-CZ 3.28Å; N223-Y282 PolarHBondContact O-OH 2.92Å; D226-Y282 VanDerWaalsContact C-CZ 3.42Å; D226-Y282 WeakPolarHBondContact CA-OH 3.22Å; D226-Y282 PolarHBondContact N-OH 2.84Å; D226-Y282 PolarHBondContact O-OH 3.31Å; D226-Y282 VanDerWaalsContact O-OH 3.08Å; L227-Y282 HydrophobicContact CB-CD1 3.56Å; L227-Y282 HydrophobicContact CB-CD2 4.11Å; L227-Y282 HydrophobicContact CB-CE1 3.63Å; L227-Y282 HydrophobicContact CB-CE2 4.17Å; L227-Y282 HydrophobicContact CB-CG 3.84Å; L227-Y282 HydrophobicContact CD1-CD2 4.33Å; L227-Y282 HydrophobicContact CD2-CD1 4.45Å; L227-Y282 HydrophobicContact CD2-CG 4.19Å; L227-Y282 HydrophobicContact CG-CG 4.42Å; L227-Y282 PolarHBondContact N-OH 3.17Å; L277-Y282 HydrophobicContact CG-CE2 4.43Å; Y278-Y282 AromaticContact CD1-CD2 4Å; Y278-Y282 HydrophobicContact CD1-CD2 4Å; Y278-Y282 AromaticContact CD2-CD2 3.99Å; Y278-Y282 HydrophobicContact CD2-CD2 3.99Å; Y278-Y282 HydrophobicContact CD2-CE2 4.49Å; Y278-Y282 HydrophobicContact CE1-CD2 4.14Å; Y278-Y282 HydrophobicContact CE2-CD2 4.06Å; Y278-Y282 HydrophobicContact CE2-CE2 4.37Å; Y278-Y282 AromaticContact CG-CD2 3.98Å; Y278-Y282 HydrophobicContact CG-CD2 3.98Å; Y278-Y282 CarbonylContact O-C 3.59Å; Y278-Y282 WeakPolarHBondContact O-CA 3.47Å; Y278-Y282 PolarHBondContact O-N 3.32Å; Y282-E284 VanDerWaalsContact C-N 3.32Å; Y282-E284 PolarHBondContact O-N 3.06Å; Y282-E285 VanDerWaalsContact C-OE2 3.25Å; Y282-E285 WeakPolarHBondContact CA-OE2 3.37Å; Y282-E285 PolarHBondContact O-N 3.1Å; Y282-F286 WeakPolarHBondContact O-CB 3.36Å; Y282-F286 PolarHBondContact O-N 3.25Å
283	D	91.4	Very high	94.2	Very high	28 Å²	28	44.9 Å²	44.9	15%	0.15	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-40.1	-171.3	-172.2	34.3	0	0	0	111.7	Y278 E285 F286 Q287 Y330	Y278-D283 PolarHBondContact O-N 3.2Å; D283-E285 VanDerWaalsContact C-N 3.33Å; D283-E285 PolarHBondContact O-N 3.11Å; D283-F286 PolarHBondContact O-N 2.85Å; D283-Q287 WeakPolarHBondContact O-CB 3.4Å; D283-Q287 PolarHBondContact O-N 3.34Å; D283-Y330 WeakPolarHBondContact OD1-CE2 3.1Å; D283-Y330 PolarHBondContact OD1-OH 3.48Å
284	E	92.7	Very high	94.1	Very high	166 Å²	166	44.2 Å²	44.2	78%	0.776	20%	0.201	S	C	*	.	H	α-helix	trans	-59.8	-43.9	-177.7	-61.3	-172.8	-178.2	0	0	111.4	Y282	Y282-E284 VanDerWaalsContact C-N 3.32Å; Y282-E284 PolarHBondContact O-N 3.06Å
285	E	94.5	Very high	93.8	Very high	57 Å²	57	48.1 Å²	48.1	27%	0.266	23%	0.225	S	C	.	.	H	α-helix	trans	-80.2	-33.8	-179.8	-54.9	78.4	-171.7	0	0	111.6	L227 E232 M235 Y282 D283	L227-E285 HydrophobicContact CD2-CB 4.22Å; L227-E285 HydrophobicContact CD2-CG 3.8Å; E232-E285 HydrophobicContact CG-CG 4.36Å; M235-E285 HydrophobicContact CE-CB 4.1Å; M235-E285 WeakPolarHBondContact CE-O 3.48Å; M235-E285 HydrophobicContact SD-CB 3.77Å; Y282-E285 VanDerWaalsContact C-OE2 3.25Å; Y282-E285 WeakPolarHBondContact CA-OE2 3.37Å; Y282-E285 PolarHBondContact O-N 3.1Å; D283-E285 VanDerWaalsContact C-N 3.33Å; D283-E285 PolarHBondContact O-N 3.11Å
286	F	94.9	Very high	93.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-79.8	-19.6	-177.5	-169.2	-120	0	0	0	114.1	M235 M239 A275 Y278 A279 Y282 D283 R288 Y289 L290 F293 F320	M235-F286 VanDerWaalsContact CE-CA 3.41Å; M235-F286 HydrophobicContact CE-CB 3.76Å; M235-F286 HydrophobicContact CE-CD2 3.73Å; M235-F286 HydrophobicContact CE-CG 4.25Å; M239-F286 HydrophobicContact CE-CD2 4.45Å; M239-F286 HydrophobicContact CE-CE2 4.48Å; M239-F286 HydrophobicContact CG-CD2 4.44Å; M239-F286 HydrophobicContact CG-CE2 4.32Å; M239-F286 HydrophobicContact SD-CD2 4.05Å; M239-F286 HydrophobicContact SD-CE2 3.62Å; A275-F286 HydrophobicContact CB-CZ 4.07Å; Y278-F286 HydrophobicContact CD1-CB 4.36Å; Y278-F286 HydrophobicContact CD1-CD2 4.23Å; Y278-F286 HydrophobicContact CG-CD2 4.42Å; A279-F286 HydrophobicContact CB-CD1 3.97Å; A279-F286 HydrophobicContact CB-CE1 4.01Å; Y282-F286 WeakPolarHBondContact O-CB 3.36Å; Y282-F286 PolarHBondContact O-N 3.25Å; D283-F286 PolarHBondContact O-N 2.85Å; F286-R288 PolarHBondContact O-N 3.19Å; F286-Y289 HydrophobicContact CD2-CD2 4.21Å; F286-Y289 PolarHBondContact O-N 3.03Å; F286-L290 HydrophobicContact CD1-CB 4.11Å; F286-L290 HydrophobicContact CD1-CD1 3.92Å; F286-L290 HydrophobicContact CE1-CB 4.11Å; F286-L290 HydrophobicContact CE1-CD1 3.51Å; F286-L290 HydrophobicContact CE1-CG 4.45Å; F286-L290 PolarHBondContact O-N 3.16Å; F286-F293 AromaticContact CE2-CD2 3.87Å; F286-F293 HydrophobicContact CE2-CD2 3.87Å; F286-F293 AromaticContact CE2-CE2 3.91Å; F286-F293 HydrophobicContact CE2-CE2 3.91Å; F286-F293 HydrophobicContact CZ-CB 4.28Å; F286-F293 AromaticContact CZ-CD2 3.61Å; F286-F293 HydrophobicContact CZ-CD2 3.61Å; F286-F293 HydrophobicContact CZ-CE2 4.08Å; F286-F293 AromaticContact CZ-CG 3.94Å; F286-F293 HydrophobicContact CZ-CG 3.94Å; F286-F320 HydrophobicContact CE1-CE2 4.27Å
287	Q	92.8	Very high	93.9	Very high	110 Å²	110	48.3 Å²	48.3	51%	0.514	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-41.4	-174.6	-170.9	177.8	21.7	0	0	114	D283 Y289 P291 Y330	D283-Q287 WeakPolarHBondContact O-CB 3.4Å; D283-Q287 PolarHBondContact O-N 3.34Å; Q287-Y289 VanDerWaalsContact C-N 3.31Å; Q287-Y289 PolarHBondContact O-N 3.14Å; Q287-P291 WeakPolarHBondContact O-CD 3.4Å; Q287-Y330 HydrophobicContact CG-CE1 4.25Å
288	R	94.5	Very high	93.7	Very high	159 Å²	159	50.8 Å²	50.8	60%	0.6	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-24.9	-179.8	63.7	178.2	165.1	160.5	-1.2	114.3	F286	F286-R288 PolarHBondContact O-N 3.19Å
289	Y	95.5	Very high	93.6	Very high	14 Å²	14	54.8 Å²	54.8	6%	0.055	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-28.4	179.8	-56	-74.7	0	0	0	112.2	M235 E236 M239 F286 Q287 R292 F293	M235-Y289 HydrophobicContact CB-CE2 4.47Å; M235-Y289 HydrophobicContact CE-CD2 3.88Å; M235-Y289 HydrophobicContact CE-CE2 3.91Å; M235-Y289 HydrophobicContact CG-CD2 4.42Å; M235-Y289 HydrophobicContact CG-CE2 3.7Å; M235-Y289 HydrophobicContact SD-CD2 4.35Å; M235-Y289 HydrophobicContact SD-CE2 3.77Å; E236-Y289 WeakPolarHBondContact CA-OH 3.38Å; E236-Y289 VanDerWaalsContact CB-OH 3.31Å; E236-Y289 WeakPolarHBondContact CB-OH 3.45Å; E236-Y289 PolarHBondContact N-OH 3.46Å; E236-Y289 VanDerWaalsContact N-OH 3.17Å; M239-Y289 HydrophobicContact CB-CD1 3.54Å; M239-Y289 HydrophobicContact CB-CD2 4.08Å; M239-Y289 HydrophobicContact CB-CE1 3.79Å; M239-Y289 HydrophobicContact CB-CE2 4.28Å; M239-Y289 HydrophobicContact CB-CG 3.69Å; M239-Y289 HydrophobicContact CG-CD1 4.25Å; M239-Y289 HydrophobicContact CG-CD2 3.85Å; M239-Y289 HydrophobicContact CG-CE1 4.46Å; M239-Y289 HydrophobicContact CG-CE2 4.06Å; M239-Y289 HydrophobicContact CG-CG 3.93Å; F286-Y289 HydrophobicContact CD2-CD2 4.21Å; F286-Y289 PolarHBondContact O-N 3.03Å; Q287-Y289 VanDerWaalsContact C-N 3.31Å; Q287-Y289 PolarHBondContact O-N 3.14Å; Y289-R292 WeakPolarHBondContact O-CB 3.33Å; Y289-R292 PolarHBondContact O-N 3.45Å; Y289-R292 VanDerWaalsContact O-N 3.1Å; Y289-F293 PolarHBondContact O-N 3.28Å
290	L	93	Very high	93.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-50	-48.1	-171.7	-179.5	78.1	0	0	0	114.3	A279 F286 R292 F293 V294 F320 V324 Y330	A279-L290 HydrophobicContact CB-CD1 4.16Å; F286-L290 HydrophobicContact CD1-CB 4.11Å; F286-L290 HydrophobicContact CD1-CD1 3.92Å; F286-L290 HydrophobicContact CE1-CB 4.11Å; F286-L290 HydrophobicContact CE1-CD1 3.51Å; F286-L290 HydrophobicContact CE1-CG 4.45Å; F286-L290 PolarHBondContact O-N 3.16Å; L290-R292 PolarHBondContact O-N 3.13Å; L290-R292 VanDerWaalsContact O-N 3.15Å; L290-F293 PolarHBondContact O-N 3.23Å; L290-V294 HydrophobicContact CD1-CG2 4.02Å; L290-V294 HydrophobicContact CG-CG2 3.93Å; L290-V294 WeakPolarHBondContact O-CG2 3.36Å; L290-V294 PolarHBondContact O-N 3.34Å; L290-F320 HydrophobicContact CD1-CE2 4.06Å; L290-F320 HydrophobicContact CD1-CZ 3.66Å; L290-V324 HydrophobicContact CD1-CG1 4.29Å; L290-V324 HydrophobicContact CD1-CG2 3.74Å; L290-V324 HydrophobicContact CD2-CG1 3.98Å; L290-Y330 HydrophobicContact CD2-CD1 3.5Å; L290-Y330 HydrophobicContact CD2-CD2 3.46Å; L290-Y330 VanDerWaalsContact CD2-CD2 3.46Å; L290-Y330 HydrophobicContact CD2-CE1 3.22Å; L290-Y330 HydrophobicContact CD2-CE2 3.19Å; L290-Y330 HydrophobicContact CD2-CG 3.63Å
291	P	92.4	Very high	93.7	Very high	64 Å²	64	52.4 Å²	52.4	42%	0.416	25%	0.247	S	C	.	.	H	α-helix	trans	-58.3	-34	-177	-26.2	35.5	0	0	0	113.6	Q287 T295	Q287-P291 WeakPolarHBondContact O-CD 3.4Å; P291-T295 WeakPolarHBondContact O-CB 3.46Å; P291-T295 PolarHBondContact O-N 3.33Å; P291-T295 PolarHBondContact O-OG1 3.18Å
292	R	94.1	Very high	93.6	Very high	112 Å²	112	50.9 Å²	50.9	42%	0.423	25%	0.246	S	C	.	.	H	α-helix	trans	-70.1	-43.2	176.9	-68.6	179.4	61.1	-170.7	-3.6	111.2	N240 H243 Y289 L290 T295 A296	N240-R292 PolarHBondContact OD1-NH1 3.41Å; H243-R292 PolarHBondContact ND1-NH2 3.36Å; Y289-R292 WeakPolarHBondContact O-CB 3.33Å; Y289-R292 PolarHBondContact O-N 3.45Å; Y289-R292 VanDerWaalsContact O-N 3.1Å; L290-R292 PolarHBondContact O-N 3.13Å; L290-R292 VanDerWaalsContact O-N 3.15Å; R292-T295 PolarHBondContact O-N 2.88Å; R292-A296 WeakPolarHBondContact O-CB 3.35Å; R292-A296 PolarHBondContact O-N 3.47Å
293	F	96.4	Very high	93.4	Very high	3 Å²	3	55.6 Å²	55.6	1%	0.013	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-43.4	174.7	-81.1	-85.4	0	0	0	112.1	M239 F242 H243 L246 I271 A275 F286 Y289 L290 T295 A296 I297 F320	M239-F293 HydrophobicContact CB-CE2 4.18Å; M239-F293 HydrophobicContact SD-CE2 4.25Å; M239-F293 HydrophobicContact SD-CZ 4.25Å; F242-F293 HydrophobicContact CB-CE1 4.35Å; F242-F293 HydrophobicContact CB-CZ 4.07Å; H243-F293 HydrophobicContact CB-CE1 4.48Å; H243-F293 HydrophobicContact CB-CE2 4.33Å; H243-F293 HydrophobicContact CB-CZ 4.05Å; L246-F293 HydrophobicContact CD2-CD1 3.92Å; L246-F293 HydrophobicContact CD2-CE1 4.23Å; I271-F293 HydrophobicContact CG2-CE1 4.04Å; A275-F293 HydrophobicContact CB-CD1 3.85Å; A275-F293 HydrophobicContact CB-CE1 4.16Å; A275-F293 HydrophobicContact CB-CG 4.37Å; F286-F293 AromaticContact CE2-CD2 3.87Å; F286-F293 HydrophobicContact CE2-CD2 3.87Å; F286-F293 AromaticContact CE2-CE2 3.91Å; F286-F293 HydrophobicContact CE2-CE2 3.91Å; F286-F293 HydrophobicContact CZ-CB 4.28Å; F286-F293 AromaticContact CZ-CD2 3.61Å; F286-F293 HydrophobicContact CZ-CD2 3.61Å; F286-F293 HydrophobicContact CZ-CE2 4.08Å; F286-F293 AromaticContact CZ-CG 3.94Å; F286-F293 HydrophobicContact CZ-CG 3.94Å; Y289-F293 PolarHBondContact O-N 3.28Å; L290-F293 PolarHBondContact O-N 3.23Å; F293-T295 VanDerWaalsContact C-N 3.33Å; F293-T295 PolarHBondContact O-N 3.32Å; F293-A296 PolarHBondContact O-N 3.3Å; F293-I297 VanDerWaalsContact O-CB 3.29Å; F293-I297 WeakPolarHBondContact O-CB 3.28Å; F293-I297 VanDerWaalsContact O-CG1 3.26Å; F293-I297 WeakPolarHBondContact O-CG1 3.44Å; F293-I297 PolarHBondContact O-N 2.73Å; F293-F320 HydrophobicContact CB-CE2 4.46Å; F293-F320 HydrophobicContact CB-CZ 3.88Å
294	V	92.9	Very high	93.4	Very high	19 Å²	19	55.5 Å²	55.5	12%	0.115	28%	0.276	C	S	.	.	H	α-helix	trans	-56.8	-47.8	174.1	172.8	0	0	0	0	110.8	L290 W298 F320 L321 V324 L333	L290-V294 HydrophobicContact CD1-CG2 4.02Å; L290-V294 HydrophobicContact CG-CG2 3.93Å; L290-V294 WeakPolarHBondContact O-CG2 3.36Å; L290-V294 PolarHBondContact O-N 3.34Å; V294-W298 WeakPolarHBondContact O-CB 3.45Å; V294-W298 PolarHBondContact O-N 2.89Å; V294-F320 HydrophobicContact CB-CE1 4.46Å; V294-F320 HydrophobicContact CG2-CE1 3.8Å; V294-F320 HydrophobicContact CG2-CZ 3.97Å; V294-L321 HydrophobicContact CG1-CD2 4.26Å; V294-V324 HydrophobicContact CG2-CG1 4.14Å; V294-L333 HydrophobicContact CG2-CD1 4.28Å
295	T	92.4	Very high	93.2	Very high	83 Å²	83	49 Å²	49	51%	0.509	25%	0.254	S	S	.	.	H	α-helix	trans	-64.2	-43.3	178.6	-54.6	0	0	0	0	112.2	P291 R292 F293 N299	P291-T295 WeakPolarHBondContact O-CB 3.46Å; P291-T295 PolarHBondContact O-N 3.33Å; P291-T295 PolarHBondContact O-OG1 3.18Å; R292-T295 PolarHBondContact O-N 2.88Å; F293-T295 VanDerWaalsContact C-N 3.33Å; F293-T295 PolarHBondContact O-N 3.32Å; T295-N299 WeakPolarHBondContact O-CB 3.41Å; T295-N299 VanDerWaalsContact O-CG 3.29Å; T295-N299 PolarHBondContact O-N 2.82Å; T295-N299 PolarHBondContact O-ND2 2.78Å
296	A	95.8	Very high	92.9	Very high	11 Å²	11	49.9 Å²	49.9	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-45.5	-179.8	0	0	0	0	0	112.1	L246 T247 R292 F293 N299 L300	L246-A296 HydrophobicContact CD2-CB 3.94Å; T247-A296 HydrophobicContact CG2-CB 3.85Å; R292-A296 WeakPolarHBondContact O-CB 3.35Å; R292-A296 PolarHBondContact O-N 3.47Å; F293-A296 PolarHBondContact O-N 3.3Å; A296-N299 PolarHBondContact O-N 2.55Å; A296-L300 VanDerWaalsContact O-CB 3.32Å; A296-L300 WeakPolarHBondContact O-CB 3.44Å; A296-L300 PolarHBondContact O-N 2.84Å
297	I	95.6	Very high	92.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-69.7	-36.3	179.2	-67	176	0	0	0	110.6	L246 F293 L300 L301 A317 F320 L321	L246-I297 HydrophobicContact CD2-CD1 4.28Å; L246-I297 HydrophobicContact CD2-CG1 3.72Å; F293-I297 VanDerWaalsContact O-CB 3.29Å; F293-I297 WeakPolarHBondContact O-CB 3.28Å; F293-I297 VanDerWaalsContact O-CG1 3.26Å; F293-I297 WeakPolarHBondContact O-CG1 3.44Å; F293-I297 PolarHBondContact O-N 2.73Å; I297-L300 WeakPolarHBondContact O-CB 3.46Å; I297-L300 PolarHBondContact O-N 3.05Å; I297-L301 HydrophobicContact CG2-CD1 4.23Å; I297-L301 VanDerWaalsContact O-CG 3.31Å; I297-L301 WeakPolarHBondContact O-CG 3.41Å; I297-L301 PolarHBondContact O-N 3.41Å; I297-A317 HydrophobicContact CG2-CB 3.64Å; I297-A317 WeakPolarHBondContact CG2-O 3.35Å; I297-F320 HydrophobicContact CB-CD1 4.1Å; I297-F320 HydrophobicContact CB-CE1 4.35Å; I297-F320 HydrophobicContact CD1-CB 4.06Å; I297-F320 HydrophobicContact CD1-CD1 3.28Å; I297-F320 HydrophobicContact CD1-CD2 3.94Å; I297-F320 HydrophobicContact CD1-CE1 3.59Å; I297-F320 HydrophobicContact CD1-CE2 4.2Å; I297-F320 HydrophobicContact CD1-CG 3.46Å; I297-F320 VanDerWaalsContact CD1-CG 3.46Å; I297-F320 HydrophobicContact CD1-CZ 4.03Å; I297-F320 HydrophobicContact CG1-CD1 4.23Å; I297-F320 HydrophobicContact CG1-CE1 4.44Å; I297-F320 HydrophobicContact CG2-CD1 3.92Å; I297-L321 HydrophobicContact CG2-CG 4.31Å
298	W	91.7	Very high	92.4	Very high	55 Å²	55	50.7 Å²	50.7	21%	0.208	27%	0.266	C	S	.	.	H	α-helix	trans	-59.4	-52.6	171	175.3	-100.5	0	0	0	112.2	V294 L300 L301 V302 L321 S342 I343 V347	V294-W298 WeakPolarHBondContact O-CB 3.45Å; V294-W298 PolarHBondContact O-N 2.89Å; W298-L300 VanDerWaalsContact C-N 3.26Å; W298-L300 PolarHBondContact O-N 2.94Å; W298-L301 PolarHBondContact O-N 3.13Å; W298-V302 HydrophobicContact CD2-CG2 4.43Å; W298-V302 HydrophobicContact CZ2-CG2 4.22Å; W298-V302 WeakPolarHBondContact O-CG2 3.3Å; W298-V302 PolarHBondContact O-N 2.97Å; W298-L321 HydrophobicContact CE3-CD1 4.1Å; W298-S342 WeakPolarHBondContact CZ2-OG 3.31Å; W298-I343 HydrophobicContact CE3-CG1 4.26Å; W298-I343 HydrophobicContact CH2-CB 4.09Å; W298-I343 HydrophobicContact CH2-CG1 3.41Å; W298-I343 VanDerWaalsContact CH2-CG1 3.41Å; W298-I343 HydrophobicContact CZ3-CB 4.04Å; W298-I343 HydrophobicContact CZ3-CD1 4.42Å; W298-I343 HydrophobicContact CZ3-CG1 3.23Å; W298-I343 HydrophobicContact CZ3-CG2 4.48Å; W298-V347 HydrophobicContact CE3-CG2 4.2Å; W298-V347 HydrophobicContact CH2-CG2 3.94Å; W298-V347 HydrophobicContact CZ3-CG2 3.5Å
299	N	92.5	Very high	92.2	Very high	85 Å²	85	44.1 Å²	44.1	46%	0.455	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-37.2	178.1	-72.6	-24	0	0	0	111.7	T295 A296 V302 T303	T295-N299 WeakPolarHBondContact O-CB 3.41Å; T295-N299 VanDerWaalsContact O-CG 3.29Å; T295-N299 PolarHBondContact O-N 2.82Å; T295-N299 PolarHBondContact O-ND2 2.78Å; A296-N299 PolarHBondContact O-N 2.55Å; N299-V302 PolarHBondContact O-N 2.83Å; N299-T303 WeakPolarHBondContact O-CB 3.43Å; N299-T303 VanDerWaalsContact O-CG2 3.28Å; N299-T303 WeakPolarHBondContact O-CG2 3.47Å; N299-T303 PolarHBondContact O-N 3.39Å; N299-T303 PolarHBondContact O-OG1 3.19Å
300	L	94.6	Very high	92	Very high	17 Å²	17	45.6 Å²	45.6	9%	0.089	25%	0.247	C	C	.	.	H	α-helix	trans	-57.1	-54.4	173	-178	73.4	0	0	0	110.4	L246 K268 A296 I297 W298 V302 T303 T304 L313 A317	L246-L300 HydrophobicContact CD1-CD2 4.33Å; K268-L300 HydrophobicContact CD-CD1 4.23Å; A296-L300 VanDerWaalsContact O-CB 3.32Å; A296-L300 WeakPolarHBondContact O-CB 3.44Å; A296-L300 PolarHBondContact O-N 2.84Å; I297-L300 WeakPolarHBondContact O-CB 3.46Å; I297-L300 PolarHBondContact O-N 3.05Å; W298-L300 VanDerWaalsContact C-N 3.26Å; W298-L300 PolarHBondContact O-N 2.94Å; L300-V302 VanDerWaalsContact C-N 3.27Å; L300-V302 PolarHBondContact O-N 2.8Å; L300-T303 PolarHBondContact O-N 3.05Å; L300-T303 PolarHBondContact O-OG1 3.06Å; L300-T304 WeakPolarHBondContact O-CB 3.12Å; L300-T304 PolarHBondContact O-N 2.93Å; L300-T304 PolarHBondContact O-OG1 3.37Å; L300-L313 HydrophobicContact CD1-CD2 4.17Å; L300-L313 HydrophobicContact CD2-CD1 3.8Å; L300-L313 HydrophobicContact CD2-CD2 4.27Å; L300-L313 HydrophobicContact CD2-CG 4.03Å; L300-A317 HydrophobicContact CD2-CB 4.24Å
301	L	93.6	Very high	91.9	Very high	9 Å²	9	46.9 Å²	46.9	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-33.2	-179.7	-71.6	170.1	0	0	0	114	I297 W298 V314 A317 I318 L321 V347	I297-L301 HydrophobicContact CG2-CD1 4.23Å; I297-L301 VanDerWaalsContact O-CG 3.31Å; I297-L301 WeakPolarHBondContact O-CG 3.41Å; I297-L301 PolarHBondContact O-N 3.41Å; W298-L301 PolarHBondContact O-N 3.13Å; L301-V314 HydrophobicContact CD2-CB 4.35Å; L301-V314 HydrophobicContact CD2-CG1 3.87Å; L301-V314 HydrophobicContact CD2-CG2 4.48Å; L301-A317 HydrophobicContact CD1-CB 4.24Å; L301-A317 HydrophobicContact CD2-CB 3.63Å; L301-A317 HydrophobicContact CG-CB 3.89Å; L301-I318 HydrophobicContact CD1-CG1 4.01Å; L301-I318 HydrophobicContact CD2-CD1 4.36Å; L301-I318 HydrophobicContact CD2-CG1 3.63Å; L301-I318 HydrophobicContact CG-CG1 4.49Å; L301-L321 HydrophobicContact CD1-CD1 3.39Å; L301-L321 HydrophobicContact CD1-CG 4.16Å; L301-V347 HydrophobicContact CB-CG1 4.46Å; L301-V347 HydrophobicContact CB-CG2 4.2Å; L301-V347 HydrophobicContact CD1-CG1 4.07Å
302	V	90.9	Very high	91.9	Very high	63 Å²	63	46.8 Å²	46.8	38%	0.382	25%	0.25	S	C	.	.	H	α-helix	trans	-77.8	-25.2	178	174.2	0	0	0	0	112.5	W298 N299 L300	W298-V302 HydrophobicContact CD2-CG2 4.43Å; W298-V302 HydrophobicContact CZ2-CG2 4.22Å; W298-V302 WeakPolarHBondContact O-CG2 3.3Å; W298-V302 PolarHBondContact O-N 2.97Å; N299-V302 PolarHBondContact O-N 2.83Å; L300-V302 VanDerWaalsContact C-N 3.27Å; L300-V302 PolarHBondContact O-N 2.8Å
303	T	89.9	Confident	91.9	Very high	112 Å²	112	41.7 Å²	41.7	69%	0.687	23%	0.231	S	C	*	.	H	α-helix	trans	-102.1	-17.8	-175.2	54.7	0	0	0	0	113.8	N299 L300	N299-T303 WeakPolarHBondContact O-CB 3.43Å; N299-T303 VanDerWaalsContact O-CG2 3.28Å; N299-T303 WeakPolarHBondContact O-CG2 3.47Å; N299-T303 PolarHBondContact O-N 3.39Å; N299-T303 PolarHBondContact O-OG1 3.19Å; L300-T303 PolarHBondContact O-N 3.05Å; L300-T303 PolarHBondContact O-OG1 3.06Å
304	T	91.5	Very high	91.8	Very high	26 Å²	26	41.7 Å²	41.7	16%	0.16	23%	0.231	C	C	.	.			trans	-80	133.8	177.3	-60.4	0	0	0	0	111.1	L300 Y310 V314	L300-T304 WeakPolarHBondContact O-CB 3.12Å; L300-T304 PolarHBondContact O-N 2.93Å; L300-T304 PolarHBondContact O-OG1 3.37Å; T304-Y310 VanDerWaalsContact CG2-CB 3.43Å; T304-Y310 HydrophobicContact CG2-CD1 3.86Å; T304-Y310 HydrophobicContact CG2-CD2 3.74Å; T304-Y310 HydrophobicContact CG2-CE2 4.46Å; T304-Y310 HydrophobicContact CG2-CG 3.4Å; T304-V314 HydrophobicContact CG2-CG2 3.6Å
305	G	88.1	Confident	91.7	Very high	29 Å²	29	40.9 Å²	40.9	30%	0.299	23%	0.226	S	C	.	.			trans	-77.7	-168.7	-178.1	0	0	0	0	0	114.4	E307 R382	G305-E307 WeakPolarHBondContact CA-OE2 3.49Å; G305-R382 VanDerWaalsContact O-CZ 3.31Å; G305-R382 PolarHBondContact O-NH1 3.39Å; G305-R382 PolarHBondContact O-NH2 2.91Å
306	Q	87.8	Confident	91.8	Very high	76 Å²	76	37.1 Å²	37.1	36%	0.355	20%	0.203	S	C	.	.	S	Bend	trans	-95.5	0.9	-175	-69	-65.8	-16.7	0	0	114.1	P350 R355	Q306-P350 PolarHBondContact NE2-O 3.23Å; Q306-R355 PolarHBondContact O-NH1 3.4Å
307	E	89.1	Confident	91.7	Very high	70 Å²	70	36.6 Å²	36.6	33%	0.327	20%	0.199	S	C	.	.			trans	-63.3	147.8	-179.4	-54	90	151	0	0	111.8	G305 K309 Y310 R382	G305-E307 WeakPolarHBondContact CA-OE2 3.49Å; E307-K309 VanDerWaalsContact C-N 3.31Å; E307-K309 HydrophobicContact CB-CG 4.04Å; E307-K309 PolarHBondContact O-N 3.27Å; E307-Y310 HydrophobicContact CB-CD2 3.98Å; E307-Y310 HydrophobicContact CB-CE2 4.25Å; E307-Y310 HydrophobicContact CG-CE2 4.49Å; E307-Y310 PolarHBondContact O-N 3.15Å; E307-Y310 VanDerWaalsContact O-N 3.16Å; E307-Y310 WeakPolarHBondContact OE2-CD2 3.33Å; E307-Y310 WeakPolarHBondContact OE2-CE2 3.21Å; E307-R382 PolarHBondContact O-NH2 2.76Å
308	V	87.8	Confident	91.7	Very high	58 Å²	58	36.6 Å²	36.6	35%	0.352	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-64.4	-34.8	-174	175.2	0	0	0	0	111.8	E258 Y310 D311 A357	E258-V308 PolarHBondContact O-N 3.48Å; V308-Y310 PolarHBondContact O-N 3.4Å; V308-D311 VanDerWaalsContact O-CB 3.3Å; V308-D311 WeakPolarHBondContact O-CB 3.49Å; V308-D311 PolarHBondContact O-N 2.8Å; V308-A357 HydrophobicContact CG2-CB 3.71Å
309	K	90	Very high	91.6	Very high	21 Å²	21	37.4 Å²	37.4	9%	0.091	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-54.5	-22.6	175.6	61.8	161.4	154	-141.1	0	114.5	T255 D257 E258 E259 E260 A261 E307	T255-K309 HydrophobicContact CG2-CD 4.24Å; T255-K309 PolarHBondContact O-NZ 3.48Å; D257-K309 VanDerWaalsContact O-CD 3.25Å; D257-K309 WeakPolarHBondContact O-CD 3.45Å; D257-K309 WeakPolarHBondContact O-CE 3.18Å; D257-K309 PolarHBondContact O-NZ 2.77Å; E258-K309 WeakPolarHBondContact O-CB 3.36Å; E258-K309 PolarHBondContact O-N 3.37Å; E259-K309 WeakPolarHBondContact O-CA 3.5Å; E259-K309 PolarHBondContact O-N 3.16Å; E260-K309 WeakPolarHBondContact O-CB 3.39Å; A261-K309 VanDerWaalsContact CB-O 3.31Å; A261-K309 WeakPolarHBondContact CB-O 3.48Å; E307-K309 VanDerWaalsContact C-N 3.31Å; E307-K309 HydrophobicContact CB-CG 4.04Å; E307-K309 PolarHBondContact O-N 3.27Å
310	Y	92.4	Very high	91.7	Very high	45 Å²	45	33.3 Å²	33.3	18%	0.176	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-96.2	-5.6	-179.5	-61.4	-51.1	0	0	0	113.4	E265 T304 E307 V308 L312 L313 V314	E265-Y310 HydrophobicContact CG-CD1 3.75Å; E265-Y310 HydrophobicContact CG-CE1 3.68Å; T304-Y310 VanDerWaalsContact CG2-CB 3.43Å; T304-Y310 HydrophobicContact CG2-CD1 3.86Å; T304-Y310 HydrophobicContact CG2-CD2 3.74Å; T304-Y310 HydrophobicContact CG2-CE2 4.46Å; T304-Y310 HydrophobicContact CG2-CG 3.4Å; E307-Y310 HydrophobicContact CB-CD2 3.98Å; E307-Y310 HydrophobicContact CB-CE2 4.25Å; E307-Y310 HydrophobicContact CG-CE2 4.49Å; E307-Y310 PolarHBondContact O-N 3.15Å; E307-Y310 VanDerWaalsContact O-N 3.16Å; E307-Y310 WeakPolarHBondContact OE2-CD2 3.33Å; E307-Y310 WeakPolarHBondContact OE2-CE2 3.21Å; V308-Y310 PolarHBondContact O-N 3.4Å; Y310-L312 PolarHBondContact O-N 3.31Å; Y310-L313 WeakPolarHBondContact O-CB 3.39Å; Y310-L313 PolarHBondContact O-N 3.32Å; Y310-L313 VanDerWaalsContact O-N 3.11Å; Y310-V314 WeakPolarHBondContact O-CB 3.42Å; Y310-V314 WeakPolarHBondContact O-CG2 3.39Å; Y310-V314 PolarHBondContact O-N 2.75Å
311	D	91.3	Very high	91.6	Very high	26 Å²	26	32.6 Å²	32.6	14%	0.139	18%	0.179	C	C	.	.	H	α-helix	trans	-56.6	-51.3	-173.6	-77.8	11.5	0	0	0	112.2	V308 L313 V314 S315 R355 R382	V308-D311 VanDerWaalsContact O-CB 3.3Å; V308-D311 WeakPolarHBondContact O-CB 3.49Å; V308-D311 PolarHBondContact O-N 2.8Å; D311-L313 VanDerWaalsContact C-N 3.28Å; D311-L313 PolarHBondContact O-N 3.38Å; D311-V314 PolarHBondContact O-N 3.07Å; D311-S315 VanDerWaalsContact O-CB 3.27Å; D311-S315 WeakPolarHBondContact O-CB 3.38Å; D311-S315 PolarHBondContact O-N 3.01Å; D311-S315 PolarHBondContact O-OG 3.23Å; D311-R355 IonicContact OD1-CZ 3.27Å; D311-R355 IonicContact OD1-NH1 3.61Å; D311-R355 PolarHBondContact OD1-NH1 3.35Å; D311-R355 IonicContact OD1-NH2 3.63Å; D311-R355 IonicContact OD2-CZ 3.7Å; D311-R355 IonicContact OD2-NH1 3.64Å; D311-R355 PolarHBondContact OD2-NH1 2.99Å; D311-R355 IonicContact OD2-NH2 2.99Å; D311-R355 PolarHBondContact OD2-NH2 3.48Å; D311-R382 WeakPolarHBondContact OD1-CD 3.28Å; D311-R382 IonicContact OD1-CZ 2.82Å; D311-R382 IonicContact OD1-NE 3.16Å; D311-R382 PolarHBondContact OD1-NE 2.93Å; D311-R382 IonicContact OD1-NH2 3.7Å; D311-R382 PolarHBondContact OD1-NH2 3.15Å
312	L	90.9	Very high	91.5	Very high	62 Å²	62	32.4 Å²	32.4	33%	0.325	18%	0.179	S	C	.	.	H	α-helix	trans	-58.9	-40.7	178.2	-178.6	66.5	0	0	0	112	L266 S269 Y310 N316 D380	L266-L312 HydrophobicContact CD2-CD2 4.04Å; S269-L312 WeakPolarHBondContact OG-CG 3.33Å; Y310-L312 PolarHBondContact O-N 3.31Å; L312-N316 VanDerWaalsContact O-CG 3.24Å; L312-N316 PolarHBondContact O-N 3.42Å; L312-N316 VanDerWaalsContact O-N 3.13Å; L312-N316 PolarHBondContact O-OD1 3.5Å; L312-D380 HydrophobicContact CD1-CB 4.29Å
313	L	94.1	Very high	91.4	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-66.9	-48.6	179.3	177.1	58.7	0	0	0	111.6	E265 K268 S269 L300 Y310 D311 A317	E265-L313 HydrophobicContact CB-CD2 4.37Å; E265-L313 HydrophobicContact CG-CD2 4.33Å; K268-L313 HydrophobicContact CB-CD1 3.48Å; K268-L313 VanDerWaalsContact CB-CD1 3.48Å; K268-L313 HydrophobicContact CB-CD2 4.3Å; K268-L313 HydrophobicContact CD-CD2 4.46Å; S269-L313 VanDerWaalsContact N-CD1 3.34Å; L300-L313 HydrophobicContact CD1-CD2 4.17Å; L300-L313 HydrophobicContact CD2-CD1 3.8Å; L300-L313 HydrophobicContact CD2-CD2 4.27Å; L300-L313 HydrophobicContact CD2-CG 4.03Å; Y310-L313 WeakPolarHBondContact O-CB 3.39Å; Y310-L313 PolarHBondContact O-N 3.32Å; Y310-L313 VanDerWaalsContact O-N 3.11Å; D311-L313 VanDerWaalsContact C-N 3.28Å; D311-L313 PolarHBondContact O-N 3.38Å; L313-A317 WeakPolarHBondContact O-CB 3.4Å; L313-A317 PolarHBondContact O-N 2.74Å
314	V	94.1	Very high	91.5	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.018	13%	0.131	C	C	.	.	H	α-helix	trans	-65	-42.7	-179.6	170.8	0	0	0	0	110.3	L301 T304 Y310 D311 A317 I318 R382	L301-V314 HydrophobicContact CD2-CB 4.35Å; L301-V314 HydrophobicContact CD2-CG1 3.87Å; L301-V314 HydrophobicContact CD2-CG2 4.48Å; T304-V314 HydrophobicContact CG2-CG2 3.6Å; Y310-V314 WeakPolarHBondContact O-CB 3.42Å; Y310-V314 WeakPolarHBondContact O-CG2 3.39Å; Y310-V314 PolarHBondContact O-N 2.75Å; D311-V314 PolarHBondContact O-N 3.07Å; V314-A317 PolarHBondContact O-N 3.47Å; V314-I318 HydrophobicContact CG1-CD1 3.67Å; V314-I318 HydrophobicContact CG1-CG1 4.27Å; V314-I318 WeakPolarHBondContact O-CB 3.17Å; V314-I318 VanDerWaalsContact O-CG1 3.25Å; V314-I318 WeakPolarHBondContact O-CG1 3.4Å; V314-I318 PolarHBondContact O-N 2.9Å; V314-R382 HydrophobicContact CB-CG 4.3Å; V314-R382 HydrophobicContact CG1-CG 3.93Å
315	S	92.2	Very high	91.4	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-50.6	177	-65	0	0	0	0	111.7	D311 A317 I318 Q319 D380 T381 R382	D311-S315 VanDerWaalsContact O-CB 3.27Å; D311-S315 WeakPolarHBondContact O-CB 3.38Å; D311-S315 PolarHBondContact O-N 3.01Å; D311-S315 PolarHBondContact O-OG 3.23Å; S315-A317 VanDerWaalsContact C-N 3.34Å; S315-A317 PolarHBondContact O-N 3.3Å; S315-I318 PolarHBondContact O-N 3.41Å; S315-Q319 WeakPolarHBondContact O-CB 3.3Å; S315-Q319 PolarHBondContact O-N 2.79Å; S315-D380 WeakPolarHBondContact CB-O 3.3Å; S315-D380 PolarHBondContact OG-O 3.46Å; S315-T381 PolarHBondContact OG-O 2.76Å; S315-R382 PolarHBondContact OG-N 2.99Å
316	N	93.1	Very high	91.3	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-68.4	-34.8	-179.8	-62.9	11.5	0	0	0	111.8	S269 C272 D273 L312 Q319 F320	S269-N316 PolarHBondContact OG-ND2 3.08Å; C272-N316 HydrophobicContact CB-CB 3.9Å; D273-N316 VanDerWaalsContact CG-ND2 3.34Å; D273-N316 WeakPolarHBondContact OD1-CB 3.33Å; D273-N316 PolarHBondContact OD1-ND2 2.91Å; D273-N316 PolarHBondContact OD2-ND2 3.13Å; L312-N316 VanDerWaalsContact O-CG 3.24Å; L312-N316 PolarHBondContact O-N 3.42Å; L312-N316 VanDerWaalsContact O-N 3.13Å; L312-N316 PolarHBondContact O-OD1 3.5Å; N316-Q319 PolarHBondContact O-N 2.8Å; N316-F320 PolarHBondContact O-N 3.38Å
317	A	95.5	Very high	91.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.2	-43.5	174.4	0	0	0	0	0	112.3	I297 L300 L301 L313 V314 S315 F320 L321	I297-A317 HydrophobicContact CG2-CB 3.64Å; I297-A317 WeakPolarHBondContact CG2-O 3.35Å; L300-A317 HydrophobicContact CD2-CB 4.24Å; L301-A317 HydrophobicContact CD1-CB 4.24Å; L301-A317 HydrophobicContact CD2-CB 3.63Å; L301-A317 HydrophobicContact CG-CB 3.89Å; L313-A317 WeakPolarHBondContact O-CB 3.4Å; L313-A317 PolarHBondContact O-N 2.74Å; V314-A317 PolarHBondContact O-N 3.47Å; S315-A317 VanDerWaalsContact C-N 3.34Å; S315-A317 PolarHBondContact O-N 3.3Å; A317-F320 WeakPolarHBondContact O-CB 3.46Å; A317-F320 PolarHBondContact O-N 3.19Å; A317-L321 PolarHBondContact O-N 3.49Å
318	I	93.9	Very high	91.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.1	-42.4	173.9	-68.7	170.6	0	0	0	110.1	L301 V314 S315 F320 L321 A322 V347 N351 A385 L389	L301-I318 HydrophobicContact CD1-CG1 4.01Å; L301-I318 HydrophobicContact CD2-CD1 4.36Å; L301-I318 HydrophobicContact CD2-CG1 3.63Å; L301-I318 HydrophobicContact CG-CG1 4.49Å; V314-I318 HydrophobicContact CG1-CD1 3.67Å; V314-I318 HydrophobicContact CG1-CG1 4.27Å; V314-I318 WeakPolarHBondContact O-CB 3.17Å; V314-I318 VanDerWaalsContact O-CG1 3.25Å; V314-I318 WeakPolarHBondContact O-CG1 3.4Å; V314-I318 PolarHBondContact O-N 2.9Å; S315-I318 PolarHBondContact O-N 3.41Å; I318-F320 VanDerWaalsContact C-N 3.29Å; I318-F320 PolarHBondContact O-N 2.86Å; I318-L321 CarbonylContact O-C 3.52Å; I318-L321 PolarHBondContact O-N 2.9Å; I318-A322 WeakPolarHBondContact O-CB 3.45Å; I318-A322 PolarHBondContact O-N 3.03Å; I318-V347 HydrophobicContact CD1-CG1 4.31Å; I318-V347 HydrophobicContact CG1-CG1 4.05Å; I318-N351 HydrophobicContact CD1-CB 4.2Å; I318-A385 HydrophobicContact CB-CB 3.76Å; I318-A385 HydrophobicContact CD1-CB 4.26Å; I318-A385 HydrophobicContact CG2-CB 3.67Å; I318-A385 WeakPolarHBondContact CG2-O 3.49Å; I318-L389 HydrophobicContact CG2-CB 3.75Å; I318-L389 HydrophobicContact CG2-CD2 4Å; I318-L389 HydrophobicContact CG2-CG 4.46Å
319	Q	91.1	Very high	91.1	Very high	72 Å²	72	30.4 Å²	30.4	34%	0.336	15%	0.148	S	C	.	.	H	α-helix	trans	-61.8	-37.7	178.4	-168.7	-178.5	21.9	0	0	111.8	S315 N316 A322 S323	S315-Q319 WeakPolarHBondContact O-CB 3.3Å; S315-Q319 PolarHBondContact O-N 2.79Å; N316-Q319 PolarHBondContact O-N 2.8Å; Q319-A322 PolarHBondContact O-N 2.97Å; Q319-S323 WeakPolarHBondContact O-CB 3.21Å; Q319-S323 PolarHBondContact O-N 3.14Å; Q319-S323 PolarHBondContact O-OG 3.17Å
320	F	94.3	Very high	91	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-56.6	-54.4	168.9	169.4	-91.9	0	0	0	110.7	A275 A276 A279 F286 L290 F293 V294 I297 N316 A317 I318 A322 S323 V324	A275-F320 HydrophobicContact CB-CD2 3.88Å; A275-F320 HydrophobicContact CB-CE2 3.78Å; A276-F320 HydrophobicContact CB-CB 4.25Å; A276-F320 HydrophobicContact CB-CD2 4.19Å; A279-F320 HydrophobicContact CB-CE2 4.26Å; F286-F320 HydrophobicContact CE1-CE2 4.27Å; L290-F320 HydrophobicContact CD1-CE2 4.06Å; L290-F320 HydrophobicContact CD1-CZ 3.66Å; F293-F320 HydrophobicContact CB-CE2 4.46Å; F293-F320 HydrophobicContact CB-CZ 3.88Å; V294-F320 HydrophobicContact CB-CE1 4.46Å; V294-F320 HydrophobicContact CG2-CE1 3.8Å; V294-F320 HydrophobicContact CG2-CZ 3.97Å; I297-F320 HydrophobicContact CB-CD1 4.1Å; I297-F320 HydrophobicContact CB-CE1 4.35Å; I297-F320 HydrophobicContact CD1-CB 4.06Å; I297-F320 HydrophobicContact CD1-CD1 3.28Å; I297-F320 HydrophobicContact CD1-CD2 3.94Å; I297-F320 HydrophobicContact CD1-CE1 3.59Å; I297-F320 HydrophobicContact CD1-CE2 4.2Å; I297-F320 HydrophobicContact CD1-CG 3.46Å; I297-F320 VanDerWaalsContact CD1-CG 3.46Å; I297-F320 HydrophobicContact CD1-CZ 4.03Å; I297-F320 HydrophobicContact CG1-CD1 4.23Å; I297-F320 HydrophobicContact CG1-CE1 4.44Å; I297-F320 HydrophobicContact CG2-CD1 3.92Å; N316-F320 PolarHBondContact O-N 3.38Å; A317-F320 WeakPolarHBondContact O-CB 3.46Å; A317-F320 PolarHBondContact O-N 3.19Å; I318-F320 VanDerWaalsContact C-N 3.29Å; I318-F320 PolarHBondContact O-N 2.86Å; F320-A322 VanDerWaalsContact C-N 3.3Å; F320-A322 PolarHBondContact O-N 3.25Å; F320-S323 PolarHBondContact O-N 3.16Å; F320-S323 VanDerWaalsContact O-N 3.11Å; F320-S323 PolarHBondContact O-OG 3.48Å; F320-V324 HydrophobicContact CD1-CG2 4.33Å; F320-V324 HydrophobicContact CD2-CG2 4.35Å; F320-V324 HydrophobicContact CE1-CG2 3.91Å; F320-V324 HydrophobicContact CE2-CG2 3.94Å; F320-V324 HydrophobicContact CZ-CG2 3.72Å; F320-V324 WeakPolarHBondContact O-CG2 3.43Å; F320-V324 PolarHBondContact O-N 3.19Å
321	L	93.1	Very high	90.8	Very high	2 Å²	2	31 Å²	31	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-40	179	-69.2	-174.5	0	0	0	112.5	V294 I297 W298 L301 A317 I318 S323 V324 C325 L389	V294-L321 HydrophobicContact CG1-CD2 4.26Å; I297-L321 HydrophobicContact CG2-CG 4.31Å; W298-L321 HydrophobicContact CE3-CD1 4.1Å; L301-L321 HydrophobicContact CD1-CD1 3.39Å; L301-L321 HydrophobicContact CD1-CG 4.16Å; A317-L321 PolarHBondContact O-N 3.49Å; I318-L321 CarbonylContact O-C 3.52Å; I318-L321 PolarHBondContact O-N 2.9Å; L321-S323 VanDerWaalsContact C-N 3.33Å; L321-S323 PolarHBondContact O-N 3.11Å; L321-V324 PolarHBondContact O-N 3.39Å; L321-C325 WeakPolarHBondContact O-CB 3.32Å; L321-C325 PolarHBondContact O-N 3.3Å; L321-C325 PolarHBondContact O-SG 3.19Å; L321-L389 HydrophobicContact CB-CD1 4.07Å
322	A	90.3	Very high	90.7	Very high	5 Å²	5	34.8 Å²	34.8	4%	0.041	17%	0.172	C	C	.	.	H	α-helix	trans	-58.3	-46.9	175.3	0	0	0	0	0	110.6	I318 Q319 F320 V324 C325 E326 L389	I318-A322 WeakPolarHBondContact O-CB 3.45Å; I318-A322 PolarHBondContact O-N 3.03Å; Q319-A322 PolarHBondContact O-N 2.97Å; F320-A322 VanDerWaalsContact C-N 3.3Å; F320-A322 PolarHBondContact O-N 3.25Å; A322-V324 VanDerWaalsContact C-N 3.31Å; A322-V324 PolarHBondContact O-N 2.93Å; A322-C325 PolarHBondContact O-N 3.49Å; A322-C325 PolarHBondContact O-SG 3.2Å; A322-E326 WeakPolarHBondContact O-CG 3.31Å; A322-E326 PolarHBondContact O-N 2.91Å; A322-L389 HydrophobicContact CB-CB 4.28Å; A322-L389 HydrophobicContact CB-CD1 4.34Å
323	S	89.1	Confident	90.4	Very high	9 Å²	9	34.5 Å²	34.5	6%	0.063	17%	0.17	C	C	.	.	H	α-helix	trans	-65.3	-31.7	178.7	75	0	0	0	0	114.1	Q319 F320 L321	Q319-S323 WeakPolarHBondContact O-CB 3.21Å; Q319-S323 PolarHBondContact O-N 3.14Å; Q319-S323 PolarHBondContact O-OG 3.17Å; F320-S323 PolarHBondContact O-N 3.16Å; F320-S323 VanDerWaalsContact O-N 3.11Å; F320-S323 PolarHBondContact O-OG 3.48Å; L321-S323 VanDerWaalsContact C-N 3.33Å; L321-S323 PolarHBondContact O-N 3.11Å
324	V	91.6	Very high	90.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-77.2	-42.8	178.1	-179.2	0	0	0	0	110.8	A279 L290 V294 F320 L321 A322 E326 R327 Y330 F334	A279-V324 HydrophobicContact CB-CG2 4.18Å; L290-V324 HydrophobicContact CD1-CG1 4.29Å; L290-V324 HydrophobicContact CD1-CG2 3.74Å; L290-V324 HydrophobicContact CD2-CG1 3.98Å; V294-V324 HydrophobicContact CG2-CG1 4.14Å; F320-V324 HydrophobicContact CD1-CG2 4.33Å; F320-V324 HydrophobicContact CD2-CG2 4.35Å; F320-V324 HydrophobicContact CE1-CG2 3.91Å; F320-V324 HydrophobicContact CE2-CG2 3.94Å; F320-V324 HydrophobicContact CZ-CG2 3.72Å; F320-V324 WeakPolarHBondContact O-CG2 3.43Å; F320-V324 PolarHBondContact O-N 3.19Å; L321-V324 PolarHBondContact O-N 3.39Å; A322-V324 VanDerWaalsContact C-N 3.31Å; A322-V324 PolarHBondContact O-N 2.93Å; V324-E326 PolarHBondContact O-N 3.34Å; V324-R327 WeakPolarHBondContact O-CB 3.4Å; V324-R327 PolarHBondContact O-N 3.48Å; V324-R327 VanDerWaalsContact O-N 3.11Å; V324-Y330 HydrophobicContact CG1-CD2 3.77Å; V324-Y330 HydrophobicContact CG1-CG 4.02Å; V324-F334 HydrophobicContact CB-CE2 4.47Å; V324-F334 HydrophobicContact CB-CZ 4.41Å; V324-F334 HydrophobicContact CG1-CE2 3.94Å; V324-F334 HydrophobicContact CG1-CZ 4.18Å
325	C	89	Confident	89.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67.9	-21.4	-178.7	73	0	0	0	0	113.4	L321 A322 R327 F334 G392 L393 F396	L321-C325 WeakPolarHBondContact O-CB 3.32Å; L321-C325 PolarHBondContact O-N 3.3Å; L321-C325 PolarHBondContact O-SG 3.19Å; A322-C325 PolarHBondContact O-N 3.49Å; A322-C325 PolarHBondContact O-SG 3.2Å; C325-R327 PolarHBondContact O-N 2.74Å; C325-F334 HydrophobicContact CB-CD1 4.38Å; C325-F334 HydrophobicContact CB-CD2 3.9Å; C325-F334 HydrophobicContact CB-CE1 4.23Å; C325-F334 HydrophobicContact CB-CE2 3.73Å; C325-F334 HydrophobicContact CB-CG 4.24Å; C325-F334 HydrophobicContact CB-CZ 3.9Å; C325-G392 WeakPolarHBondContact SG-CA 3.5Å; C325-L393 HydrophobicContact CB-CD2 4.03Å; C325-F396 WeakPolarHBondContact O-CD2 3.43Å; C325-F396 VanDerWaalsContact O-CE2 3.3Å; C325-F396 WeakPolarHBondContact O-CE2 3.39Å
326	E	86.8	Confident	89.8	Confident	75 Å²	75	43.1 Å²	43.1	35%	0.35	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-8.9	173.6	-75.3	-175.7	-178.1	0	0	114.4	A322 V324 K395 F396	A322-E326 WeakPolarHBondContact O-CG 3.31Å; A322-E326 PolarHBondContact O-N 2.91Å; V324-E326 PolarHBondContact O-N 3.34Å; E326-K395 HydrophobicContact CB-CD 4.2Å; E326-K395 HydrophobicContact CG-CD 4.24Å; E326-K395 PolarHBondContact O-NZ 3.17Å; E326-F396 WeakPolarHBondContact O-CE2 3.4Å
327	R	87.5	Confident	89.6	Confident	82 Å²	82	47.4 Å²	47.4	31%	0.309	23%	0.232	S	C	.	.			trans	-91.4	124.2	-177.6	-63.2	-75.8	167.1	169.6	-4	111.4	Q280 V324 C325 H329 Y330 K331	Q280-R327 PolarHBondContact O-NH2 3.16Å; V324-R327 WeakPolarHBondContact O-CB 3.4Å; V324-R327 PolarHBondContact O-N 3.48Å; V324-R327 VanDerWaalsContact O-N 3.11Å; C325-R327 PolarHBondContact O-N 2.74Å; R327-H329 VanDerWaalsContact C-N 3.27Å; R327-H329 PolarHBondContact O-N 3.42Å; R327-Y330 HydrophobicContact CB-CD2 3.58Å; R327-Y330 HydrophobicContact CB-CE2 4.22Å; R327-Y330 HydrophobicContact CB-CG 4.36Å; R327-Y330 HydrophobicContact CG-CD2 3.99Å; R327-Y330 HydrophobicContact CG-CE2 4.31Å; R327-Y330 PolarHBondContact O-N 3.02Å; R327-Y330 VanDerWaalsContact O-N 3.12Å; R327-K331 PolarHBondContact O-N 2.78Å
328	P	86.9	Confident	89.4	Confident	80 Å²	80	53.1 Å²	53.1	52%	0.519	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-55.4	-38.1	179.6	-24.6	31.2	0	0	0	114.2	Y330 K331 F396	P328-Y330 VanDerWaalsContact C-N 3.28Å; P328-Y330 PolarHBondContact O-N 2.91Å; P328-K331 WeakPolarHBondContact O-CB 3.41Å; P328-K331 PolarHBondContact O-N 3.27Å; P328-F396 HydrophobicContact CB-CE1 4.46Å; P328-F396 HydrophobicContact CB-CZ 4.12Å; P328-F396 HydrophobicContact CG-CE1 4.28Å; P328-F396 HydrophobicContact CG-CZ 3.76Å
329	H	86.5	Confident	89.2	Confident	145 Å²	145	55.4 Å²	55.4	67%	0.671	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-73	-16.9	-176.9	-61.6	101.6	0	0	0	114.1	R327 N332	R327-H329 VanDerWaalsContact C-N 3.27Å; R327-H329 PolarHBondContact O-N 3.42Å; H329-N332 PolarHBondContact O-OD1 3.07Å
330	Y	87.7	Confident	89.1	Confident	13 Å²	13	52 Å²	52	5%	0.051	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-102.7	5.7	176.2	-58.4	-44.2	0	0	0	113.4	D283 Q287 L290 V324 R327 P328 N332 L333 F334	D283-Y330 WeakPolarHBondContact OD1-CE2 3.1Å; D283-Y330 PolarHBondContact OD1-OH 3.48Å; Q287-Y330 HydrophobicContact CG-CE1 4.25Å; L290-Y330 HydrophobicContact CD2-CD1 3.5Å; L290-Y330 HydrophobicContact CD2-CD2 3.46Å; L290-Y330 VanDerWaalsContact CD2-CD2 3.46Å; L290-Y330 HydrophobicContact CD2-CE1 3.22Å; L290-Y330 HydrophobicContact CD2-CE2 3.19Å; L290-Y330 HydrophobicContact CD2-CG 3.63Å; V324-Y330 HydrophobicContact CG1-CD2 3.77Å; V324-Y330 HydrophobicContact CG1-CG 4.02Å; R327-Y330 HydrophobicContact CB-CD2 3.58Å; R327-Y330 HydrophobicContact CB-CE2 4.22Å; R327-Y330 HydrophobicContact CB-CG 4.36Å; R327-Y330 HydrophobicContact CG-CD2 3.99Å; R327-Y330 HydrophobicContact CG-CE2 4.31Å; R327-Y330 PolarHBondContact O-N 3.02Å; R327-Y330 VanDerWaalsContact O-N 3.12Å; P328-Y330 VanDerWaalsContact C-N 3.28Å; P328-Y330 PolarHBondContact O-N 2.91Å; Y330-N332 PolarHBondContact O-N 3.09Å; Y330-N332 VanDerWaalsContact O-N 3.15Å; Y330-L333 HydrophobicContact CD1-CD1 4.27Å; Y330-L333 HydrophobicContact CG-CD1 4.39Å; Y330-L333 WeakPolarHBondContact O-CB 3.48Å; Y330-L333 PolarHBondContact O-N 3.2Å; Y330-F334 WeakPolarHBondContact O-CD2 3.43Å
331	K	87.7	Confident	89	Confident	66 Å²	66	54.1 Å²	54.1	29%	0.287	27%	0.274	S	S	.	.	H	α-helix	trans	-49.8	-41.4	176.2	-173.9	-169.9	-178.8	-135.5	0	111.7	R327 P328 L333 F334 E335 F396 F397	R327-K331 PolarHBondContact O-N 2.78Å; P328-K331 WeakPolarHBondContact O-CB 3.41Å; P328-K331 PolarHBondContact O-N 3.27Å; K331-L333 PolarHBondContact O-N 3.48Å; K331-L333 VanDerWaalsContact O-N 3.15Å; K331-F334 CarbonylContact O-C 3.59Å; K331-F334 PolarHBondContact O-N 3.3Å; K331-E335 IonicContact NZ-OE1 2.89Å; K331-E335 PolarHBondContact NZ-OE1 2.93Å; K331-E335 PolarHBondContact O-N 2.99Å; K331-F396 HydrophobicContact CD-CB 4.4Å; K331-F396 HydrophobicContact CG-CB 4.3Å; K331-F397 HydrophobicContact CB-CZ 4.42Å; K331-F397 HydrophobicContact CD-CE1 4.41Å; K331-F397 HydrophobicContact CD-CZ 4.32Å; K331-F397 HydrophobicContact CG-CE1 3.86Å; K331-F397 HydrophobicContact CG-CE2 4.18Å; K331-F397 HydrophobicContact CG-CZ 3.33Å; K331-F397 WeakPolarHBondContact O-CZ 3.48Å
332	N	88.9	Confident	89	Confident	106 Å²	106	55.1 Å²	55.1	57%	0.567	28%	0.281	S	S	*	.	H	α-helix	trans	-60.2	-23.2	179.7	66.1	-51.2	0	0	0	114.2	H329 Y330 F334	H329-N332 PolarHBondContact O-OD1 3.07Å; Y330-N332 PolarHBondContact O-N 3.09Å; Y330-N332 VanDerWaalsContact O-N 3.15Å; N332-F334 PolarHBondContact O-N 3.2Å
333	L	85.7	Confident	88.9	Confident	56 Å²	56	54.9 Å²	54.9	29%	0.293	28%	0.279	S	S	.	.	H	α-helix	trans	-71.7	-22.3	175.2	-59	-178.6	0	0	0	112.3	V294 Y330 K331	V294-L333 HydrophobicContact CG2-CD1 4.28Å; Y330-L333 HydrophobicContact CD1-CD1 4.27Å; Y330-L333 HydrophobicContact CG-CD1 4.39Å; Y330-L333 WeakPolarHBondContact O-CB 3.48Å; Y330-L333 PolarHBondContact O-N 3.2Å; K331-L333 PolarHBondContact O-N 3.48Å; K331-L333 VanDerWaalsContact O-N 3.15Å
334	F	88.2	Confident	89	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-119.2	-1.8	-174.5	-55.6	-82.6	0	0	0	113.3	V324 C325 Y330 K331 N332 D336 L340 I343 L393 F397	V324-F334 HydrophobicContact CB-CE2 4.47Å; V324-F334 HydrophobicContact CB-CZ 4.41Å; V324-F334 HydrophobicContact CG1-CE2 3.94Å; V324-F334 HydrophobicContact CG1-CZ 4.18Å; C325-F334 HydrophobicContact CB-CD1 4.38Å; C325-F334 HydrophobicContact CB-CD2 3.9Å; C325-F334 HydrophobicContact CB-CE1 4.23Å; C325-F334 HydrophobicContact CB-CE2 3.73Å; C325-F334 HydrophobicContact CB-CG 4.24Å; C325-F334 HydrophobicContact CB-CZ 3.9Å; Y330-F334 WeakPolarHBondContact O-CD2 3.43Å; K331-F334 CarbonylContact O-C 3.59Å; K331-F334 PolarHBondContact O-N 3.3Å; N332-F334 PolarHBondContact O-N 3.2Å; F334-D336 VanDerWaalsContact C-N 3.35Å; F334-D336 PolarHBondContact O-N 3.35Å; F334-L340 WeakPolarHBondContact O-CD2 2.97Å; F334-L340 WeakPolarHBondContact O-CG 3.18Å; F334-I343 HydrophobicContact CD1-CD1 3.6Å; F334-I343 HydrophobicContact CE1-CD1 4.17Å; F334-L393 HydrophobicContact CB-CD2 4.36Å; F334-L393 HydrophobicContact CD1-CD2 4.17Å; F334-L393 HydrophobicContact CG-CD2 4.4Å; F334-F397 HydrophobicContact CB-CE2 3.71Å; F334-F397 HydrophobicContact CB-CZ 4.11Å
335	E	88.2	Confident	89	Confident	106 Å²	106	59 Å²	59	50%	0.495	30%	0.298	S	S	.	.			trans	-76	-21.2	-174.3	-173.4	163.9	-130.6	0	0	113.6	K331 Q337 F397	K331-E335 IonicContact NZ-OE1 2.89Å; K331-E335 PolarHBondContact NZ-OE1 2.93Å; K331-E335 PolarHBondContact O-N 2.99Å; E335-Q337 PolarHBondContact O-N 3.29Å; E335-F397 HydrophobicContact CB-CE1 3.89Å; E335-F397 HydrophobicContact CB-CZ 4.06Å; E335-F397 HydrophobicContact CG-CE1 4.05Å
336	D	90.1	Very high	89.1	Confident	78 Å²	78	64.4 Å²	64.4	42%	0.417	32%	0.321	S	S	.	.	S	Bend	trans	-66.4	129.6	175.1	-178.7	75.8	0	0	0	111.2	F334 N338 T339 L340	F334-D336 VanDerWaalsContact C-N 3.35Å; F334-D336 PolarHBondContact O-N 3.35Å; D336-N338 VanDerWaalsContact C-N 3.29Å; D336-N338 PolarHBondContact O-N 2.67Å; D336-N338 WeakPolarHBondContact OD2-CA 3.16Å; D336-N338 WeakPolarHBondContact OD2-CB 3.36Å; D336-N338 PolarHBondContact OD2-N 2.86Å; D336-N338 PolarHBondContact OD2-ND2 3.35Å; D336-T339 WeakPolarHBondContact O-CB 3.39Å; D336-T339 PolarHBondContact O-N 3.11Å; D336-T339 VanDerWaalsContact O-N 3.13Å; D336-T339 PolarHBondContact OD2-N 3.34Å; D336-L340 PolarHBondContact O-N 2.87Å
337	Q	90	Very high	89.3	Confident	94 Å²	94	60.8 Å²	60.8	44%	0.439	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-35.5	-177.6	-174.7	68.3	26.9	0	0	112.2	E335 L340 T341	E335-Q337 PolarHBondContact O-N 3.29Å; Q337-L340 PolarHBondContact O-N 3.34Å; Q337-T341 WeakPolarHBondContact O-CB 3.39Å; Q337-T341 PolarHBondContact O-N 2.98Å; Q337-T341 PolarHBondContact O-OG1 3.18Å; Q337-T341 VanDerWaalsContact O-OG1 3.13Å
338	N	91	Very high	89.5	Confident	121 Å²	121	56.9 Å²	56.9	65%	0.647	29%	0.289	S	S	*	.	H	α-helix	trans	-71.4	-35.6	178.1	-50.6	-66.8	0	0	0	110.8	D336 S342	D336-N338 VanDerWaalsContact C-N 3.29Å; D336-N338 PolarHBondContact O-N 2.67Å; D336-N338 WeakPolarHBondContact OD2-CA 3.16Å; D336-N338 WeakPolarHBondContact OD2-CB 3.36Å; D336-N338 PolarHBondContact OD2-N 2.86Å; D336-N338 PolarHBondContact OD2-ND2 3.35Å; N338-S342 VanDerWaalsContact O-CB 3.23Å; N338-S342 WeakPolarHBondContact O-CB 3.26Å; N338-S342 PolarHBondContact O-N 3.07Å
339	T	88.9	Confident	89.7	Confident	48 Å²	48	54 Å²	54	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-49.5	171.5	-60.4	0	0	0	0	110.7	D336 T341 S342 I343	D336-T339 WeakPolarHBondContact O-CB 3.39Å; D336-T339 PolarHBondContact O-N 3.11Å; D336-T339 VanDerWaalsContact O-N 3.13Å; D336-T339 PolarHBondContact OD2-N 3.34Å; T339-T341 PolarHBondContact O-N 3.45Å; T339-S342 PolarHBondContact O-N 2.75Å; T339-I343 HydrophobicContact CG2-CD1 3.73Å; T339-I343 HydrophobicContact CG2-CG1 4.38Å; T339-I343 WeakPolarHBondContact O-CD1 3.34Å; T339-I343 WeakPolarHBondContact O-CG1 3.46Å; T339-I343 PolarHBondContact O-N 2.93Å
340	L	90.1	Very high	90	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-58.2	-50.1	175.8	-70.4	176.6	0	0	0	112	F334 D336 Q337 S342 I343 C344 L393 F397 P400 V401 I404	F334-L340 WeakPolarHBondContact O-CD2 2.97Å; F334-L340 WeakPolarHBondContact O-CG 3.18Å; D336-L340 PolarHBondContact O-N 2.87Å; Q337-L340 PolarHBondContact O-N 3.34Å; L340-S342 VanDerWaalsContact C-N 3.3Å; L340-S342 PolarHBondContact O-N 3.21Å; L340-I343 PolarHBondContact O-N 3.36Å; L340-I343 VanDerWaalsContact O-N 3.17Å; L340-C344 WeakPolarHBondContact O-CB 3.16Å; L340-C344 PolarHBondContact O-N 2.88Å; L340-C344 PolarHBondContact O-SG 3.28Å; L340-L393 HydrophobicContact CD2-CD2 3.98Å; L340-F397 HydrophobicContact CD1-CB 4.19Å; L340-F397 HydrophobicContact CD1-CD1 4.35Å; L340-F397 HydrophobicContact CD1-CG 4.23Å; L340-F397 HydrophobicContact CD2-CD2 4.21Å; L340-F397 HydrophobicContact CD2-CG 4.36Å; L340-P400 HydrophobicContact CD1-CB 4.04Å; L340-V401 HydrophobicContact CD2-CG2 4.28Å; L340-I404 HydrophobicContact CB-CD1 3.95Å
341	T	92.4	Very high	90.1	Very high	43 Å²	43	48.3 Å²	48.3	26%	0.264	25%	0.247	S	C	.	.	H	α-helix	trans	-58.1	-44	176.9	-65.5	0	0	0	0	111.1	Q337 T339 I343 C344 E345	Q337-T341 WeakPolarHBondContact O-CB 3.39Å; Q337-T341 PolarHBondContact O-N 2.98Å; Q337-T341 PolarHBondContact O-OG1 3.18Å; Q337-T341 VanDerWaalsContact O-OG1 3.13Å; T339-T341 PolarHBondContact O-N 3.45Å; T341-I343 VanDerWaalsContact C-N 3.35Å; T341-I343 PolarHBondContact O-N 2.95Å; T341-C344 PolarHBondContact O-N 3.03Å; T341-E345 WeakPolarHBondContact O-CB 3.41Å; T341-E345 PolarHBondContact O-N 3.18Å
342	S	91.7	Very high	90.2	Very high	23 Å²	23	45.3 Å²	45.3	16%	0.161	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-35.1	178.3	-169	0	0	0	0	112.6	W298 N338 T339 L340 K346	W298-S342 WeakPolarHBondContact CZ2-OG 3.31Å; N338-S342 VanDerWaalsContact O-CB 3.23Å; N338-S342 WeakPolarHBondContact O-CB 3.26Å; N338-S342 PolarHBondContact O-N 3.07Å; T339-S342 PolarHBondContact O-N 2.75Å; L340-S342 VanDerWaalsContact C-N 3.3Å; L340-S342 PolarHBondContact O-N 3.21Å; S342-K346 VanDerWaalsContact O-CB 3.27Å; S342-K346 WeakPolarHBondContact O-CB 3.36Å; S342-K346 PolarHBondContact O-N 2.99Å
343	I	90.1	Very high	90.3	Very high	1 Å²	1	45 Å²	45	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-67.4	-48.4	175.8	-66.2	156.9	0	0	0	109.3	W298 F334 T339 L340 T341 E345 V347 I348 L389 L393	W298-I343 HydrophobicContact CE3-CG1 4.26Å; W298-I343 HydrophobicContact CH2-CB 4.09Å; W298-I343 HydrophobicContact CH2-CG1 3.41Å; W298-I343 VanDerWaalsContact CH2-CG1 3.41Å; W298-I343 HydrophobicContact CZ3-CB 4.04Å; W298-I343 HydrophobicContact CZ3-CD1 4.42Å; W298-I343 HydrophobicContact CZ3-CG1 3.23Å; W298-I343 HydrophobicContact CZ3-CG2 4.48Å; F334-I343 HydrophobicContact CD1-CD1 3.6Å; F334-I343 HydrophobicContact CE1-CD1 4.17Å; T339-I343 HydrophobicContact CG2-CD1 3.73Å; T339-I343 HydrophobicContact CG2-CG1 4.38Å; T339-I343 WeakPolarHBondContact O-CD1 3.34Å; T339-I343 WeakPolarHBondContact O-CG1 3.46Å; T339-I343 PolarHBondContact O-N 2.93Å; L340-I343 PolarHBondContact O-N 3.36Å; L340-I343 VanDerWaalsContact O-N 3.17Å; T341-I343 VanDerWaalsContact C-N 3.35Å; T341-I343 PolarHBondContact O-N 2.95Å; I343-E345 PolarHBondContact O-N 2.86Å; I343-V347 WeakPolarHBondContact O-CA 3.27Å; I343-V347 WeakPolarHBondContact O-CB 3.39Å; I343-V347 PolarHBondContact O-N 2.99Å; I343-V347 VanDerWaalsContact O-N 3.11Å; I343-I348 HydrophobicContact CG2-CD1 3.79Å; I343-I348 HydrophobicContact CG2-CG1 4.12Å; I343-I348 PolarHBondContact O-N 3.06Å; I343-L389 HydrophobicContact CG2-CD2 3.82Å; I343-L389 HydrophobicContact CG2-CG 4.44Å; I343-L393 HydrophobicContact CD1-CD2 4.47Å; I343-L393 HydrophobicContact CG2-CD1 3.82Å
344	C	90.5	Very high	90.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	I	π-helix	trans	-57.4	-50.1	176.6	-68.5	0	0	0	0	111.3	L340 T341 V349 I404 F405 Y408	L340-C344 WeakPolarHBondContact O-CB 3.16Å; L340-C344 PolarHBondContact O-N 2.88Å; L340-C344 PolarHBondContact O-SG 3.28Å; T341-C344 PolarHBondContact O-N 3.03Å; C344-V349 WeakPolarHBondContact O-CB 3.2Å; C344-V349 VanDerWaalsContact O-CG2 3.28Å; C344-V349 WeakPolarHBondContact O-CG2 3.27Å; C344-V349 PolarHBondContact O-N 3.32Å; C344-I404 HydrophobicContact CB-CG2 3.68Å; C344-F405 HydrophobicContact CB-CD1 4.31Å; C344-F405 HydrophobicContact CB-CE1 3.56Å; C344-F405 HydrophobicContact CB-CZ 3.87Å; C344-F405 WeakPolarHBondContact SG-CZ 3.41Å; C344-Y408 HydrophobicContact CB-CE2 4.47Å
345	E	91.7	Very high	90.7	Very high	96 Å²	96	44.1 Å²	44.1	45%	0.449	22%	0.222	S	C	.	.	I	π-helix	trans	-77.6	-44	-172	-171.8	178.1	-158.1	0	0	113.9	T341 I343 P350 Y408	T341-E345 WeakPolarHBondContact O-CB 3.41Å; T341-E345 PolarHBondContact O-N 3.18Å; I343-E345 PolarHBondContact O-N 2.86Å; E345-P350 WeakPolarHBondContact O-CD 3.42Å; E345-P350 WeakPolarHBondContact O-CG 3.43Å; E345-Y408 WeakPolarHBondContact CB-OH 3.29Å; E345-Y408 WeakPolarHBondContact CG-OH 3.27Å
346	K	90.9	Very high	90.8	Very high	112 Å²	112	42.6 Å²	42.6	49%	0.487	23%	0.228	S	C	.	.	I	π-helix	trans	-99.2	-20.9	-170.3	-56.9	-172.3	-177.1	173	0	113.7	S342	S342-K346 VanDerWaalsContact O-CB 3.27Å; S342-K346 WeakPolarHBondContact O-CB 3.36Å; S342-K346 PolarHBondContact O-N 2.99Å
347	V	91.7	Very high	90.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	I	π-helix	trans	-112	-55.5	-178.6	-177.7	0	0	0	0	110.4	W298 L301 I318 I343 N351 L389	W298-V347 HydrophobicContact CE3-CG2 4.2Å; W298-V347 HydrophobicContact CH2-CG2 3.94Å; W298-V347 HydrophobicContact CZ3-CG2 3.5Å; L301-V347 HydrophobicContact CB-CG1 4.46Å; L301-V347 HydrophobicContact CB-CG2 4.2Å; L301-V347 HydrophobicContact CD1-CG1 4.07Å; I318-V347 HydrophobicContact CD1-CG1 4.31Å; I318-V347 HydrophobicContact CG1-CG1 4.05Å; I343-V347 WeakPolarHBondContact O-CA 3.27Å; I343-V347 WeakPolarHBondContact O-CB 3.39Å; I343-V347 PolarHBondContact O-N 2.99Å; I343-V347 VanDerWaalsContact O-N 3.11Å; V347-N351 WeakPolarHBondContact O-CB 3.45Å; V347-N351 PolarHBondContact O-ND2 3.09Å; V347-L389 HydrophobicContact CG1-CD2 4.15Å
348	I	91.3	Very high	90.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.207	C	C	.	.	I	π-helix	trans	-73.8	-57.9	-170.9	-64.7	170.6	0	0	0	111.4	I343 N351 M352 A386 L389 V390 L393 F405	I343-I348 HydrophobicContact CG2-CD1 3.79Å; I343-I348 HydrophobicContact CG2-CG1 4.12Å; I343-I348 PolarHBondContact O-N 3.06Å; I348-N351 CarbonylContact O-C 3.42Å; I348-N351 PolarHBondContact O-N 2.89Å; I348-N351 VanDerWaalsContact O-N 3.15Å; I348-M352 HydrophobicContact CG2-CG 4.21Å; I348-M352 HydrophobicContact CG2-SD 3.37Å; I348-M352 WeakPolarHBondContact CG2-SD 3.23Å; I348-M352 WeakPolarHBondContact O-CG 3.35Å; I348-M352 PolarHBondContact O-N 3.47Å; I348-A386 HydrophobicContact CG2-CB 4.39Å; I348-L389 HydrophobicContact CD1-CD2 4.03Å; I348-L389 HydrophobicContact CD1-CG 4.03Å; I348-L389 HydrophobicContact CG1-CD2 3.78Å; I348-L389 HydrophobicContact CG1-CG 4.23Å; I348-V390 HydrophobicContact CD1-CG2 3.95Å; I348-V390 HydrophobicContact CG2-CG2 3.64Å; I348-L393 HydrophobicContact CD1-CD1 3.77Å; I348-F405 HydrophobicContact CB-CE1 4.4Å; I348-F405 HydrophobicContact CB-CZ 4.1Å; I348-F405 HydrophobicContact CD1-CE2 4.46Å; I348-F405 HydrophobicContact CD1-CZ 3.72Å; I348-F405 HydrophobicContact CG2-CE1 4.01Å; I348-F405 HydrophobicContact CG2-CZ 3.67Å
349	V	91.4	Very high	90.8	Very high	19 Å²	19	34.1 Å²	34.1	12%	0.115	19%	0.189	C	C	.	.	H	α-helix	trans	-55.4	-49.8	-175.9	168.1	0	0	0	0	112.2	C344 N351 M352 E353 F405 Y408 M412	C344-V349 WeakPolarHBondContact O-CB 3.2Å; C344-V349 VanDerWaalsContact O-CG2 3.28Å; C344-V349 WeakPolarHBondContact O-CG2 3.27Å; C344-V349 PolarHBondContact O-N 3.32Å; V349-N351 VanDerWaalsContact C-N 3.26Å; V349-N351 PolarHBondContact O-N 2.95Å; V349-M352 PolarHBondContact O-N 3.31Å; V349-E353 PolarHBondContact O-N 3.38Å; V349-F405 HydrophobicContact CG2-CE1 4.37Å; V349-Y408 HydrophobicContact CG2-CG 4.42Å; V349-M412 HydrophobicContact CG1-CE 4.31Å
350	P	91.2	Very high	91	Very high	30 Å²	30	37.5 Å²	37.5	20%	0.195	20%	0.201	C	C	.	.	H	α-helix	trans	-64.6	-29.6	-178.5	-23.5	36.5	0	0	0	113.3	Q306 E345 M352	Q306-P350 PolarHBondContact NE2-O 3.23Å; E345-P350 WeakPolarHBondContact O-CD 3.42Å; E345-P350 WeakPolarHBondContact O-CG 3.43Å; P350-M352 VanDerWaalsContact C-N 3.32Å
351	N	90.9	Very high	91	Very high	8 Å²	8	38.4 Å²	38.4	4%	0.043	21%	0.208	C	C	.	.	H	α-helix	trans	-86.7	-3.3	177.6	-71.4	-60	0	0	0	112.9	I318 V347 I348 V349 R382 R383 A386	I318-N351 HydrophobicContact CD1-CB 4.2Å; V347-N351 WeakPolarHBondContact O-CB 3.45Å; V347-N351 PolarHBondContact O-ND2 3.09Å; I348-N351 CarbonylContact O-C 3.42Å; I348-N351 PolarHBondContact O-N 2.89Å; I348-N351 VanDerWaalsContact O-N 3.15Å; V349-N351 VanDerWaalsContact C-N 3.26Å; V349-N351 PolarHBondContact O-N 2.95Å; N351-R382 HydrophobicContact CB-CB 4.13Å; N351-R382 CarbonylContact O-C 3.31Å; N351-R382 VanDerWaalsContact OD1-CD 3.29Å; N351-R382 WeakPolarHBondContact OD1-CD 3.44Å; N351-R382 PolarHBondContact OD1-NH1 2.89Å; N351-R382 VanDerWaalsContact OD1-NH1 3.13Å; N351-R383 VanDerWaalsContact O-CA 3.31Å; N351-R383 WeakPolarHBondContact O-CA 3.4Å; N351-R383 WeakPolarHBondContact O-CG 3.24Å; N351-R383 PolarHBondContact O-N 3.37Å; N351-A386 HydrophobicContact CB-CB 4.2Å
352	M	89.6	Confident	91.1	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.02	20%	0.197	C	C	.	.	H	α-helix	trans	-100.8	-12.7	172.5	-70.4	180	90.1	0	0	113.3	I348 V349 P350 R383 A386 Y432 L433 S436	I348-M352 HydrophobicContact CG2-CG 4.21Å; I348-M352 HydrophobicContact CG2-SD 3.37Å; I348-M352 WeakPolarHBondContact CG2-SD 3.23Å; I348-M352 WeakPolarHBondContact O-CG 3.35Å; I348-M352 PolarHBondContact O-N 3.47Å; V349-M352 PolarHBondContact O-N 3.31Å; P350-M352 VanDerWaalsContact C-N 3.32Å; M352-R383 PolarHBondContact O-NE 3.4Å; M352-R383 PolarHBondContact O-NH2 3.32Å; M352-A386 HydrophobicContact CG-CB 3.74Å; M352-A386 HydrophobicContact SD-CB 4.44Å; M352-Y432 HydrophobicContact CB-CD1 4.26Å; M352-Y432 HydrophobicContact CE-CD1 3.29Å; M352-Y432 HydrophobicContact CE-CE1 3.79Å; M352-Y432 HydrophobicContact CE-CG 4.3Å; M352-Y432 HydrophobicContact CG-CD1 4.16Å; M352-Y432 HydrophobicContact CG-CE1 4.38Å; M352-L433 HydrophobicContact CE-CB 4.09Å; M352-L433 HydrophobicContact CE-CD1 3.91Å; M352-L433 HydrophobicContact SD-CD1 3.74Å; M352-S436 WeakPolarHBondContact CE-OG 3.11Å
353	E	90.4	Very high	91.2	Very high	98 Å²	98	41.1 Å²	41.1	46%	0.458	22%	0.216	S	C	.	.	S	Bend	trans	-62.6	155.7	177.7	-70.9	-175.5	176.1	0	0	112.6	V349 R355 R383	V349-E353 PolarHBondContact O-N 3.38Å; E353-R355 PolarHBondContact O-N 2.82Å; E353-R383 PolarHBondContact O-NE 3.07Å; E353-R383 PolarHBondContact O-NH2 3.42Å; E353-R383 VanDerWaalsContact O-NH2 3.11Å
354	F	90.9	Very high	91.3	Very high	8 Å²	8	47.1 Å²	47.1	4%	0.035	25%	0.248	C	C	.	.			trans	-86.9	102.3	178.7	-157.9	-94.8	0	0	0	109.4	D358 E359 F362 Y369 R383 W424 K425 D428 V479	F354-D358 HydrophobicContact CD1-CB 4.36Å; F354-D358 HydrophobicContact CD2-CB 4.26Å; F354-D358 HydrophobicContact CE1-CB 4.25Å; F354-D358 HydrophobicContact CE2-CB 4.08Å; F354-D358 HydrophobicContact CG-CB 4.37Å; F354-D358 HydrophobicContact CZ-CB 4.07Å; F354-E359 HydrophobicContact CD1-CB 4.13Å; F354-E359 HydrophobicContact CE1-CB 3.57Å; F354-E359 HydrophobicContact CE1-CG 4.07Å; F354-F362 HydrophobicContact CZ-CB 4.13Å; F354-F362 HydrophobicContact CZ-CG 4.48Å; F354-Y369 HydrophobicContact CE2-CE2 4.32Å; F354-Y369 HydrophobicContact CZ-CE2 4.48Å; F354-R383 VanDerWaalsContact CB-NH2 3.27Å; F354-W424 AromaticContact CD1-CH2 3.69Å; F354-W424 HydrophobicContact CD1-CH2 3.69Å; F354-W424 HydrophobicContact CD1-CZ3 4.14Å; F354-W424 AromaticContact CE1-CH2 3.89Å; F354-W424 HydrophobicContact CE1-CH2 3.89Å; F354-W424 HydrophobicContact CE1-CZ3 4.44Å; F354-W424 HydrophobicContact CG-CH2 4.38Å; F354-W424 HydrophobicContact CG-CZ3 4.4Å; F354-K425 HydrophobicContact CB-CD 4.49Å; F354-K425 HydrophobicContact CB-CG 4.38Å; F354-D428 WeakPolarHBondContact CB-OD2 3.43Å; F354-V479 HydrophobicContact CD2-CG1 4.03Å; F354-V479 HydrophobicContact CE1-CG2 3.99Å; F354-V479 HydrophobicContact CE2-CG1 3.67Å; F354-V479 HydrophobicContact CE2-CG2 4.31Å; F354-V479 HydrophobicContact CZ-CG1 3.96Å; F354-V479 HydrophobicContact CZ-CG2 3.72Å
355	R	91	Very high	91.4	Very high	36 Å²	36	51.3 Å²	51.3	14%	0.136	27%	0.27	C	S	.	.			trans	-81.6	165.5	-174.3	-56.4	178.7	-63.1	162.5	-2.2	110.6	Q306 D311 E353 A357 D358 E359	Q306-R355 PolarHBondContact O-NH1 3.4Å; D311-R355 IonicContact OD1-CZ 3.27Å; D311-R355 IonicContact OD1-NH1 3.61Å; D311-R355 PolarHBondContact OD1-NH1 3.35Å; D311-R355 IonicContact OD1-NH2 3.63Å; D311-R355 IonicContact OD2-CZ 3.7Å; D311-R355 IonicContact OD2-NH1 3.64Å; D311-R355 PolarHBondContact OD2-NH1 2.99Å; D311-R355 IonicContact OD2-NH2 2.99Å; D311-R355 PolarHBondContact OD2-NH2 3.48Å; E353-R355 PolarHBondContact O-N 2.82Å; R355-A357 VanDerWaalsContact C-N 3.25Å; R355-A357 PolarHBondContact O-N 3.42Å; R355-D358 VanDerWaalsContact CB-OD2 3.27Å; R355-D358 WeakPolarHBondContact CB-OD2 3.19Å; R355-D358 PolarHBondContact N-OD2 2.73Å; R355-D358 IonicContact NE-OD2 3.09Å; R355-D358 PolarHBondContact NE-OD2 3.12Å; R355-D358 IonicContact NH2-OD1 2.71Å; R355-D358 WeakPolarHBondContact O-CB 3.34Å; R355-D358 PolarHBondContact O-N 2.66Å; R355-E359 PolarHBondContact O-N 3.34Å
356	A	90.1	Very high	91.5	Very high	74 Å²	74	47.4 Å²	47.4	61%	0.612	25%	0.253	S	S	*	.	H	α-helix	trans	-58.5	-38.6	174.7	0	0	0	0	0	112.1	D358 E359 E360	A356-D358 VanDerWaalsContact C-N 3.3Å; A356-D358 PolarHBondContact O-N 2.7Å; A356-E359 WeakPolarHBondContact O-CB 3.2Å; A356-E359 PolarHBondContact O-N 2.84Å; A356-E360 WeakPolarHBondContact O-CB 3.08Å; A356-E360 PolarHBondContact O-N 2.88Å
357	A	88.2	Confident	91.4	Very high	34 Å²	34	47.3 Å²	47.3	28%	0.281	26%	0.255	S	S	.	.	H	α-helix	trans	-65.5	-30.9	175.2	0	0	0	0	0	113.1	V308 R355 A361	V308-A357 HydrophobicContact CG2-CB 3.71Å; R355-A357 VanDerWaalsContact C-N 3.25Å; R355-A357 PolarHBondContact O-N 3.42Å; A357-A361 VanDerWaalsContact O-CB 3.24Å; A357-A361 WeakPolarHBondContact O-CB 3.37Å; A357-A361 PolarHBondContact O-N 3.19Å
358	D	90.5	Very high	91.2	Very high	28 Å²	28	49 Å²	49	15%	0.15	26%	0.262	C	S	.	.	H	α-helix	trans	-73.3	-35	175.1	-54.3	-49.7	0	0	0	110.6	F354 R355 A356 F362	F354-D358 HydrophobicContact CD1-CB 4.36Å; F354-D358 HydrophobicContact CD2-CB 4.26Å; F354-D358 HydrophobicContact CE1-CB 4.25Å; F354-D358 HydrophobicContact CE2-CB 4.08Å; F354-D358 HydrophobicContact CG-CB 4.37Å; F354-D358 HydrophobicContact CZ-CB 4.07Å; R355-D358 VanDerWaalsContact CB-OD2 3.27Å; R355-D358 WeakPolarHBondContact CB-OD2 3.19Å; R355-D358 PolarHBondContact N-OD2 2.73Å; R355-D358 IonicContact NE-OD2 3.09Å; R355-D358 PolarHBondContact NE-OD2 3.12Å; R355-D358 IonicContact NH2-OD1 2.71Å; R355-D358 WeakPolarHBondContact O-CB 3.34Å; R355-D358 PolarHBondContact O-N 2.66Å; A356-D358 VanDerWaalsContact C-N 3.3Å; A356-D358 PolarHBondContact O-N 2.7Å; D358-F362 VanDerWaalsContact O-CB 3.25Å; D358-F362 WeakPolarHBondContact O-CB 3.37Å; D358-F362 PolarHBondContact O-N 3Å
359	E	93.2	Very high	91.2	Very high	54 Å²	54	50.2 Å²	50.2	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-67.8	-47.2	174.7	-164	165.2	-171.1	0	0	112	F354 R355 A356 A361 F362 E363 K425	F354-E359 HydrophobicContact CD1-CB 4.13Å; F354-E359 HydrophobicContact CE1-CB 3.57Å; F354-E359 HydrophobicContact CE1-CG 4.07Å; R355-E359 PolarHBondContact O-N 3.34Å; A356-E359 WeakPolarHBondContact O-CB 3.2Å; A356-E359 PolarHBondContact O-N 2.84Å; E359-A361 PolarHBondContact O-N 2.71Å; E359-F362 WeakPolarHBondContact O-CB 3.48Å; E359-F362 PolarHBondContact O-N 2.98Å; E359-F362 VanDerWaalsContact O-N 3.15Å; E359-E363 WeakPolarHBondContact O-CG 3.48Å; E359-E363 PolarHBondContact O-N 2.6Å; E359-K425 WeakPolarHBondContact OE2-CE 3.38Å; E359-K425 IonicContact OE2-NZ 3.59Å; E359-K425 PolarHBondContact OE2-NZ 2.94Å
360	E	92.4	Very high	91.2	Very high	119 Å²	119	49.7 Å²	49.7	56%	0.556	26%	0.264	S	S	*	.	H	α-helix	trans	-60.5	-44.5	173	-175.5	-178.8	173.1	0	0	111.1	A356 F362 E363 D364 N365	A356-E360 WeakPolarHBondContact O-CB 3.08Å; A356-E360 PolarHBondContact O-N 2.88Å; E360-F362 VanDerWaalsContact C-N 3.3Å; E360-F362 PolarHBondContact O-N 2.89Å; E360-E363 PolarHBondContact O-N 3.08Å; E360-D364 HydrophobicContact CG-CB 4.49Å; E360-D364 WeakPolarHBondContact O-CA 2.96Å; E360-D364 WeakPolarHBondContact O-CB 3.37Å; E360-D364 PolarHBondContact O-N 3.3Å; E360-N365 PolarHBondContact O-N 3.4Å
361	A	90.6	Very high	91	Very high	19 Å²	19	52.9 Å²	52.9	16%	0.157	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-37.1	174.8	0	0	0	0	0	112.1	A357 E359 N365 S366 Y369	A357-A361 VanDerWaalsContact O-CB 3.24Å; A357-A361 WeakPolarHBondContact O-CB 3.37Å; A357-A361 PolarHBondContact O-N 3.19Å; E359-A361 PolarHBondContact O-N 2.71Å; A361-N365 CarbonylContact O-C 3.54Å; A361-N365 WeakPolarHBondContact O-CA 3.3Å; A361-N365 PolarHBondContact O-N 3.47Å; A361-S366 WeakPolarHBondContact O-CA 3.36Å; A361-S366 PolarHBondContact O-N 3.44Å; A361-Y369 HydrophobicContact CB-CD2 4.21Å
362	F	94.7	Very high	90.6	Very high	5 Å²	5	57.5 Å²	57.5	2%	0.022	29%	0.289	C	S	.	.	H	α-helix	trans	-67.5	-39.3	177.6	-177.6	-83.9	0	0	0	112.5	F354 D358 E359 E360 Y369 P478 V479 A482 S515 V517 V518	F354-F362 HydrophobicContact CZ-CB 4.13Å; F354-F362 HydrophobicContact CZ-CG 4.48Å; D358-F362 VanDerWaalsContact O-CB 3.25Å; D358-F362 WeakPolarHBondContact O-CB 3.37Å; D358-F362 PolarHBondContact O-N 3Å; E359-F362 WeakPolarHBondContact O-CB 3.48Å; E359-F362 PolarHBondContact O-N 2.98Å; E359-F362 VanDerWaalsContact O-N 3.15Å; E360-F362 VanDerWaalsContact C-N 3.3Å; E360-F362 PolarHBondContact O-N 2.89Å; F362-Y369 HydrophobicContact CB-CD2 4.04Å; F362-Y369 HydrophobicContact CB-CE2 4.12Å; F362-Y369 HydrophobicContact CB-CG 4.45Å; F362-Y369 HydrophobicContact CD2-CD1 4.11Å; F362-Y369 HydrophobicContact CD2-CD2 4.5Å; F362-Y369 AromaticContact CD2-CE1 3.74Å; F362-Y369 HydrophobicContact CD2-CE1 3.74Å; F362-Y369 HydrophobicContact CD2-CE2 4.15Å; F362-Y369 HydrophobicContact CD2-CG 4.49Å; F362-Y369 AromaticContact CD2-CZ 3.77Å; F362-Y369 HydrophobicContact CE2-CE1 4.35Å; F362-P478 HydrophobicContact CE1-CB 3.87Å; F362-P478 HydrophobicContact CE1-CG 4.05Å; F362-P478 HydrophobicContact CZ-CB 4.04Å; F362-V479 HydrophobicContact CD1-CG2 4.04Å; F362-V479 HydrophobicContact CD2-CG2 4.15Å; F362-V479 HydrophobicContact CE1-CG2 3.97Å; F362-V479 HydrophobicContact CE2-CG2 4.06Å; F362-V479 HydrophobicContact CG-CG2 4.15Å; F362-V479 HydrophobicContact CZ-CG2 3.98Å; F362-A482 HydrophobicContact CE2-CB 3.85Å; F362-A482 HydrophobicContact CZ-CB 4.21Å; F362-S515 WeakPolarHBondContact CE1-OG 3.16Å; F362-V517 HydrophobicContact CD1-CG2 4.49Å; F362-V517 HydrophobicContact CD2-CB 3.98Å; F362-V517 HydrophobicContact CD2-CG1 3.96Å; F362-V517 HydrophobicContact CD2-CG2 3.76Å; F362-V517 HydrophobicContact CE1-CB 4.44Å; F362-V517 HydrophobicContact CE2-CB 3.48Å; F362-V517 VanDerWaalsContact CE2-CB 3.48Å; F362-V517 HydrophobicContact CE2-CG1 3.44Å; F362-V517 VanDerWaalsContact CE2-CG1 3.44Å; F362-V517 HydrophobicContact CE2-CG2 3.81Å; F362-V517 HydrophobicContact CG-CG2 4.12Å; F362-V517 HydrophobicContact CZ-CB 3.74Å; F362-V517 HydrophobicContact CZ-CG1 4.14Å; F362-V517 HydrophobicContact CZ-CG2 4.19Å; F362-V518 HydrophobicContact CZ-CG2 4.29Å
363	E	93.9	Very high	90.4	Very high	119 Å²	119	58.9 Å²	58.9	56%	0.556	30%	0.296	S	S	*	.	H	α-helix	trans	-87.4	-49.8	-175.9	-66.3	-173.2	167.3	0	0	112.9	E359 E360	E359-E363 WeakPolarHBondContact O-CG 3.48Å; E359-E363 PolarHBondContact O-N 2.6Å; E360-E363 PolarHBondContact O-N 3.08Å
364	D	92.5	Very high	89.9	Confident	127 Å²	127	56 Å²	56	68%	0.679	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-27.3	-169.2	-65	-45.9	0	0	0	113.4	E360	E360-D364 HydrophobicContact CG-CB 4.49Å; E360-D364 WeakPolarHBondContact O-CA 2.96Å; E360-D364 WeakPolarHBondContact O-CB 3.37Å; E360-D364 PolarHBondContact O-N 3.3Å
365	N	92.5	Very high	88.8	Confident	88 Å²	88	59.7 Å²	59.7	47%	0.471	30%	0.301	S	S	.	.			trans	-123.7	45.3	178.6	-162.6	-1.7	0	0	0	112.8	E360 A361 E367 E368 Y369	E360-N365 PolarHBondContact O-N 3.4Å; A361-N365 CarbonylContact O-C 3.54Å; A361-N365 WeakPolarHBondContact O-CA 3.3Å; A361-N365 PolarHBondContact O-N 3.47Å; N365-E367 PolarHBondContact O-N 3.49Å; N365-E367 VanDerWaalsContact O-N 3.1Å; N365-E368 PolarHBondContact O-N 2.95Å; N365-E368 VanDerWaalsContact OD1-CB 3.28Å; N365-E368 WeakPolarHBondContact OD1-CB 3.33Å; N365-Y369 PolarHBondContact O-N 2.68Å; N365-Y369 VanDerWaalsContact O-N 3.1Å
366	S	93.7	Very high	87.4	Confident	13 Å²	13	59.7 Å²	59.7	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-54.4	-32.8	-173.2	57.4	0	0	0	0	114.2	A361 Y369 I370 I516	A361-S366 WeakPolarHBondContact O-CA 3.36Å; A361-S366 PolarHBondContact O-N 3.44Å; S366-Y369 PolarHBondContact O-N 3.45Å; S366-I370 WeakPolarHBondContact O-CB 3.4Å; S366-I370 WeakPolarHBondContact O-CD1 3.45Å; S366-I370 WeakPolarHBondContact O-CG1 3.36Å; S366-I370 PolarHBondContact O-N 3.37Å; S366-I516 WeakPolarHBondContact OG-CB 3.07Å; S366-I516 WeakPolarHBondContact OG-CD1 3.47Å; S366-I516 WeakPolarHBondContact OG-CG2 3.2Å
367	E	89.4	Confident	85.7	Confident	111 Å²	111	58.3 Å²	58.3	52%	0.519	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-48.3	176.7	-174.6	175.1	177.2	0	0	111.5	N365 Y369 I370 R371 K611	N365-E367 PolarHBondContact O-N 3.49Å; N365-E367 VanDerWaalsContact O-N 3.1Å; E367-Y369 VanDerWaalsContact C-N 3.32Å; E367-Y369 PolarHBondContact O-N 2.99Å; E367-I370 PolarHBondContact O-N 2.9Å; E367-R371 VanDerWaalsContact O-CB 3.3Å; E367-R371 WeakPolarHBondContact O-CB 3.46Å; E367-R371 PolarHBondContact O-N 3.37Å; E367-K611 IonicContact OE1-NZ 3.5Å; E367-K611 PolarHBondContact OE1-NZ 2.84Å; E367-K611 IonicContact OE2-NZ 3.79Å; E367-K611 PolarHBondContact OE2-NZ 3.27Å
368	E	87	Confident	84.3	Confident	35 Å²	35	57.4 Å²	57.4	16%	0.164	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-38.7	177.1	-179.9	63.1	-176.5	0	0	111.5	N365 R371 R372	N365-E368 PolarHBondContact O-N 2.95Å; N365-E368 VanDerWaalsContact OD1-CB 3.28Å; N365-E368 WeakPolarHBondContact OD1-CB 3.33Å; E368-R371 PolarHBondContact O-N 3.02Å; E368-R371 IonicContact OE1-CZ 2.76Å; E368-R371 IonicContact OE1-NH2 3.05Å; E368-R371 PolarHBondContact OE1-NH2 2.86Å; E368-R371 IonicContact OE2-CZ 3.71Å; E368-R371 IonicContact OE2-NE 3.98Å; E368-R371 PolarHBondContact OE2-NE 3.02Å; E368-R371 IonicContact OE2-NH2 3.83Å; E368-R371 PolarHBondContact OE2-NH2 3.15Å; E368-R372 WeakPolarHBondContact O-CB 3.41Å; E368-R372 VanDerWaalsContact O-CG 3.29Å; E368-R372 WeakPolarHBondContact O-CG 3.13Å; E368-R372 PolarHBondContact O-N 3.11Å; E368-R372 IonicContact OE1-CZ 2.68Å; E368-R372 VanDerWaalsContact OE1-CZ 3.25Å; E368-R372 IonicContact OE1-NE 2.73Å; E368-R372 PolarHBondContact OE1-NE 3.27Å; E368-R372 IonicContact OE1-NH2 3.33Å; E368-R372 PolarHBondContact OE1-NH2 3.28Å
369	Y	91.3	Very high	82.7	Confident	26 Å²	26	61.5 Å²	61.5	10%	0.102	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-49.7	174.6	-174.9	-82.2	0	0	0	111.5	F354 A361 F362 N365 S366 E367 R371 R372 D373 V517 Y521	F354-Y369 HydrophobicContact CE2-CE2 4.32Å; F354-Y369 HydrophobicContact CZ-CE2 4.48Å; A361-Y369 HydrophobicContact CB-CD2 4.21Å; F362-Y369 HydrophobicContact CB-CD2 4.04Å; F362-Y369 HydrophobicContact CB-CE2 4.12Å; F362-Y369 HydrophobicContact CB-CG 4.45Å; F362-Y369 HydrophobicContact CD2-CD1 4.11Å; F362-Y369 HydrophobicContact CD2-CD2 4.5Å; F362-Y369 AromaticContact CD2-CE1 3.74Å; F362-Y369 HydrophobicContact CD2-CE1 3.74Å; F362-Y369 HydrophobicContact CD2-CE2 4.15Å; F362-Y369 HydrophobicContact CD2-CG 4.49Å; F362-Y369 AromaticContact CD2-CZ 3.77Å; F362-Y369 HydrophobicContact CE2-CE1 4.35Å; N365-Y369 PolarHBondContact O-N 2.68Å; N365-Y369 VanDerWaalsContact O-N 3.1Å; S366-Y369 PolarHBondContact O-N 3.45Å; E367-Y369 VanDerWaalsContact C-N 3.32Å; E367-Y369 PolarHBondContact O-N 2.99Å; Y369-R371 PolarHBondContact O-N 3.46Å; Y369-R372 PolarHBondContact O-N 3.04Å; Y369-D373 VanDerWaalsContact O-CB 3.32Å; Y369-D373 WeakPolarHBondContact O-CB 3.34Å; Y369-D373 PolarHBondContact O-N 3.38Å; Y369-V517 HydrophobicContact CD1-CG1 4Å; Y369-V517 HydrophobicContact CD1-CG2 4.07Å; Y369-V517 HydrophobicContact CE1-CG1 4Å; Y369-Y521 WeakPolarHBondContact CE1-OH 3.43Å
370	I	91.9	Very high	81.4	Confident	8 Å²	8	63 Å²	63	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-44.1	179.4	-67.3	157.7	0	0	0	110.8	S366 E367 D373 L374 I516 V517 T520 Y521 Y571	S366-I370 WeakPolarHBondContact O-CB 3.4Å; S366-I370 WeakPolarHBondContact O-CD1 3.45Å; S366-I370 WeakPolarHBondContact O-CG1 3.36Å; S366-I370 PolarHBondContact O-N 3.37Å; E367-I370 PolarHBondContact O-N 2.9Å; I370-D373 PolarHBondContact O-N 3Å; I370-L374 HydrophobicContact CG2-CD1 3.83Å; I370-L374 HydrophobicContact CG2-CG 4.22Å; I370-L374 WeakPolarHBondContact O-CB 3.43Å; I370-L374 PolarHBondContact O-N 3.06Å; I370-I516 HydrophobicContact CD1-CG2 4.22Å; I370-V517 HydrophobicContact CD1-CG2 4.34Å; I370-V517 HydrophobicContact CG1-CG1 4.28Å; I370-V517 HydrophobicContact CG1-CG2 4.22Å; I370-T520 HydrophobicContact CD1-CG2 3.85Å; I370-T520 HydrophobicContact CG1-CG2 4.46Å; I370-T520 HydrophobicContact CG2-CG2 4.14Å; I370-Y521 HydrophobicContact CB-CE1 4.48Å; I370-Y521 HydrophobicContact CG1-CE1 3.95Å; I370-Y521 HydrophobicContact CG2-CE1 4.3Å; I370-Y571 HydrophobicContact CG2-CD2 4.4Å; I370-Y571 HydrophobicContact CG2-CE2 3.71Å
371	R	85.3	Confident	80.8	Confident	97 Å²	97	58.9 Å²	58.9	37%	0.366	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-44.9	179.6	-165.4	-178.6	67.3	95.2	0.6	111.9	E367 E368 Y369 E375 S377	E367-R371 VanDerWaalsContact O-CB 3.3Å; E367-R371 WeakPolarHBondContact O-CB 3.46Å; E367-R371 PolarHBondContact O-N 3.37Å; E368-R371 PolarHBondContact O-N 3.02Å; E368-R371 IonicContact OE1-CZ 2.76Å; E368-R371 IonicContact OE1-NH2 3.05Å; E368-R371 PolarHBondContact OE1-NH2 2.86Å; E368-R371 IonicContact OE2-CZ 3.71Å; E368-R371 IonicContact OE2-NE 3.98Å; E368-R371 PolarHBondContact OE2-NE 3.02Å; E368-R371 IonicContact OE2-NH2 3.83Å; E368-R371 PolarHBondContact OE2-NH2 3.15Å; Y369-R371 PolarHBondContact O-N 3.46Å; R371-E375 WeakPolarHBondContact CG-OE2 3.5Å; R371-E375 VanDerWaalsContact O-CB 3.24Å; R371-E375 WeakPolarHBondContact O-CB 3.38Å; R371-E375 PolarHBondContact O-N 2.83Å; R371-S377 VanDerWaalsContact C-OG 3.29Å; R371-S377 PolarHBondContact O-OG 3.11Å
372	R	83	Confident	80.6	Confident	105 Å²	105	58.1 Å²	58.1	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-49.9	174.6	-73.9	177	-173.3	-176.6	4.9	110.6	E368 Y369 S377 D378	E368-R372 WeakPolarHBondContact O-CB 3.41Å; E368-R372 VanDerWaalsContact O-CG 3.29Å; E368-R372 WeakPolarHBondContact O-CG 3.13Å; E368-R372 PolarHBondContact O-N 3.11Å; E368-R372 IonicContact OE1-CZ 2.68Å; E368-R372 VanDerWaalsContact OE1-CZ 3.25Å; E368-R372 IonicContact OE1-NE 2.73Å; E368-R372 PolarHBondContact OE1-NE 3.27Å; E368-R372 IonicContact OE1-NH2 3.33Å; E368-R372 PolarHBondContact OE1-NH2 3.28Å; Y369-R372 PolarHBondContact O-N 3.04Å; R372-S377 WeakPolarHBondContact CA-OG 3.42Å; R372-S377 PolarHBondContact N-OG 2.93Å; R372-D378 HydrophobicContact CB-CB 4.25Å; R372-D378 WeakPolarHBondContact O-CB 3.32Å
373	D	84.9	Confident	80.3	Confident	33 Å²	33	58.8 Å²	58.8	18%	0.176	30%	0.297	C	S	.	.	H	α-helix	trans	-76.6	-40.3	-168.8	-162.7	58.5	0	0	0	114.7	Y369 I370 K486 Y521	Y369-D373 VanDerWaalsContact O-CB 3.32Å; Y369-D373 WeakPolarHBondContact O-CB 3.34Å; Y369-D373 PolarHBondContact O-N 3.38Å; I370-D373 PolarHBondContact O-N 3Å; D373-K486 IonicContact OD1-NZ 3.57Å; D373-K486 PolarHBondContact OD1-NZ 2.89Å; D373-K486 VanDerWaalsContact OD2-CD 3.25Å; D373-K486 WeakPolarHBondContact OD2-CD 3.32Å; D373-K486 WeakPolarHBondContact OD2-CE 3.42Å; D373-K486 IonicContact OD2-NZ 3.34Å; D373-K486 PolarHBondContact OD2-NZ 3.17Å; D373-Y521 WeakPolarHBondContact CB-OH 3.36Å; D373-Y521 PolarHBondContact OD2-OH 2.85Å
374	L	80.3	Confident	79.8	Confident	37 Å²	37	55.8 Å²	55.8	19%	0.194	28%	0.281	C	S	.	.	H	α-helix	trans	-92.3	-36.4	-176.1	-61.3	-170.2	0	0	0	113.6	I370 M489 Y521 Y571	I370-L374 HydrophobicContact CG2-CD1 3.83Å; I370-L374 HydrophobicContact CG2-CG 4.22Å; I370-L374 WeakPolarHBondContact O-CB 3.43Å; I370-L374 PolarHBondContact O-N 3.06Å; L374-M489 HydrophobicContact CD2-CE 3.42Å; L374-M489 VanDerWaalsContact CD2-CE 3.42Å; L374-Y521 HydrophobicContact CD1-CD1 3.92Å; L374-Y521 HydrophobicContact CD1-CE1 3.72Å; L374-Y521 HydrophobicContact CD2-CD1 4.43Å; L374-Y521 HydrophobicContact CD2-CE1 3.92Å; L374-Y521 HydrophobicContact CG-CD1 4.41Å; L374-Y521 HydrophobicContact CG-CE1 3.77Å; L374-Y571 HydrophobicContact CD1-CD1 4.31Å; L374-Y571 HydrophobicContact CD1-CE1 3.71Å
375	E	68	Low	79.6	Confident	86 Å²	86	50 Å²	50	40%	0.402	25%	0.25	S	S	.	.	H	α-helix	trans	-89.4	-10.7	-173.2	-54.4	171.3	-160.6	0	0	112.4	R371 S377 Q444 Y571	R371-E375 WeakPolarHBondContact CG-OE2 3.5Å; R371-E375 VanDerWaalsContact O-CB 3.24Å; R371-E375 WeakPolarHBondContact O-CB 3.38Å; R371-E375 PolarHBondContact O-N 2.83Å; E375-S377 VanDerWaalsContact C-N 3.3Å; E375-Q444 PolarHBondContact O-NE2 3.11Å; E375-Y571 PolarHBondContact OE1-OH 2.99Å
376	G	62.8	Low	79.6	Confident	35 Å²	35	45.8 Å²	45.8	36%	0.361	23%	0.228	S	C	.	.	S	Bend	trans	74.1	22.1	-178.7	0	0	0	0	0	113.2	D378	G376-D378 WeakPolarHBondContact CA-OD1 3.4Å; G376-D378 PolarHBondContact O-N 3.06Å
377	S	54.1	Low	79.2	Confident	46 Å²	46	45.6 Å²	45.6	32%	0.322	23%	0.227	S	C	.	.			trans	-75.7	9.8	170.7	62.8	0	0	0	0	112.8	R371 R372 E375 I379	R371-S377 VanDerWaalsContact C-OG 3.29Å; R371-S377 PolarHBondContact O-OG 3.11Å; R372-S377 WeakPolarHBondContact CA-OG 3.42Å; R372-S377 PolarHBondContact N-OG 2.93Å; E375-S377 VanDerWaalsContact C-N 3.3Å; S377-I379 VanDerWaalsContact C-N 3.28Å; S377-I379 PolarHBondContact O-N 3.08Å
378	D	58.7	Low	79.1	Confident	14 Å²	14	42 Å²	42	8%	0.075	21%	0.21	C	C	.	.			trans	-84.8	20	-176.4	65.1	-21.9	0	0	0	114.7	R372 G376 D380 T381 R384	R372-D378 HydrophobicContact CB-CB 4.25Å; R372-D378 WeakPolarHBondContact O-CB 3.32Å; G376-D378 WeakPolarHBondContact CA-OD1 3.4Å; G376-D378 PolarHBondContact O-N 3.06Å; D378-D380 PolarHBondContact O-N 3.25Å; D378-T381 HydrophobicContact CB-CG2 3.93Å; D378-T381 PolarHBondContact O-N 3.15Å; D378-T381 PolarHBondContact O-OG1 2.95Å; D378-R384 HydrophobicContact CB-CB 4.33Å; D378-R384 WeakPolarHBondContact O-CB 3.47Å; D378-R384 WeakPolarHBondContact OD2-CB 3.49Å; D378-R384 VanDerWaalsContact OD2-CD 3.31Å; D378-R384 WeakPolarHBondContact OD2-CD 3.02Å
379	I	57.5	Low	79.4	Confident	114 Å²	114	40.3 Å²	40.3	59%	0.585	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-35.2	-175	-59.7	175.4	0	0	0	112	S377	S377-I379 VanDerWaalsContact C-N 3.28Å; S377-I379 PolarHBondContact O-N 3.08Å
380	D	64.4	Low	79.4	Confident	87 Å²	87	39.1 Å²	39.1	47%	0.465	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	15.8	-174.1	-56.5	-34.1	0	0	0	113.9	L312 S315 D378	L312-D380 HydrophobicContact CD1-CB 4.29Å; S315-D380 WeakPolarHBondContact CB-O 3.3Å; S315-D380 PolarHBondContact OG-O 3.46Å; D378-D380 PolarHBondContact O-N 3.25Å
381	T	80.3	Confident	79.2	Confident	31 Å²	31	42.2 Å²	42.2	19%	0.19	21%	0.209	C	C	.	.			trans	-89.4	143.5	177.4	71.6	0	0	0	0	112.7	S315 D378 R383 R384 A385	S315-T381 PolarHBondContact OG-O 2.76Å; D378-T381 HydrophobicContact CB-CG2 3.93Å; D378-T381 PolarHBondContact O-N 3.15Å; D378-T381 PolarHBondContact O-OG1 2.95Å; T381-R383 VanDerWaalsContact C-N 3.34Å; T381-R383 PolarHBondContact O-N 3.31Å; T381-R384 PolarHBondContact O-N 3.27Å; T381-R384 WeakPolarHBondContact OG1-CB 3.49Å; T381-R384 PolarHBondContact OG1-N 2.77Å; T381-A385 PolarHBondContact O-N 3.36Å
382	R	86.7	Confident	79.4	Confident	3 Å²	3	37.6 Å²	37.6	1%	0.011	19%	0.192	C	C	.	.	H	α-helix	trans	-58.1	-45.1	177.4	-68.8	-178.1	179.6	-136.4	13.9	112.6	G305 E307 D311 V314 S315 N351 R384 A385 A386	G305-R382 VanDerWaalsContact O-CZ 3.31Å; G305-R382 PolarHBondContact O-NH1 3.39Å; G305-R382 PolarHBondContact O-NH2 2.91Å; E307-R382 PolarHBondContact O-NH2 2.76Å; D311-R382 WeakPolarHBondContact OD1-CD 3.28Å; D311-R382 IonicContact OD1-CZ 2.82Å; D311-R382 IonicContact OD1-NE 3.16Å; D311-R382 PolarHBondContact OD1-NE 2.93Å; D311-R382 IonicContact OD1-NH2 3.7Å; D311-R382 PolarHBondContact OD1-NH2 3.15Å; V314-R382 HydrophobicContact CB-CG 4.3Å; V314-R382 HydrophobicContact CG1-CG 3.93Å; S315-R382 PolarHBondContact OG-N 2.99Å; N351-R382 HydrophobicContact CB-CB 4.13Å; N351-R382 CarbonylContact O-C 3.31Å; N351-R382 VanDerWaalsContact OD1-CD 3.29Å; N351-R382 WeakPolarHBondContact OD1-CD 3.44Å; N351-R382 PolarHBondContact OD1-NH1 2.89Å; N351-R382 VanDerWaalsContact OD1-NH1 3.13Å; R382-R384 VanDerWaalsContact C-N 3.32Å; R382-R384 PolarHBondContact O-N 3.36Å; R382-A385 PolarHBondContact O-N 3.22Å; R382-A386 VanDerWaalsContact O-CB 3.3Å; R382-A386 WeakPolarHBondContact O-CB 3.25Å; R382-A386 PolarHBondContact O-N 3.12Å
383	R	88.3	Confident	79.8	Confident	20 Å²	20	32.6 Å²	32.6	8%	0.075	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-44.6	177.9	-76.1	-171.8	164.6	-146.2	-17	111.1	N351 M352 E353 F354 T381 A386 C387 D428 Y432	N351-R383 VanDerWaalsContact O-CA 3.31Å; N351-R383 WeakPolarHBondContact O-CA 3.4Å; N351-R383 WeakPolarHBondContact O-CG 3.24Å; N351-R383 PolarHBondContact O-N 3.37Å; M352-R383 PolarHBondContact O-NE 3.4Å; M352-R383 PolarHBondContact O-NH2 3.32Å; E353-R383 PolarHBondContact O-NE 3.07Å; E353-R383 PolarHBondContact O-NH2 3.42Å; E353-R383 VanDerWaalsContact O-NH2 3.11Å; F354-R383 VanDerWaalsContact CB-NH2 3.27Å; T381-R383 VanDerWaalsContact C-N 3.34Å; T381-R383 PolarHBondContact O-N 3.31Å; R383-A386 PolarHBondContact O-N 3.35Å; R383-C387 PolarHBondContact O-N 3.09Å; R383-C387 PolarHBondContact O-SG 3.35Å; R383-D428 IonicContact CZ-OD1 2.73Å; R383-D428 IonicContact CZ-OD2 2.8Å; R383-D428 IonicContact NH1-OD1 3.46Å; R383-D428 PolarHBondContact NH1-OD1 3.22Å; R383-D428 IonicContact NH1-OD2 2.71Å; R383-D428 IonicContact NH2-OD1 3.23Å; R383-D428 IonicContact NH2-OD2 2.7Å; R383-D428 PolarHBondContact NH2-OD2 3.32Å; R383-Y432 HydrophobicContact CB-CE1 3.73Å; R383-Y432 WeakPolarHBondContact CB-OH 3.26Å; R383-Y432 HydrophobicContact CG-CE1 4.2Å
384	R	84.2	Confident	80.1	Confident	56 Å²	56	32 Å²	32	21%	0.211	17%	0.171	C	C	.	.	H	α-helix	trans	-66.3	-48.2	178.1	178.9	59.3	-162	-143.6	2.1	112.3	D378 T381 R382 A386 C387 D388	D378-R384 HydrophobicContact CB-CB 4.33Å; D378-R384 WeakPolarHBondContact O-CB 3.47Å; D378-R384 WeakPolarHBondContact OD2-CB 3.49Å; D378-R384 VanDerWaalsContact OD2-CD 3.31Å; D378-R384 WeakPolarHBondContact OD2-CD 3.02Å; T381-R384 PolarHBondContact O-N 3.27Å; T381-R384 WeakPolarHBondContact OG1-CB 3.49Å; T381-R384 PolarHBondContact OG1-N 2.77Å; R382-R384 VanDerWaalsContact C-N 3.32Å; R382-R384 PolarHBondContact O-N 3.36Å; R384-A386 VanDerWaalsContact C-N 3.26Å; R384-A386 PolarHBondContact O-N 3.38Å; R384-C387 WeakPolarHBondContact O-CA 3.26Å; R384-C387 VanDerWaalsContact O-CB 3.29Å; R384-C387 WeakPolarHBondContact O-CB 3.34Å; R384-C387 PolarHBondContact O-N 3.15Å; R384-D388 IonicContact CZ-OD1 3.45Å; R384-D388 IonicContact CZ-OD2 3.65Å; R384-D388 IonicContact NE-OD1 2.77Å; R384-D388 PolarHBondContact NE-OD1 3.01Å; R384-D388 VanDerWaalsContact NE-OD1 3.12Å; R384-D388 IonicContact NE-OD2 3.41Å; R384-D388 PolarHBondContact NE-OD2 3.1Å; R384-D388 VanDerWaalsContact NE-OD2 3.08Å; R384-D388 IonicContact NH2-OD1 3.66Å; R384-D388 PolarHBondContact NH2-OD1 3.34Å; R384-D388 VanDerWaalsContact NH2-OD1 3.07Å; R384-D388 IonicContact NH2-OD2 3.69Å; R384-D388 PolarHBondContact O-N 3.26Å
385	A	88.4	Confident	80.5	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-42.2	177.7	0	0	0	0	0	110.7	I318 T381 R382 C387 D388 L389	I318-A385 HydrophobicContact CB-CB 3.76Å; I318-A385 HydrophobicContact CD1-CB 4.26Å; I318-A385 HydrophobicContact CG2-CB 3.67Å; I318-A385 WeakPolarHBondContact CG2-O 3.49Å; T381-A385 PolarHBondContact O-N 3.36Å; R382-A385 PolarHBondContact O-N 3.22Å; A385-C387 VanDerWaalsContact C-N 3.34Å; A385-C387 PolarHBondContact O-N 3.24Å; A385-D388 PolarHBondContact O-N 3.43Å; A385-L389 PolarHBondContact O-N 3.48Å
386	A	90.5	Very high	81.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-41	174	0	0	0	0	0	112.1	I348 N351 M352 R382 R383 R384 L389 V390	I348-A386 HydrophobicContact CG2-CB 4.39Å; N351-A386 HydrophobicContact CB-CB 4.2Å; M352-A386 HydrophobicContact CG-CB 3.74Å; M352-A386 HydrophobicContact SD-CB 4.44Å; R382-A386 VanDerWaalsContact O-CB 3.3Å; R382-A386 WeakPolarHBondContact O-CB 3.25Å; R382-A386 PolarHBondContact O-N 3.12Å; R383-A386 PolarHBondContact O-N 3.35Å; R384-A386 VanDerWaalsContact C-N 3.26Å; R384-A386 PolarHBondContact O-N 3.38Å; A386-L389 PolarHBondContact O-N 2.98Å; A386-V390 WeakPolarHBondContact O-CG2 3.41Å; A386-V390 PolarHBondContact O-N 2.82Å
387	C	87.1	Confident	83	Confident	9 Å²	9	34 Å²	34	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-61.8	-42.9	173.7	-65.3	0	0	0	0	112.8	R383 R384 A385 L389 V390 R391 Y432 S436	R383-C387 PolarHBondContact O-N 3.09Å; R383-C387 PolarHBondContact O-SG 3.35Å; R384-C387 WeakPolarHBondContact O-CA 3.26Å; R384-C387 VanDerWaalsContact O-CB 3.29Å; R384-C387 WeakPolarHBondContact O-CB 3.34Å; R384-C387 PolarHBondContact O-N 3.15Å; A385-C387 VanDerWaalsContact C-N 3.34Å; A385-C387 PolarHBondContact O-N 3.24Å; C387-L389 VanDerWaalsContact C-N 3.3Å; C387-V390 WeakPolarHBondContact O-CB 3.48Å; C387-V390 PolarHBondContact O-N 3.33Å; C387-R391 PolarHBondContact O-N 3.01Å; C387-Y432 WeakPolarHBondContact SG-CE1 3.15Å; C387-Y432 VanDerWaalsContact SG-CZ 3.58Å; C387-Y432 PolarHBondContact SG-OH 2.91Å; C387-Y432 VanDerWaalsContact SG-OH 3.42Å; C387-S436 PolarHBondContact SG-OG 3.19Å
388	D	87.2	Confident	84.7	Confident	34 Å²	34	34.3 Å²	34.3	18%	0.182	16%	0.164	C	C	.	.	H	α-helix	trans	-67.6	-34.9	179.2	-68.1	-23.8	0	0	0	110.8	R384 A385 R391 G392	R384-D388 IonicContact CZ-OD1 3.45Å; R384-D388 IonicContact CZ-OD2 3.65Å; R384-D388 IonicContact NE-OD1 2.77Å; R384-D388 PolarHBondContact NE-OD1 3.01Å; R384-D388 VanDerWaalsContact NE-OD1 3.12Å; R384-D388 IonicContact NE-OD2 3.41Å; R384-D388 PolarHBondContact NE-OD2 3.1Å; R384-D388 VanDerWaalsContact NE-OD2 3.08Å; R384-D388 IonicContact NH2-OD1 3.66Å; R384-D388 PolarHBondContact NH2-OD1 3.34Å; R384-D388 VanDerWaalsContact NH2-OD1 3.07Å; R384-D388 IonicContact NH2-OD2 3.69Å; R384-D388 PolarHBondContact O-N 3.26Å; A385-D388 PolarHBondContact O-N 3.43Å; D388-R391 PolarHBondContact O-N 3.44Å; D388-R391 IonicContact OD1-CZ 3.36Å; D388-R391 IonicContact OD1-NH1 2.79Å; D388-R391 PolarHBondContact OD1-NH1 3.28Å; D388-R391 IonicContact OD1-NH2 3.77Å; D388-R391 PolarHBondContact OD1-NH2 2.78Å; D388-R391 VanDerWaalsContact OD1-NH2 3.16Å; D388-G392 PolarHBondContact O-N 2.89Å
389	L	91.6	Very high	86.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-66.1	-41.7	170.6	-178.6	59.8	0	0	0	112.5	I318 L321 A322 I343 V347 I348 A385 A386 C387 R391 G392 L393	I318-L389 HydrophobicContact CG2-CB 3.75Å; I318-L389 HydrophobicContact CG2-CD2 4Å; I318-L389 HydrophobicContact CG2-CG 4.46Å; L321-L389 HydrophobicContact CB-CD1 4.07Å; A322-L389 HydrophobicContact CB-CB 4.28Å; A322-L389 HydrophobicContact CB-CD1 4.34Å; I343-L389 HydrophobicContact CG2-CD2 3.82Å; I343-L389 HydrophobicContact CG2-CG 4.44Å; V347-L389 HydrophobicContact CG1-CD2 4.15Å; I348-L389 HydrophobicContact CD1-CD2 4.03Å; I348-L389 HydrophobicContact CD1-CG 4.03Å; I348-L389 HydrophobicContact CG1-CD2 3.78Å; I348-L389 HydrophobicContact CG1-CG 4.23Å; A385-L389 PolarHBondContact O-N 3.48Å; A386-L389 PolarHBondContact O-N 2.98Å; C387-L389 VanDerWaalsContact C-N 3.3Å; L389-R391 VanDerWaalsContact C-N 3.28Å; L389-R391 PolarHBondContact O-N 3.12Å; L389-G392 PolarHBondContact O-N 3.1Å; L389-L393 HydrophobicContact CD1-CD1 4.4Å; L389-L393 HydrophobicContact CD1-CG 4.2Å; L389-L393 HydrophobicContact CG-CD1 4.27Å; L389-L393 HydrophobicContact CG-CG 4.5Å; L389-L393 WeakPolarHBondContact O-CB 3.38Å; L389-L393 WeakPolarHBondContact O-CG 3.3Å; L389-L393 PolarHBondContact O-N 3.1Å
390	V	91.7	Very high	87.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-56.8	-45.8	172.3	172.3	0	0	0	0	110.2	I348 A386 C387 L393 C394 F405	I348-V390 HydrophobicContact CD1-CG2 3.95Å; I348-V390 HydrophobicContact CG2-CG2 3.64Å; A386-V390 WeakPolarHBondContact O-CG2 3.41Å; A386-V390 PolarHBondContact O-N 2.82Å; C387-V390 WeakPolarHBondContact O-CB 3.48Å; C387-V390 PolarHBondContact O-N 3.33Å; V390-L393 PolarHBondContact O-N 2.85Å; V390-C394 WeakPolarHBondContact O-CB 3.45Å; V390-C394 PolarHBondContact O-N 3.33Å; V390-C394 PolarHBondContact O-SG 3.29Å; V390-F405 HydrophobicContact CB-CE2 4.5Å; V390-F405 HydrophobicContact CG1-CE2 4.08Å; V390-F405 HydrophobicContact CG2-CE2 3.76Å; V390-F405 HydrophobicContact CG2-CZ 3.92Å
391	R	87.6	Confident	89.2	Confident	74 Å²	74	28.7 Å²	28.7	28%	0.279	15%	0.147	S	C	.	.	H	α-helix	trans	-63.2	-45.2	178.7	-165.2	-176.7	-53.4	111.8	11.3	111.7	C387 D388 L389 C394 K395	C387-R391 PolarHBondContact O-N 3.01Å; D388-R391 PolarHBondContact O-N 3.44Å; D388-R391 IonicContact OD1-CZ 3.36Å; D388-R391 IonicContact OD1-NH1 2.79Å; D388-R391 PolarHBondContact OD1-NH1 3.28Å; D388-R391 IonicContact OD1-NH2 3.77Å; D388-R391 PolarHBondContact OD1-NH2 2.78Å; D388-R391 VanDerWaalsContact OD1-NH2 3.16Å; L389-R391 VanDerWaalsContact C-N 3.28Å; L389-R391 PolarHBondContact O-N 3.12Å; R391-C394 PolarHBondContact O-N 2.79Å; R391-K395 PolarHBondContact O-N 3.29Å
392	G	89.2	Confident	89.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.1	-45.1	177.2	0	0	0	0	0	112.5	C325 D388 L389 K395	C325-G392 WeakPolarHBondContact SG-CA 3.5Å; D388-G392 PolarHBondContact O-N 2.89Å; L389-G392 PolarHBondContact O-N 3.1Å; G392-K395 VanDerWaalsContact O-CB 3.22Å; G392-K395 WeakPolarHBondContact O-CB 3.38Å; G392-K395 PolarHBondContact O-N 2.85Å
393	L	91.9	Very high	90.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.1	-41.8	175.9	-68.9	173.4	0	0	0	112.3	C325 F334 L340 I343 I348 L389 V390 K395 F396 F397 V401	C325-L393 HydrophobicContact CB-CD2 4.03Å; F334-L393 HydrophobicContact CB-CD2 4.36Å; F334-L393 HydrophobicContact CD1-CD2 4.17Å; F334-L393 HydrophobicContact CG-CD2 4.4Å; L340-L393 HydrophobicContact CD2-CD2 3.98Å; I343-L393 HydrophobicContact CD1-CD2 4.47Å; I343-L393 HydrophobicContact CG2-CD1 3.82Å; I348-L393 HydrophobicContact CD1-CD1 3.77Å; L389-L393 HydrophobicContact CD1-CD1 4.4Å; L389-L393 HydrophobicContact CD1-CG 4.2Å; L389-L393 HydrophobicContact CG-CD1 4.27Å; L389-L393 HydrophobicContact CG-CG 4.5Å; L389-L393 WeakPolarHBondContact O-CB 3.38Å; L389-L393 WeakPolarHBondContact O-CG 3.3Å; L389-L393 PolarHBondContact O-N 3.1Å; V390-L393 PolarHBondContact O-N 2.85Å; L393-K395 PolarHBondContact O-N 3.2Å; L393-K395 VanDerWaalsContact O-N 3.15Å; L393-F396 PolarHBondContact O-N 2.88Å; L393-F397 WeakPolarHBondContact O-CB 3.2Å; L393-F397 WeakPolarHBondContact O-CD2 3.17Å; L393-F397 PolarHBondContact O-N 3.15Å; L393-V401 HydrophobicContact CB-CG2 3.99Å
394	C	91.1	Very high	90.3	Very high	21 Å²	21	29.8 Å²	29.8	14%	0.142	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-20	179.1	-71.5	0	0	0	0	112.9	V390 R391 F396 E398	V390-C394 WeakPolarHBondContact O-CB 3.45Å; V390-C394 PolarHBondContact O-N 3.33Å; V390-C394 PolarHBondContact O-SG 3.29Å; R391-C394 PolarHBondContact O-N 2.79Å; C394-F396 VanDerWaalsContact C-N 3.26Å; C394-F396 PolarHBondContact O-N 3.25Å; C394-E398 WeakPolarHBondContact O-CB 3.27Å; C394-E398 PolarHBondContact O-N 3.4Å
395	K	88.9	Confident	90.7	Very high	122 Å²	122	27.1 Å²	27.1	53%	0.53	16%	0.155	S	C	.	.	H	α-helix	trans	-57.1	-37	176.1	-169.2	178.4	-176.5	178.5	0	113.4	E326 R391 G392 L393	E326-K395 HydrophobicContact CB-CD 4.2Å; E326-K395 HydrophobicContact CG-CD 4.24Å; E326-K395 PolarHBondContact O-NZ 3.17Å; R391-K395 PolarHBondContact O-N 3.29Å; G392-K395 VanDerWaalsContact O-CB 3.22Å; G392-K395 WeakPolarHBondContact O-CB 3.38Å; G392-K395 PolarHBondContact O-N 2.85Å; L393-K395 PolarHBondContact O-N 3.2Å; L393-K395 VanDerWaalsContact O-N 3.15Å
396	F	91.1	Very high	90.9	Very high	66 Å²	66	29.2 Å²	29.2	29%	0.289	17%	0.169	S	C	.	.	H	α-helix	trans	-119.8	-17.9	-179.8	-58	-61.8	0	0	0	114	C325 E326 P328 K331 L393 C394	C325-F396 WeakPolarHBondContact O-CD2 3.43Å; C325-F396 VanDerWaalsContact O-CE2 3.3Å; C325-F396 WeakPolarHBondContact O-CE2 3.39Å; E326-F396 WeakPolarHBondContact O-CE2 3.4Å; P328-F396 HydrophobicContact CB-CE1 4.46Å; P328-F396 HydrophobicContact CB-CZ 4.12Å; P328-F396 HydrophobicContact CG-CE1 4.28Å; P328-F396 HydrophobicContact CG-CZ 3.76Å; K331-F396 HydrophobicContact CD-CB 4.4Å; K331-F396 HydrophobicContact CG-CB 4.3Å; L393-F396 PolarHBondContact O-N 2.88Å; C394-F396 VanDerWaalsContact C-N 3.26Å; C394-F396 PolarHBondContact O-N 3.25Å
397	F	92	Very high	91	Very high	12 Å²	12	31.2 Å²	31.2	5%	0.053	19%	0.19	C	C	.	.	H	α-helix	trans	-127.2	30.8	-172.1	-49.3	-71	0	0	0	112.4	K331 F334 E335 L340 L393 G399 P400 V401	K331-F397 HydrophobicContact CB-CZ 4.42Å; K331-F397 HydrophobicContact CD-CE1 4.41Å; K331-F397 HydrophobicContact CD-CZ 4.32Å; K331-F397 HydrophobicContact CG-CE1 3.86Å; K331-F397 HydrophobicContact CG-CE2 4.18Å; K331-F397 HydrophobicContact CG-CZ 3.33Å; K331-F397 WeakPolarHBondContact O-CZ 3.48Å; F334-F397 HydrophobicContact CB-CE2 3.71Å; F334-F397 HydrophobicContact CB-CZ 4.11Å; E335-F397 HydrophobicContact CB-CE1 3.89Å; E335-F397 HydrophobicContact CB-CZ 4.06Å; E335-F397 HydrophobicContact CG-CE1 4.05Å; L340-F397 HydrophobicContact CD1-CB 4.19Å; L340-F397 HydrophobicContact CD1-CD1 4.35Å; L340-F397 HydrophobicContact CD1-CG 4.23Å; L340-F397 HydrophobicContact CD2-CD2 4.21Å; L340-F397 HydrophobicContact CD2-CG 4.36Å; L393-F397 WeakPolarHBondContact O-CB 3.2Å; L393-F397 WeakPolarHBondContact O-CD2 3.17Å; L393-F397 PolarHBondContact O-N 3.15Å; F397-G399 VanDerWaalsContact C-N 3.32Å; F397-G399 PolarHBondContact O-N 2.85Å; F397-P400 WeakPolarHBondContact O-CD 3.29Å; F397-V401 HydrophobicContact CB-CG2 3.77Å; F397-V401 VanDerWaalsContact O-CB 3.28Å; F397-V401 WeakPolarHBondContact O-CB 3.41Å; F397-V401 WeakPolarHBondContact O-CG2 3.17Å; F397-V401 PolarHBondContact O-N 3.46Å
398	E	90.2	Very high	91.3	Very high	52 Å²	52	33.5 Å²	33.5	24%	0.243	20%	0.198	C	C	.	.	H	α-helix	trans	-46.7	-51.4	-177.5	-168.7	172.1	-170.4	0	0	112.5	C394 T402 K440 N452 L454	C394-E398 WeakPolarHBondContact O-CB 3.27Å; C394-E398 PolarHBondContact O-N 3.4Å; E398-T402 WeakPolarHBondContact O-CB 3.44Å; E398-T402 PolarHBondContact O-N 3.01Å; E398-T402 PolarHBondContact O-OG1 2.86Å; E398-K440 VanDerWaalsContact CD-NZ 3.27Å; E398-K440 WeakPolarHBondContact OE1-CE 3.25Å; E398-K440 IonicContact OE1-NZ 2.77Å; E398-K440 PolarHBondContact OE1-NZ 2.81Å; E398-K440 IonicContact OE2-NZ 3.25Å; E398-K440 PolarHBondContact OE2-NZ 2.99Å; E398-N452 PolarHBondContact OE1-ND2 3.26Å; E398-N452 PolarHBondContact OE1-OD1 3.24Å; E398-L454 HydrophobicContact CG-CD1 4.18Å
399	G	91.9	Very high	91.6	Very high	41 Å²	41	32.3 Å²	32.3	42%	0.423	19%	0.192	S	C	.	.	H	α-helix	trans	-60.9	-61.4	179.8	0	0	0	0	0	113.6	F397 V401 T402 G403	F397-G399 VanDerWaalsContact C-N 3.32Å; F397-G399 PolarHBondContact O-N 2.85Å; G399-V401 PolarHBondContact O-N 3.48Å; G399-T402 PolarHBondContact O-N 3.32Å; G399-G403 PolarHBondContact O-N 3.5Å
400	P	92.1	Very high	91.7	Very high	55 Å²	55	36.6 Å²	36.6	36%	0.357	22%	0.215	S	C	.	.	H	α-helix	trans	-55.1	-45.3	178.7	-28.6	35	0	0	0	113.9	L340 F397 G403 I404	L340-P400 HydrophobicContact CD1-CB 4.04Å; F397-P400 WeakPolarHBondContact O-CD 3.29Å; P400-G403 PolarHBondContact O-N 3.37Å; P400-I404 VanDerWaalsContact O-CG1 3.28Å; P400-I404 WeakPolarHBondContact O-CG1 3.3Å; P400-I404 PolarHBondContact O-N 2.94Å
401	V	91.8	Very high	91.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.5	-44.8	-179.1	174.9	0	0	0	0	110.9	L340 L393 F397 G399 G403 I404 F405	L340-V401 HydrophobicContact CD2-CG2 4.28Å; L393-V401 HydrophobicContact CB-CG2 3.99Å; F397-V401 HydrophobicContact CB-CG2 3.77Å; F397-V401 VanDerWaalsContact O-CB 3.28Å; F397-V401 WeakPolarHBondContact O-CB 3.41Å; F397-V401 WeakPolarHBondContact O-CG2 3.17Å; F397-V401 PolarHBondContact O-N 3.46Å; G399-V401 PolarHBondContact O-N 3.48Å; V401-G403 VanDerWaalsContact C-N 3.31Å; V401-G403 PolarHBondContact O-N 2.97Å; V401-I404 PolarHBondContact O-N 3.22Å; V401-F405 HydrophobicContact CG1-CD2 3.51Å; V401-F405 HydrophobicContact CG1-CE2 3.35Å; V401-F405 HydrophobicContact CG1-CZ 4.47Å; V401-F405 WeakPolarHBondContact O-CD2 3.5Å; V401-F405 PolarHBondContact O-N 3.37Å
402	T	91.9	Very high	92.3	Very high	8 Å²	8	36.9 Å²	36.9	5%	0.049	23%	0.226	C	C	.	.	H	α-helix	trans	-57.9	-43.7	173.4	-61.7	0	0	0	0	111.1	E398 G399 S406 L437 N452 L454	E398-T402 WeakPolarHBondContact O-CB 3.44Å; E398-T402 PolarHBondContact O-N 3.01Å; E398-T402 PolarHBondContact O-OG1 2.86Å; G399-T402 PolarHBondContact O-N 3.32Å; T402-S406 VanDerWaalsContact O-CB 3.27Å; T402-S406 WeakPolarHBondContact O-CB 3.4Å; T402-S406 PolarHBondContact O-N 2.89Å; T402-S406 PolarHBondContact O-OG 2.66Å; T402-L437 HydrophobicContact CG2-CD2 4.11Å; T402-N452 PolarHBondContact OG1-ND2 3.11Å; T402-L454 HydrophobicContact CG2-CB 3.83Å; T402-L454 HydrophobicContact CG2-CD1 4.08Å
403	G	92.9	Very high	92.7	Very high	47 Å²	47	37.7 Å²	37.7	49%	0.485	23%	0.23	S	C	.	.	H	α-helix	trans	-63.5	-45.3	178.8	0	0	0	0	0	113	G399 P400 V401 S406 G407	G399-G403 PolarHBondContact O-N 3.5Å; P400-G403 PolarHBondContact O-N 3.37Å; V401-G403 VanDerWaalsContact C-N 3.31Å; V401-G403 PolarHBondContact O-N 2.97Å; G403-S406 PolarHBondContact O-N 2.93Å; G403-G407 PolarHBondContact O-N 2.89Å
404	I	92.8	Very high	92.9	Very high	22 Å²	22	43.5 Å²	43.5	11%	0.113	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-52.9	176.3	-68.2	163.3	0	0	0	110.1	L340 C344 P400 V401 S406 G407 Y408	L340-I404 HydrophobicContact CB-CD1 3.95Å; C344-I404 HydrophobicContact CB-CG2 3.68Å; P400-I404 VanDerWaalsContact O-CG1 3.28Å; P400-I404 WeakPolarHBondContact O-CG1 3.3Å; P400-I404 PolarHBondContact O-N 2.94Å; V401-I404 PolarHBondContact O-N 3.22Å; I404-S406 PolarHBondContact O-N 3.39Å; I404-G407 PolarHBondContact O-N 3.01Å; I404-G407 VanDerWaalsContact O-N 3.15Å; I404-Y408 HydrophobicContact CG2-CD2 3.81Å; I404-Y408 HydrophobicContact CG2-CE2 3.47Å; I404-Y408 VanDerWaalsContact CG2-CE2 3.47Å; I404-Y408 VanDerWaalsContact O-CD2 3.26Å; I404-Y408 WeakPolarHBondContact O-CD2 3.39Å; I404-Y408 PolarHBondContact O-N 2.87Å
405	F	92.7	Very high	93.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.3	-32.2	-177.8	-72.1	-43.7	0	0	0	113.6	C344 I348 V349 V390 V401 G407 Y408 V409 L433 L437	C344-F405 HydrophobicContact CB-CD1 4.31Å; C344-F405 HydrophobicContact CB-CE1 3.56Å; C344-F405 HydrophobicContact CB-CZ 3.87Å; C344-F405 WeakPolarHBondContact SG-CZ 3.41Å; I348-F405 HydrophobicContact CB-CE1 4.4Å; I348-F405 HydrophobicContact CB-CZ 4.1Å; I348-F405 HydrophobicContact CD1-CE2 4.46Å; I348-F405 HydrophobicContact CD1-CZ 3.72Å; I348-F405 HydrophobicContact CG2-CE1 4.01Å; I348-F405 HydrophobicContact CG2-CZ 3.67Å; V349-F405 HydrophobicContact CG2-CE1 4.37Å; V390-F405 HydrophobicContact CB-CE2 4.5Å; V390-F405 HydrophobicContact CG1-CE2 4.08Å; V390-F405 HydrophobicContact CG2-CE2 3.76Å; V390-F405 HydrophobicContact CG2-CZ 3.92Å; V401-F405 HydrophobicContact CG1-CD2 3.51Å; V401-F405 HydrophobicContact CG1-CE2 3.35Å; V401-F405 HydrophobicContact CG1-CZ 4.47Å; V401-F405 WeakPolarHBondContact O-CD2 3.5Å; V401-F405 PolarHBondContact O-N 3.37Å; F405-G407 PolarHBondContact O-N 3.27Å; F405-Y408 HydrophobicContact CD1-CD2 4.27Å; F405-Y408 PolarHBondContact O-N 3.23Å; F405-Y408 VanDerWaalsContact O-N 3.16Å; F405-V409 WeakPolarHBondContact O-CB 3.46Å; F405-V409 VanDerWaalsContact O-CG2 3.25Å; F405-V409 WeakPolarHBondContact O-CG2 3.4Å; F405-V409 PolarHBondContact O-N 2.88Å; F405-L433 HydrophobicContact CB-CD1 4.25Å; F405-L433 HydrophobicContact CB-CD2 3.93Å; F405-L433 HydrophobicContact CB-CG 4.16Å; F405-L433 HydrophobicContact CD1-CD1 3.62Å; F405-L433 HydrophobicContact CD1-CD2 3.59Å; F405-L433 HydrophobicContact CD1-CG 4.11Å; F405-L433 HydrophobicContact CD2-CD1 3.98Å; F405-L433 HydrophobicContact CE1-CD1 3.82Å; F405-L433 HydrophobicContact CE1-CD2 4.35Å; F405-L433 HydrophobicContact CE2-CD1 4.17Å; F405-L433 HydrophobicContact CG-CD1 3.71Å; F405-L433 HydrophobicContact CG-CD2 3.97Å; F405-L433 HydrophobicContact CG-CG 4.13Å; F405-L433 HydrophobicContact CZ-CD1 4.1Å; F405-L437 HydrophobicContact CB-CD2 4.16Å; F405-L437 HydrophobicContact CD2-CD1 4.38Å
406	S	92.1	Very high	93.5	Very high	49 Å²	49	41.1 Å²	41.1	34%	0.343	25%	0.245	S	C	.	.	H	α-helix	trans	-58.8	-37.5	172.2	-62.6	0	0	0	0	111.7	T402 G403 I404 N410	T402-S406 VanDerWaalsContact O-CB 3.27Å; T402-S406 WeakPolarHBondContact O-CB 3.4Å; T402-S406 PolarHBondContact O-N 2.89Å; T402-S406 PolarHBondContact O-OG 2.66Å; G403-S406 PolarHBondContact O-N 2.93Å; I404-S406 PolarHBondContact O-N 3.39Å; S406-N410 WeakPolarHBondContact O-CB 2.79Å; S406-N410 VanDerWaalsContact O-CG 3.3Å; S406-N410 PolarHBondContact O-N 2.93Å; S406-N410 VanDerWaalsContact O-N 3.08Å; S406-N410 PolarHBondContact O-ND2 2.96Å
407	G	92.6	Very high	93.6	Very high	43 Å²	43	41.4 Å²	41.4	44%	0.443	26%	0.26	S	S	.	.	H	α-helix	trans	-62.6	-48	172.9	0	0	0	0	0	112.7	G403 I404 F405 N410 S411	G403-G407 PolarHBondContact O-N 2.89Å; I404-G407 PolarHBondContact O-N 3.01Å; I404-G407 VanDerWaalsContact O-N 3.15Å; F405-G407 PolarHBondContact O-N 3.27Å; G407-N410 PolarHBondContact O-N 3.46Å; G407-S411 PolarHBondContact O-N 2.77Å
408	Y	93	Very high	93.9	Very high	56 Å²	56	47.7 Å²	47.7	22%	0.22	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-45.1	177.6	-73.5	-67.9	0	0	0	112.7	C344 E345 V349 I404 F405 N410 S411 M412	C344-Y408 HydrophobicContact CB-CE2 4.47Å; E345-Y408 WeakPolarHBondContact CB-OH 3.29Å; E345-Y408 WeakPolarHBondContact CG-OH 3.27Å; V349-Y408 HydrophobicContact CG2-CG 4.42Å; I404-Y408 HydrophobicContact CG2-CD2 3.81Å; I404-Y408 HydrophobicContact CG2-CE2 3.47Å; I404-Y408 VanDerWaalsContact CG2-CE2 3.47Å; I404-Y408 VanDerWaalsContact O-CD2 3.26Å; I404-Y408 WeakPolarHBondContact O-CD2 3.39Å; I404-Y408 PolarHBondContact O-N 2.87Å; F405-Y408 HydrophobicContact CD1-CD2 4.27Å; F405-Y408 PolarHBondContact O-N 3.23Å; F405-Y408 VanDerWaalsContact O-N 3.16Å; Y408-N410 VanDerWaalsContact C-N 3.33Å; Y408-N410 PolarHBondContact O-N 3.29Å; Y408-S411 WeakPolarHBondContact O-CB 3.39Å; Y408-S411 PolarHBondContact O-N 2.72Å; Y408-S411 VanDerWaalsContact O-N 3.16Å; Y408-M412 WeakPolarHBondContact O-CB 3.16Å; Y408-M412 VanDerWaalsContact O-CG 3.31Å; Y408-M412 WeakPolarHBondContact O-CG 3.38Å; Y408-M412 PolarHBondContact O-N 3.27Å
409	V	94	Very high	94.1	Very high	9 Å²	9	48.3 Å²	48.3	6%	0.055	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-48.3	175.9	168.3	0	0	0	0	110.4	F405 S411 M412 L413 A430 L433 V434 F460	F405-V409 WeakPolarHBondContact O-CB 3.46Å; F405-V409 VanDerWaalsContact O-CG2 3.25Å; F405-V409 WeakPolarHBondContact O-CG2 3.4Å; F405-V409 PolarHBondContact O-N 2.88Å; V409-S411 PolarHBondContact O-N 3.01Å; V409-M412 PolarHBondContact O-N 2.89Å; V409-L413 HydrophobicContact CG1-CD1 3.75Å; V409-L413 HydrophobicContact CG1-CG 4.4Å; V409-L413 WeakPolarHBondContact O-CB 3.46Å; V409-L413 VanDerWaalsContact O-CG 3.24Å; V409-L413 WeakPolarHBondContact O-CG 3Å; V409-L413 PolarHBondContact O-N 3.21Å; V409-A430 HydrophobicContact CG1-CB 4.32Å; V409-L433 HydrophobicContact CG2-CB 4.3Å; V409-L433 HydrophobicContact CG2-CD2 3.74Å; V409-L433 HydrophobicContact CG2-CG 4.07Å; V409-V434 HydrophobicContact CB-CG2 4.41Å; V409-V434 HydrophobicContact CG1-CG2 3.77Å; V409-V434 HydrophobicContact CG2-CG2 3.73Å; V409-F460 HydrophobicContact CG1-CE2 4.39Å
410	N	95.1	Very high	94.2	Very high	92 Å²	92	48.7 Å²	48.7	49%	0.492	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-42.5	177.5	-76.6	-36.5	0	0	0	112.2	S406 G407 Y408 L413 Q414	S406-N410 WeakPolarHBondContact O-CB 2.79Å; S406-N410 VanDerWaalsContact O-CG 3.3Å; S406-N410 PolarHBondContact O-N 2.93Å; S406-N410 VanDerWaalsContact O-N 3.08Å; S406-N410 PolarHBondContact O-ND2 2.96Å; G407-N410 PolarHBondContact O-N 3.46Å; Y408-N410 VanDerWaalsContact C-N 3.33Å; Y408-N410 PolarHBondContact O-N 3.29Å; N410-L413 PolarHBondContact O-N 3.46Å; N410-Q414 WeakPolarHBondContact O-CB 3.36Å; N410-Q414 VanDerWaalsContact O-CG 3.24Å; N410-Q414 WeakPolarHBondContact O-CG 3.37Å; N410-Q414 PolarHBondContact O-N 3.05Å
411	S	95.7	Very high	94.2	Very high	60 Å²	60	49.8 Å²	49.8	42%	0.42	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-47.1	176.3	-170.2	0	0	0	0	111.6	G407 Y408 V409 L413 Q414 E415	G407-S411 PolarHBondContact O-N 2.77Å; Y408-S411 WeakPolarHBondContact O-CB 3.39Å; Y408-S411 PolarHBondContact O-N 2.72Å; Y408-S411 VanDerWaalsContact O-N 3.16Å; V409-S411 PolarHBondContact O-N 3.01Å; S411-L413 PolarHBondContact O-N 3.34Å; S411-Q414 PolarHBondContact O-N 2.68Å; S411-E415 WeakPolarHBondContact O-CG 3.36Å; S411-E415 PolarHBondContact O-N 2.93Å
412	M	95.6	Very high	94.4	Very high	19 Å²	19	54.3 Å²	54.3	9%	0.094	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-43.1	179	-75.2	-179.5	134.4	0	0	112.2	V349 Y408 V409 Q414 E415 Y416 H426 A429 A430	V349-M412 HydrophobicContact CG1-CE 4.31Å; Y408-M412 WeakPolarHBondContact O-CB 3.16Å; Y408-M412 VanDerWaalsContact O-CG 3.31Å; Y408-M412 WeakPolarHBondContact O-CG 3.38Å; Y408-M412 PolarHBondContact O-N 3.27Å; V409-M412 PolarHBondContact O-N 2.89Å; M412-Q414 VanDerWaalsContact C-N 3.33Å; M412-Q414 PolarHBondContact O-N 3.25Å; M412-E415 PolarHBondContact O-N 3.33Å; M412-Y416 WeakPolarHBondContact O-CB 3.34Å; M412-Y416 PolarHBondContact O-N 3.38Å; M412-H426 HydrophobicContact CB-CB 4.09Å; M412-H426 WeakPolarHBondContact CB-O 3.26Å; M412-H426 HydrophobicContact CG-CB 4.47Å; M412-H426 WeakPolarHBondContact O-CB 3.27Å; M412-A429 HydrophobicContact CE-CB 3.33Å; M412-A429 HydrophobicContact SD-CB 3.92Å; M412-A430 HydrophobicContact CB-CB 4Å; M412-A430 HydrophobicContact SD-CB 4.42Å
413	L	96.3	Very high	94.5	Very high	17 Å²	17	55.4 Å²	55.4	9%	0.089	33%	0.329	C	S	.	.	H	α-helix	trans	-67	-33.8	176.5	-68.4	171	0	0	0	112.4	V409 N410 S411 A417 K427 A430 F460	V409-L413 HydrophobicContact CG1-CD1 3.75Å; V409-L413 HydrophobicContact CG1-CG 4.4Å; V409-L413 WeakPolarHBondContact O-CB 3.46Å; V409-L413 VanDerWaalsContact O-CG 3.24Å; V409-L413 WeakPolarHBondContact O-CG 3Å; V409-L413 PolarHBondContact O-N 3.21Å; N410-L413 PolarHBondContact O-N 3.46Å; S411-L413 PolarHBondContact O-N 3.34Å; L413-A417 WeakPolarHBondContact O-CB 3.25Å; L413-A417 PolarHBondContact O-N 2.89Å; L413-K427 HydrophobicContact CD2-CG 4.06Å; L413-A430 HydrophobicContact CD2-CB 4.04Å; L413-A430 HydrophobicContact CG-CB 4.04Å; L413-F460 HydrophobicContact CD1-CE2 4.3Å
414	Q	96.9	Very high	94.6	Very high	122 Å²	122	54.9 Å²	54.9	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-68.4	-43	173	-75.1	174.8	12.6	0	0	112	N410 S411 M412 Y416 A417 K418	N410-Q414 WeakPolarHBondContact O-CB 3.36Å; N410-Q414 VanDerWaalsContact O-CG 3.24Å; N410-Q414 WeakPolarHBondContact O-CG 3.37Å; N410-Q414 PolarHBondContact O-N 3.05Å; S411-Q414 PolarHBondContact O-N 2.68Å; M412-Q414 VanDerWaalsContact C-N 3.33Å; M412-Q414 PolarHBondContact O-N 3.25Å; Q414-Y416 VanDerWaalsContact C-N 3.33Å; Q414-A417 PolarHBondContact O-N 3.09Å; Q414-K418 WeakPolarHBondContact O-CG 3.25Å; Q414-K418 PolarHBondContact O-N 2.77Å
415	E	96	Very high	94.8	Very high	59 Å²	59	57 Å²	57	28%	0.276	32%	0.32	S	S	.	.	H	α-helix	trans	-62.1	-42	174.5	-70.3	-51.1	139.8	0	0	111.6	S411 M412 A417 K418 N423	S411-E415 WeakPolarHBondContact O-CG 3.36Å; S411-E415 PolarHBondContact O-N 2.93Å; M412-E415 PolarHBondContact O-N 3.33Å; E415-A417 PolarHBondContact O-N 3.31Å; E415-K418 PolarHBondContact O-N 2.93Å; E415-K418 IonicContact OE1-NZ 3.89Å; E415-K418 PolarHBondContact OE1-NZ 2.89Å; E415-K418 WeakPolarHBondContact OE2-CD 3.22Å; E415-K418 IonicContact OE2-NZ 3.96Å; E415-K418 PolarHBondContact OE2-NZ 3.46Å; E415-K418 VanDerWaalsContact OE2-NZ 3.09Å; E415-N423 WeakPolarHBondContact O-CB 3.25Å; E415-N423 PolarHBondContact O-ND2 2.87Å
416	Y	96	Very high	94.9	Very high	35 Å²	35	60.1 Å²	60.1	14%	0.137	34%	0.335	C	S	.	.	H	α-helix	trans	-55.7	-48.7	171.6	169.2	-103.8	0	0	0	112	M412 Q414 K418 N419 P420 W424 K427 L480	M412-Y416 WeakPolarHBondContact O-CB 3.34Å; M412-Y416 PolarHBondContact O-N 3.38Å; Q414-Y416 VanDerWaalsContact C-N 3.33Å; Y416-K418 PolarHBondContact O-N 3.28Å; Y416-N419 CarbonylContact O-C 3.33Å; Y416-N419 VanDerWaalsContact O-C 3.31Å; Y416-N419 PolarHBondContact O-N 3.2Å; Y416-P420 HydrophobicContact CD2-CB 4.3Å; Y416-P420 HydrophobicContact CE2-CB 3.68Å; Y416-P420 HydrophobicContact CE2-CG 4.4Å; Y416-P420 WeakPolarHBondContact O-CA 3.25Å; Y416-P420 WeakPolarHBondContact O-CD 3.2Å; Y416-P420 VanDerWaalsContact O-N 3.12Å; Y416-W424 HydrophobicContact CE2-CB 4.4Å; Y416-K427 HydrophobicContact CD1-CB 4.24Å; Y416-K427 HydrophobicContact CD1-CD 3.71Å; Y416-K427 HydrophobicContact CD1-CG 4.47Å; Y416-K427 HydrophobicContact CD2-CB 3.73Å; Y416-K427 HydrophobicContact CD2-CD 4.19Å; Y416-K427 HydrophobicContact CE1-CD 3.48Å; Y416-K427 VanDerWaalsContact CE1-CD 3.48Å; Y416-K427 HydrophobicContact CE2-CB 4.19Å; Y416-K427 HydrophobicContact CE2-CD 3.98Å; Y416-K427 HydrophobicContact CG-CB 3.73Å; Y416-K427 HydrophobicContact CG-CD 4.04Å; Y416-K427 HydrophobicContact CG-CG 4.43Å; Y416-L480 HydrophobicContact CE2-CD1 3.91Å
417	A	95	Very high	95.1	Very high	72 Å²	72	58.1 Å²	58.1	60%	0.595	32%	0.32	S	S	*	.	H	α-helix	trans	-62.7	-25	-177.8	0	0	0	0	0	113.8	L413 Q414 E415	L413-A417 WeakPolarHBondContact O-CB 3.25Å; L413-A417 PolarHBondContact O-N 2.89Å; Q414-A417 PolarHBondContact O-N 3.09Å; E415-A417 PolarHBondContact O-N 3.31Å
418	K	96.7	Very high	95.3	Very high	143 Å²	143	56 Å²	56	62%	0.622	30%	0.299	S	S	*	.	H	α-helix	trans	-68.9	-40	176.3	-69.3	173.9	-169.3	171.8	0	112.6	Q414 E415 Y416	Q414-K418 WeakPolarHBondContact O-CG 3.25Å; Q414-K418 PolarHBondContact O-N 2.77Å; E415-K418 PolarHBondContact O-N 2.93Å; E415-K418 IonicContact OE1-NZ 3.89Å; E415-K418 PolarHBondContact OE1-NZ 2.89Å; E415-K418 WeakPolarHBondContact OE2-CD 3.22Å; E415-K418 IonicContact OE2-NZ 3.96Å; E415-K418 PolarHBondContact OE2-NZ 3.46Å; E415-K418 VanDerWaalsContact OE2-NZ 3.09Å; Y416-K418 PolarHBondContact O-N 3.28Å
419	N	95.6	Very high	95.3	Very high	66 Å²	66	53.5 Å²	53.5	35%	0.353	29%	0.29	S	S	.	.			trans	-155	83.5	-179.9	-170.2	-1.7	0	0	0	111.4	Y416 S421 V422 N423	Y416-N419 CarbonylContact O-C 3.33Å; Y416-N419 VanDerWaalsContact O-C 3.31Å; Y416-N419 PolarHBondContact O-N 3.2Å; N419-S421 PolarHBondContact O-N 2.96Å; N419-S421 VanDerWaalsContact O-N 3.15Å; N419-S421 PolarHBondContact OD1-OG 2.94Å; N419-V422 VanDerWaalsContact ND2-CG2 3.32Å; N419-V422 WeakPolarHBondContact ND2-CG2 3.47Å; N419-V422 PolarHBondContact O-N 3.2Å; N419-N423 WeakPolarHBondContact O-CB 3.47Å; N419-N423 PolarHBondContact O-N 3.28Å
420	P	93.9	Very high	95.4	Very high	48 Å²	48	53.1 Å²	53.1	31%	0.312	29%	0.287	S	S	.	.	H	α-helix	trans	-55.8	-34.8	-175.1	-30.7	37.3	0	0	0	114.5	Y416 V422 W424 F477	Y416-P420 HydrophobicContact CD2-CB 4.3Å; Y416-P420 HydrophobicContact CE2-CB 3.68Å; Y416-P420 HydrophobicContact CE2-CG 4.4Å; Y416-P420 WeakPolarHBondContact O-CA 3.25Å; Y416-P420 WeakPolarHBondContact O-CD 3.2Å; Y416-P420 VanDerWaalsContact O-N 3.12Å; P420-V422 VanDerWaalsContact C-N 3.32Å; P420-V422 PolarHBondContact O-N 3.36Å; P420-W424 WeakPolarHBondContact O-CB 3.2Å; P420-W424 PolarHBondContact O-N 3.28Å; P420-F477 HydrophobicContact CB-CE2 4.5Å; P420-F477 HydrophobicContact CB-CZ 4.35Å
421	S	92.6	Very high	95.3	Very high	78 Å²	78	48.9 Å²	48.9	55%	0.545	26%	0.264	S	S	.	.	H	α-helix	trans	-69.5	-28.7	-176.7	61.4	0	0	0	0	113.8	N419	N419-S421 PolarHBondContact O-N 2.96Å; N419-S421 VanDerWaalsContact O-N 3.15Å; N419-S421 PolarHBondContact OD1-OG 2.94Å
422	V	94.1	Very high	95.1	Very high	96 Å²	96	47 Å²	47	58%	0.582	25%	0.248	S	C	*	.	H	α-helix	trans	-98.8	-38	178.9	178.8	0	0	0	0	111.1	N419 P420	N419-V422 VanDerWaalsContact ND2-CG2 3.32Å; N419-V422 WeakPolarHBondContact ND2-CG2 3.47Å; N419-V422 PolarHBondContact O-N 3.2Å; P420-V422 VanDerWaalsContact C-N 3.32Å; P420-V422 PolarHBondContact O-N 3.36Å
423	N	95.4	Very high	94.9	Very high	30 Å²	30	46.2 Å²	46.2	16%	0.16	24%	0.244	C	C	.	.	H	α-helix	trans	-99.4	15.3	-168.9	-65.4	-14.9	0	0	0	113.6	E415 N419 K425 H426	E415-N423 WeakPolarHBondContact O-CB 3.25Å; E415-N423 PolarHBondContact O-ND2 2.87Å; N419-N423 WeakPolarHBondContact O-CB 3.47Å; N419-N423 PolarHBondContact O-N 3.28Å; N423-K425 PolarHBondContact O-N 3.04Å; N423-H426 WeakPolarHBondContact O-CB 3.38Å; N423-H426 PolarHBondContact O-N 2.9Å; N423-H426 PolarHBondContact O-ND1 3.1Å
424	W	95.6	Very high	94.8	Very high	36 Å²	36	45.7 Å²	45.7	14%	0.136	24%	0.242	C	C	.	.	H	α-helix	trans	-55.2	-34	179	67.8	-96.5	0	0	0	113.1	F354 Y416 P420 H426 K427 D428 F477 V479 L480	F354-W424 AromaticContact CD1-CH2 3.69Å; F354-W424 HydrophobicContact CD1-CH2 3.69Å; F354-W424 HydrophobicContact CD1-CZ3 4.14Å; F354-W424 AromaticContact CE1-CH2 3.89Å; F354-W424 HydrophobicContact CE1-CH2 3.89Å; F354-W424 HydrophobicContact CE1-CZ3 4.44Å; F354-W424 HydrophobicContact CG-CH2 4.38Å; F354-W424 HydrophobicContact CG-CZ3 4.4Å; Y416-W424 HydrophobicContact CE2-CB 4.4Å; P420-W424 WeakPolarHBondContact O-CB 3.2Å; P420-W424 PolarHBondContact O-N 3.28Å; W424-H426 PolarHBondContact O-N 3.31Å; W424-K427 WeakPolarHBondContact O-CA 3.3Å; W424-K427 WeakPolarHBondContact O-CB 3.32Å; W424-K427 PolarHBondContact O-N 2.91Å; W424-D428 PolarHBondContact O-N 3.33Å; W424-D428 VanDerWaalsContact O-N 3.15Å; W424-F477 HydrophobicContact CB-CD1 4.01Å; W424-F477 HydrophobicContact CB-CE1 4.37Å; W424-F477 HydrophobicContact CG-CD1 4.21Å; W424-V479 HydrophobicContact CE3-CB 4.29Å; W424-V479 HydrophobicContact CH2-CB 4.19Å; W424-V479 HydrophobicContact CH2-CG2 3.85Å; W424-V479 HydrophobicContact CZ3-CB 3.6Å; W424-V479 HydrophobicContact CZ3-CG1 3.79Å; W424-V479 HydrophobicContact CZ3-CG2 3.8Å; W424-L480 HydrophobicContact CB-CD1 3.91Å; W424-L480 HydrophobicContact CB-CG 4.44Å
425	K	95.4	Very high	94.4	Very high	66 Å²	66	40.9 Å²	40.9	29%	0.287	22%	0.221	S	C	.	.	H	α-helix	trans	-58.9	-29.4	176.5	-65.7	-172.5	176.4	-166.6	0	113.5	F354 E359 N423 K427 D428 A429	F354-K425 HydrophobicContact CB-CD 4.49Å; F354-K425 HydrophobicContact CB-CG 4.38Å; E359-K425 WeakPolarHBondContact OE2-CE 3.38Å; E359-K425 IonicContact OE2-NZ 3.59Å; E359-K425 PolarHBondContact OE2-NZ 2.94Å; N423-K425 PolarHBondContact O-N 3.04Å; K425-K427 VanDerWaalsContact C-N 3.32Å; K425-D428 PolarHBondContact O-N 3.15Å; K425-A429 WeakPolarHBondContact O-CB 3.35Å; K425-A429 PolarHBondContact O-N 2.67Å
426	H	95.8	Very high	94.1	Very high	66 Å²	66	38.7 Å²	38.7	31%	0.306	21%	0.212	S	C	.	.	H	α-helix	trans	-67.1	-36.8	174.2	-66.5	81.7	0	0	0	111.2	M412 N423 W424 A430	M412-H426 HydrophobicContact CB-CB 4.09Å; M412-H426 WeakPolarHBondContact CB-O 3.26Å; M412-H426 HydrophobicContact CG-CB 4.47Å; M412-H426 WeakPolarHBondContact O-CB 3.27Å; N423-H426 WeakPolarHBondContact O-CB 3.38Å; N423-H426 PolarHBondContact O-N 2.9Å; N423-H426 PolarHBondContact O-ND1 3.1Å; W424-H426 PolarHBondContact O-N 3.31Å; H426-A430 WeakPolarHBondContact O-CB 3.42Å; H426-A430 PolarHBondContact O-N 2.73Å
427	K	96.9	Very high	93.8	Very high	7 Å²	7	37.4 Å²	37.4	3%	0.03	21%	0.208	C	C	.	.	H	α-helix	trans	-71.9	-38.9	177.5	-175.3	170.3	177.5	-175.1	0	112.1	L413 Y416 W424 K425 A430 I431 H464 D468 L480	L413-K427 HydrophobicContact CD2-CG 4.06Å; Y416-K427 HydrophobicContact CD1-CB 4.24Å; Y416-K427 HydrophobicContact CD1-CD 3.71Å; Y416-K427 HydrophobicContact CD1-CG 4.47Å; Y416-K427 HydrophobicContact CD2-CB 3.73Å; Y416-K427 HydrophobicContact CD2-CD 4.19Å; Y416-K427 HydrophobicContact CE1-CD 3.48Å; Y416-K427 VanDerWaalsContact CE1-CD 3.48Å; Y416-K427 HydrophobicContact CE2-CB 4.19Å; Y416-K427 HydrophobicContact CE2-CD 3.98Å; Y416-K427 HydrophobicContact CG-CB 3.73Å; Y416-K427 HydrophobicContact CG-CD 4.04Å; Y416-K427 HydrophobicContact CG-CG 4.43Å; W424-K427 WeakPolarHBondContact O-CA 3.3Å; W424-K427 WeakPolarHBondContact O-CB 3.32Å; W424-K427 PolarHBondContact O-N 2.91Å; K425-K427 VanDerWaalsContact C-N 3.32Å; K427-A430 PolarHBondContact O-N 3.29Å; K427-I431 HydrophobicContact CG-CD1 4.01Å; K427-I431 HydrophobicContact CG-CG1 4.43Å; K427-I431 VanDerWaalsContact O-CG1 3.28Å; K427-I431 WeakPolarHBondContact O-CG1 3.31Å; K427-I431 PolarHBondContact O-N 2.93Å; K427-H464 VanDerWaalsContact CE-O 3.28Å; K427-H464 WeakPolarHBondContact CE-O 3.41Å; K427-H464 PolarHBondContact NZ-O 3.42Å; K427-D468 WeakPolarHBondContact CE-OD2 3.4Å; K427-D468 IonicContact NZ-OD1 2.67Å; K427-D468 PolarHBondContact NZ-OD1 3.29Å; K427-D468 IonicContact NZ-OD2 3.4Å; K427-D468 PolarHBondContact NZ-OD2 3.02Å; K427-L480 HydrophobicContact CB-CD1 4.32Å; K427-L480 HydrophobicContact CB-CD2 3.88Å; K427-L480 HydrophobicContact CD-CD1 4.04Å; K427-L480 HydrophobicContact CD-CD2 4.39Å; K427-L480 HydrophobicContact CG-CD1 4.43Å; K427-L480 HydrophobicContact CG-CD2 3.96Å
428	D	95.7	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56	-53.9	171.1	153.4	93.8	0	0	0	110	F354 R383 W424 K425 A430 I431 Y432 V479 L480 D483	F354-D428 WeakPolarHBondContact CB-OD2 3.43Å; R383-D428 IonicContact CZ-OD1 2.73Å; R383-D428 IonicContact CZ-OD2 2.8Å; R383-D428 IonicContact NH1-OD1 3.46Å; R383-D428 PolarHBondContact NH1-OD1 3.22Å; R383-D428 IonicContact NH1-OD2 2.71Å; R383-D428 IonicContact NH2-OD1 3.23Å; R383-D428 IonicContact NH2-OD2 2.7Å; R383-D428 PolarHBondContact NH2-OD2 3.32Å; W424-D428 PolarHBondContact O-N 3.33Å; W424-D428 VanDerWaalsContact O-N 3.15Å; K425-D428 PolarHBondContact O-N 3.15Å; D428-A430 VanDerWaalsContact C-N 3.26Å; D428-A430 PolarHBondContact O-N 3.47Å; D428-I431 PolarHBondContact O-N 3.46Å; D428-Y432 WeakPolarHBondContact O-CB 3.38Å; D428-Y432 PolarHBondContact O-N 3.35Å; D428-V479 HydrophobicContact CB-CG1 4.32Å; D428-L480 HydrophobicContact CB-CD2 4.05Å; D428-D483 WeakPolarHBondContact CA-OD2 3.48Å; D428-D483 WeakPolarHBondContact CB-OD2 3.28Å
429	A	93.3	Very high	93.1	Very high	3 Å²	3	27.7 Å²	27.7	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-36.3	-178.8	0	0	0	0	0	112.1	M412 K425 L433	M412-A429 HydrophobicContact CE-CB 3.33Å; M412-A429 HydrophobicContact SD-CB 3.92Å; K425-A429 WeakPolarHBondContact O-CB 3.35Å; K425-A429 PolarHBondContact O-N 2.67Å; A429-L433 WeakPolarHBondContact O-CB 3.5Å; A429-L433 PolarHBondContact O-N 3.39Å
430	A	95	Very high	92.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.6	-44.1	173.2	0	0	0	0	0	112.5	V409 M412 L413 H426 K427 D428 L433 V434	V409-A430 HydrophobicContact CG1-CB 4.32Å; M412-A430 HydrophobicContact CB-CB 4Å; M412-A430 HydrophobicContact SD-CB 4.42Å; L413-A430 HydrophobicContact CD2-CB 4.04Å; L413-A430 HydrophobicContact CG-CB 4.04Å; H426-A430 WeakPolarHBondContact O-CB 3.42Å; H426-A430 PolarHBondContact O-N 2.73Å; K427-A430 PolarHBondContact O-N 3.29Å; D428-A430 VanDerWaalsContact C-N 3.26Å; D428-A430 PolarHBondContact O-N 3.47Å; A430-L433 PolarHBondContact O-N 3.28Å; A430-V434 WeakPolarHBondContact O-CB 3.04Å; A430-V434 VanDerWaalsContact O-CG2 3.32Å; A430-V434 WeakPolarHBondContact O-CG2 3.34Å; A430-V434 PolarHBondContact O-N 2.94Å
431	I	94.6	Very high	92.1	Very high	3 Å²	3	28 Å²	28	2%	0.015	15%	0.152	C	C	.	.	H	α-helix	trans	-65.1	-43.7	177.1	-66	164.5	0	0	0	110.4	K427 D428 V434 T435 F460 I465 L480 D483 Y487	K427-I431 HydrophobicContact CG-CD1 4.01Å; K427-I431 HydrophobicContact CG-CG1 4.43Å; K427-I431 VanDerWaalsContact O-CG1 3.28Å; K427-I431 WeakPolarHBondContact O-CG1 3.31Å; K427-I431 PolarHBondContact O-N 2.93Å; D428-I431 PolarHBondContact O-N 3.46Å; I431-V434 PolarHBondContact O-N 3.5Å; I431-T435 WeakPolarHBondContact O-CB 3.24Å; I431-T435 PolarHBondContact O-N 3.32Å; I431-T435 PolarHBondContact O-OG1 3.41Å; I431-F460 HydrophobicContact CG1-CE1 4.17Å; I431-F460 HydrophobicContact CG1-CZ 4.11Å; I431-I465 HydrophobicContact CD1-CD1 3.89Å; I431-I465 HydrophobicContact CG1-CD1 3.95Å; I431-I465 HydrophobicContact CG2-CD1 4.13Å; I431-L480 HydrophobicContact CD1-CD2 4.43Å; I431-D483 HydrophobicContact CB-CB 4.44Å; I431-D483 HydrophobicContact CD1-CB 3.91Å; I431-D483 HydrophobicContact CG2-CB 4Å; I431-Y487 HydrophobicContact CG2-CD2 4.49Å
432	Y	91.2	Very high	91.7	Very high	21 Å²	21	28.5 Å²	28.5	8%	0.082	15%	0.146	C	C	.	.	H	α-helix	trans	-61.2	-47	178.1	-159.9	-103.1	0	0	0	110.4	M352 R383 C387 D428 V434 T435 S436	M352-Y432 HydrophobicContact CB-CD1 4.26Å; M352-Y432 HydrophobicContact CE-CD1 3.29Å; M352-Y432 HydrophobicContact CE-CE1 3.79Å; M352-Y432 HydrophobicContact CE-CG 4.3Å; M352-Y432 HydrophobicContact CG-CD1 4.16Å; M352-Y432 HydrophobicContact CG-CE1 4.38Å; R383-Y432 HydrophobicContact CB-CE1 3.73Å; R383-Y432 WeakPolarHBondContact CB-OH 3.26Å; R383-Y432 HydrophobicContact CG-CE1 4.2Å; C387-Y432 WeakPolarHBondContact SG-CE1 3.15Å; C387-Y432 VanDerWaalsContact SG-CZ 3.58Å; C387-Y432 PolarHBondContact SG-OH 2.91Å; C387-Y432 VanDerWaalsContact SG-OH 3.42Å; D428-Y432 WeakPolarHBondContact O-CB 3.38Å; D428-Y432 PolarHBondContact O-N 3.35Å; Y432-V434 PolarHBondContact O-N 3.45Å; Y432-T435 WeakPolarHBondContact O-CB 3.45Å; Y432-T435 PolarHBondContact O-N 3.46Å; Y432-S436 PolarHBondContact O-N 3.47Å; Y432-S436 PolarHBondContact O-OG 3.35Å
433	L	91.5	Very high	91	Very high	2 Å²	2	27 Å²	27	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-44.5	177.7	-176.1	58.7	0	0	0	113.5	M352 F405 V409 A429 A430 T435 S436 L437	M352-L433 HydrophobicContact CE-CB 4.09Å; M352-L433 HydrophobicContact CE-CD1 3.91Å; M352-L433 HydrophobicContact SD-CD1 3.74Å; F405-L433 HydrophobicContact CB-CD1 4.25Å; F405-L433 HydrophobicContact CB-CD2 3.93Å; F405-L433 HydrophobicContact CB-CG 4.16Å; F405-L433 HydrophobicContact CD1-CD1 3.62Å; F405-L433 HydrophobicContact CD1-CD2 3.59Å; F405-L433 HydrophobicContact CD1-CG 4.11Å; F405-L433 HydrophobicContact CD2-CD1 3.98Å; F405-L433 HydrophobicContact CE1-CD1 3.82Å; F405-L433 HydrophobicContact CE1-CD2 4.35Å; F405-L433 HydrophobicContact CE2-CD1 4.17Å; F405-L433 HydrophobicContact CG-CD1 3.71Å; F405-L433 HydrophobicContact CG-CD2 3.97Å; F405-L433 HydrophobicContact CG-CG 4.13Å; F405-L433 HydrophobicContact CZ-CD1 4.1Å; V409-L433 HydrophobicContact CG2-CB 4.3Å; V409-L433 HydrophobicContact CG2-CD2 3.74Å; V409-L433 HydrophobicContact CG2-CG 4.07Å; A429-L433 WeakPolarHBondContact O-CB 3.5Å; A429-L433 PolarHBondContact O-N 3.39Å; A430-L433 PolarHBondContact O-N 3.28Å; L433-T435 VanDerWaalsContact C-N 3.3Å; L433-T435 PolarHBondContact O-N 3.15Å; L433-S436 PolarHBondContact O-N 3.12Å; L433-L437 WeakPolarHBondContact O-CB 3.24Å; L433-L437 PolarHBondContact O-N 3.11Å
434	V	92.8	Very high	90	Very high	7 Å²	7	33.3 Å²	33.3	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-62.1	-40.5	174.4	168.6	0	0	0	0	111	V409 A430 I431 Y432 L437 A438 V455 F460	V409-V434 HydrophobicContact CB-CG2 4.41Å; V409-V434 HydrophobicContact CG1-CG2 3.77Å; V409-V434 HydrophobicContact CG2-CG2 3.73Å; A430-V434 WeakPolarHBondContact O-CB 3.04Å; A430-V434 VanDerWaalsContact O-CG2 3.32Å; A430-V434 WeakPolarHBondContact O-CG2 3.34Å; A430-V434 PolarHBondContact O-N 2.94Å; I431-V434 PolarHBondContact O-N 3.5Å; Y432-V434 PolarHBondContact O-N 3.45Å; V434-L437 PolarHBondContact O-N 2.77Å; V434-A438 WeakPolarHBondContact O-CB 3.46Å; V434-A438 PolarHBondContact O-N 2.89Å; V434-V455 HydrophobicContact CG1-CG1 3.99Å; V434-F460 HydrophobicContact CB-CE1 4.22Å; V434-F460 HydrophobicContact CB-CE2 4.22Å; V434-F460 HydrophobicContact CB-CZ 3.99Å; V434-F460 HydrophobicContact CG1-CD1 3.94Å; V434-F460 HydrophobicContact CG1-CD2 4.13Å; V434-F460 HydrophobicContact CG1-CE1 3.98Å; V434-F460 HydrophobicContact CG1-CE2 4.2Å; V434-F460 HydrophobicContact CG1-CG 4Å; V434-F460 HydrophobicContact CG1-CZ 4.12Å; V434-F460 HydrophobicContact CG2-CD2 4.15Å; V434-F460 HydrophobicContact CG2-CE2 3.64Å; V434-F460 HydrophobicContact CG2-CZ 3.84Å
435	T	90.3	Very high	89.1	Confident	20 Å²	20	39.5 Å²	39.5	12%	0.123	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-44.4	178.4	-59.7	0	0	0	0	111.3	I431 Y432 L433 S439 I490 F491	I431-T435 WeakPolarHBondContact O-CB 3.24Å; I431-T435 PolarHBondContact O-N 3.32Å; I431-T435 PolarHBondContact O-OG1 3.41Å; Y432-T435 WeakPolarHBondContact O-CB 3.45Å; Y432-T435 PolarHBondContact O-N 3.46Å; L433-T435 VanDerWaalsContact C-N 3.3Å; L433-T435 PolarHBondContact O-N 3.15Å; T435-S439 WeakPolarHBondContact O-CB 3.14Å; T435-S439 PolarHBondContact O-N 3.22Å; T435-I490 HydrophobicContact CG2-CD1 4.1Å; T435-I490 HydrophobicContact CG2-CG2 4.26Å; T435-F491 HydrophobicContact CG2-CE2 3.88Å; T435-F491 HydrophobicContact CG2-CZ 4.16Å
436	S	88	Confident	88.4	Confident	14 Å²	14	40.7 Å²	40.7	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-43.1	178	-50.9	0	0	0	0	112.4	M352 C387 Y432 L433 A438 S439	M352-S436 WeakPolarHBondContact CE-OG 3.11Å; C387-S436 PolarHBondContact SG-OG 3.19Å; Y432-S436 PolarHBondContact O-N 3.47Å; Y432-S436 PolarHBondContact O-OG 3.35Å; L433-S436 PolarHBondContact O-N 3.12Å; S436-A438 VanDerWaalsContact C-N 3.34Å; S436-A438 PolarHBondContact O-N 3.27Å; S436-S439 PolarHBondContact O-N 2.96Å
437	L	90.1	Very high	87.9	Confident	8 Å²	8	37.9 Å²	37.9	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-67.3	-34.7	179.6	-179.6	62.3	0	0	0	112.7	T402 F405 L433 V434 N452 V455	T402-L437 HydrophobicContact CG2-CD2 4.11Å; F405-L437 HydrophobicContact CB-CD2 4.16Å; F405-L437 HydrophobicContact CD2-CD1 4.38Å; L433-L437 WeakPolarHBondContact O-CB 3.24Å; L433-L437 PolarHBondContact O-N 3.11Å; V434-L437 PolarHBondContact O-N 2.77Å; L437-N452 WeakPolarHBondContact O-CB 3.31Å; L437-N452 PolarHBondContact O-ND2 2.89Å; L437-V455 HydrophobicContact CD2-CG2 3.95Å; L437-V455 HydrophobicContact CG-CG2 3.95Å
438	A	90.4	Very high	87.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-80.3	-19.8	179.6	0	0	0	0	0	113.7	V434 S436 K440 A451 N452 V455 L457 F491	V434-A438 WeakPolarHBondContact O-CB 3.46Å; V434-A438 PolarHBondContact O-N 2.89Å; S436-A438 VanDerWaalsContact C-N 3.34Å; S436-A438 PolarHBondContact O-N 3.27Å; A438-K440 PolarHBondContact O-N 3.26Å; A438-A451 CarbonylContact O-C 3.03Å; A438-A451 WeakPolarHBondContact O-CA 3.06Å; A438-N452 PolarHBondContact O-N 2.51Å; A438-V455 HydrophobicContact CB-CB 4.2Å; A438-V455 HydrophobicContact CB-CG1 4.11Å; A438-V455 HydrophobicContact CB-CG2 4.45Å; A438-L457 HydrophobicContact CB-CD2 3.61Å; A438-L457 HydrophobicContact CB-CG 4.42Å; A438-F491 HydrophobicContact CB-CE1 3.84Å; A438-F491 HydrophobicContact CB-CZ 3.75Å
439	S	87.7	Confident	87.1	Confident	11 Å²	11	40.6 Å²	40.6	8%	0.077	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	107.8	-177.3	-177.3	0	0	0	0	112.1	T435 S436 I448	T435-S439 WeakPolarHBondContact O-CB 3.14Å; T435-S439 PolarHBondContact O-N 3.22Å; S436-S439 PolarHBondContact O-N 2.96Å; S439-I448 WeakPolarHBondContact OG-CD1 3.46Å
440	K	84.6	Confident	86.7	Confident	88 Å²	88	46.2 Å²	46.2	38%	0.383	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-46.7	170.2	-70.7	-171.6	166.8	-179.6	0	112.5	E398 A438 Q450	E398-K440 VanDerWaalsContact CD-NZ 3.27Å; E398-K440 WeakPolarHBondContact OE1-CE 3.25Å; E398-K440 IonicContact OE1-NZ 2.77Å; E398-K440 PolarHBondContact OE1-NZ 2.81Å; E398-K440 IonicContact OE2-NZ 3.25Å; E398-K440 PolarHBondContact OE2-NZ 2.99Å; A438-K440 PolarHBondContact O-N 3.26Å; K440-Q450 HydrophobicContact CB-CB 4.08Å; K440-Q450 WeakPolarHBondContact CB-O 3.4Å; K440-Q450 PolarHBondContact N-O 2.99Å; K440-Q450 VanDerWaalsContact N-O 3.09Å
441	A	83.9	Confident	86.5	Confident	31 Å²	31	47.2 Å²	47.2	26%	0.256	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	142.4	178.8	0	0	0	0	0	110.3	T449 Q450	A441-T449 PolarHBondContact O-N 3.43Å; A441-T449 PolarHBondContact O-OG1 2.89Å; A441-Q450 HydrophobicContact CB-CB 4.04Å; A441-Q450 HydrophobicContact CB-CG 4.28Å; A441-Q450 PolarHBondContact N-O 3.34Å; A441-Q450 PolarHBondContact O-N 2.67Å
442	Q	83.2	Confident	86.1	Confident	89 Å²	89	47.2 Å²	47.2	42%	0.416	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.1	-178.5	71.5	-177.8	9.5	0	0	112.3	G447 I448	Q442-G447 VanDerWaalsContact CA-O 3.26Å; Q442-G447 WeakPolarHBondContact CA-O 3.42Å; Q442-I448 HydrophobicContact CB-CD1 3.69Å
443	T	80.4	Confident	86	Confident	65 Å²	65	55.2 Å²	55.2	40%	0.399	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.7	167.4	63.6	0	0	0	0	108.7	K445 H446 G447 T449	T443-K445 VanDerWaalsContact C-N 3.25Å; T443-K445 PolarHBondContact O-N 3.47Å; T443-H446 PolarHBondContact O-N 3.4Å; T443-H446 WeakPolarHBondContact OG1-CB 3.37Å; T443-H446 PolarHBondContact OG1-N 3.08Å; T443-G447 PolarHBondContact N-O 3.4Å; T443-G447 WeakPolarHBondContact O-CA 3.38Å; T443-G447 PolarHBondContact O-N 3.2Å; T443-T449 HydrophobicContact CG2-CG2 4.47Å
444	Q	73.5	Confident	85.8	Confident	163 Å²	163	60.2 Å²	60.2	76%	0.762	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-43.2	176.2	-72.2	-179	-13.1	0	0	111.6	E375 R492	E375-Q444 PolarHBondContact O-NE2 3.11Å; Q444-R492 PolarHBondContact O-NH2 2.92Å
445	K	77.5	Confident	85.6	Confident	166 Å²	166	60.9 Å²	60.9	72%	0.722	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-41	-179.2	-172.1	176	-179	178.8	0	113.8	T443 R492	T443-K445 VanDerWaalsContact C-N 3.25Å; T443-K445 PolarHBondContact O-N 3.47Å; K445-R492 VanDerWaalsContact C-NH2 3.27Å; K445-R492 PolarHBondContact O-NH2 3.2Å
446	H	80.5	Confident	85.7	Confident	90 Å²	90	64.2 Å²	64.2	42%	0.417	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-3.1	-173.5	-59.9	-75.2	0	0	0	114.4	T443 T449 R492 N493	T443-H446 PolarHBondContact O-N 3.4Å; T443-H446 WeakPolarHBondContact OG1-CB 3.37Å; T443-H446 PolarHBondContact OG1-N 3.08Å; H446-T449 HydrophobicContact CB-CG2 3.86Å; H446-R492 VanDerWaalsContact C-NH2 3.32Å; H446-N493 PolarHBondContact O-ND2 2.92Å
447	G	85.7	Confident	85.9	Confident	8 Å²	8	64.1 Å²	64.1	8%	0.082	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61.6	-143.2	-169.5	0	0	0	0	0	110	Q442 T443 T449 R492	Q442-G447 VanDerWaalsContact CA-O 3.26Å; Q442-G447 WeakPolarHBondContact CA-O 3.42Å; T443-G447 PolarHBondContact N-O 3.4Å; T443-G447 WeakPolarHBondContact O-CA 3.38Å; T443-G447 PolarHBondContact O-N 3.2Å; G447-T449 PolarHBondContact O-N 3.18Å; G447-R492 VanDerWaalsContact N-NH2 3.12Å
448	I	87.4	Confident	86	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	118.2	176.7	-58.2	-51.4	0	0	0	110.6	S439 Q442 Q450 A451 I490 F491 Q494	S439-I448 WeakPolarHBondContact OG-CD1 3.46Å; Q442-I448 HydrophobicContact CB-CD1 3.69Å; I448-Q450 WeakPolarHBondContact CG2-O 3.34Å; I448-A451 HydrophobicContact CG2-CB 4.18Å; I448-I490 HydrophobicContact CD1-CG2 3.72Å; I448-I490 HydrophobicContact CG1-CG2 3.39Å; I448-I490 WeakPolarHBondContact CG1-O 3.3Å; I448-I490 PolarHBondContact N-O 2.89Å; I448-F491 HydrophobicContact CB-CD1 4.08Å; I448-F491 HydrophobicContact CB-CE1 4.26Å; I448-F491 HydrophobicContact CG1-CD1 3.75Å; I448-F491 HydrophobicContact CG1-CE1 3.62Å; I448-F491 HydrophobicContact CG1-CZ 4.3Å; I448-F491 HydrophobicContact CG2-CD1 4.35Å; I448-F491 HydrophobicContact CG2-CE1 4.28Å; I448-Q494 HydrophobicContact CB-CG 4.37Å; I448-Q494 HydrophobicContact CG2-CG 4.18Å; I448-Q494 PolarHBondContact O-NE2 3.01Å
449	T	86.5	Confident	86.2	Confident	63 Å²	63	70.7 Å²	70.7	39%	0.387	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-29.1	175.6	54.7	0	0	0	0	112	A441 T443 H446 G447	A441-T449 PolarHBondContact O-N 3.43Å; A441-T449 PolarHBondContact O-OG1 2.89Å; T443-T449 HydrophobicContact CG2-CG2 4.47Å; H446-T449 HydrophobicContact CB-CG2 3.86Å; G447-T449 PolarHBondContact O-N 3.18Å
450	Q	86.9	Confident	86.6	Confident	121 Å²	121	71 Å²	71	57%	0.565	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.4	174.5	-62.5	-178.5	5.3	0	0	109.9	K440 A441 I448	K440-Q450 HydrophobicContact CB-CB 4.08Å; K440-Q450 WeakPolarHBondContact CB-O 3.4Å; K440-Q450 PolarHBondContact N-O 2.99Å; K440-Q450 VanDerWaalsContact N-O 3.09Å; A441-Q450 HydrophobicContact CB-CB 4.04Å; A441-Q450 HydrophobicContact CB-CG 4.28Å; A441-Q450 PolarHBondContact N-O 3.34Å; A441-Q450 PolarHBondContact O-N 2.67Å; I448-Q450 WeakPolarHBondContact CG2-O 3.34Å
451	A	89.5	Confident	87.2	Confident	22 Å²	22	66.9 Å²	66.9	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	156.6	179.5	0	0	0	0	0	112.2	A438 I448 E453 L457 Q494	A438-A451 CarbonylContact O-C 3.03Å; A438-A451 WeakPolarHBondContact O-CA 3.06Å; I448-A451 HydrophobicContact CG2-CB 4.18Å; A451-E453 PolarHBondContact O-N 3.39Å; A451-L457 HydrophobicContact CB-CD1 3.69Å; A451-Q494 HydrophobicContact CB-CG 4.35Å
452	N	87.3	Confident	87.8	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.011	34%	0.343	C	S	.	.			trans	-70.6	115.6	168.8	-177.8	-13.1	0	0	0	110.1	E398 T402 L437 A438 L454 V455	E398-N452 PolarHBondContact OE1-ND2 3.26Å; E398-N452 PolarHBondContact OE1-OD1 3.24Å; T402-N452 PolarHBondContact OG1-ND2 3.11Å; L437-N452 WeakPolarHBondContact O-CB 3.31Å; L437-N452 PolarHBondContact O-ND2 2.89Å; A438-N452 PolarHBondContact O-N 2.51Å; N452-L454 PolarHBondContact O-N 3.49Å; N452-L454 WeakPolarHBondContact OD1-CB 3.24Å; N452-L454 WeakPolarHBondContact OD1-CG 3.31Å; N452-L454 PolarHBondContact OD1-N 2.84Å; N452-V455 HydrophobicContact CB-CG2 4.29Å; N452-V455 PolarHBondContact O-N 3.43Å; N452-V455 VanDerWaalsContact O-N 3.08Å
453	E	87.4	Confident	88.4	Confident	190 Å²	190	67.6 Å²	67.6	89%	0.888	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-18.3	-178.5	-62.2	-178.6	177.6	0	0	113.4	A451 V455	A451-E453 PolarHBondContact O-N 3.39Å; E453-V455 PolarHBondContact O-N 2.87Å
454	L	88.1	Confident	89.1	Confident	107 Å²	107	67 Å²	67	56%	0.56	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.1	174.8	-56	176.4	0	0	0	112.6	E398 T402 N452	E398-L454 HydrophobicContact CG-CD1 4.18Å; T402-L454 HydrophobicContact CG2-CB 3.83Å; T402-L454 HydrophobicContact CG2-CD1 4.08Å; N452-L454 PolarHBondContact O-N 3.49Å; N452-L454 WeakPolarHBondContact OD1-CB 3.24Å; N452-L454 WeakPolarHBondContact OD1-CG 3.31Å; N452-L454 PolarHBondContact OD1-N 2.84Å
455	V	88.6	Confident	90.3	Very high	21 Å²	21	59.3 Å²	59.3	13%	0.127	30%	0.301	C	S	.	.	S	Bend	trans	-106.5	112.9	179.5	-175.8	0	0	0	0	109.6	V434 L437 A438 N452 E453 L457	V434-V455 HydrophobicContact CG1-CG1 3.99Å; L437-V455 HydrophobicContact CD2-CG2 3.95Å; L437-V455 HydrophobicContact CG-CG2 3.95Å; A438-V455 HydrophobicContact CB-CB 4.2Å; A438-V455 HydrophobicContact CB-CG1 4.11Å; A438-V455 HydrophobicContact CB-CG2 4.45Å; N452-V455 HydrophobicContact CB-CG2 4.29Å; N452-V455 PolarHBondContact O-N 3.43Å; N452-V455 VanDerWaalsContact O-N 3.08Å; E453-V455 PolarHBondContact O-N 2.87Å; V455-L457 HydrophobicContact CG1-CD2 4.31Å; V455-L457 PolarHBondContact O-N 2.75Å
456	N	92	Very high	91.2	Very high	89 Å²	89	52 Å²	52	48%	0.476	27%	0.27	S	S	.	.			trans	-76.3	87.9	176.1	-169.9	-13.7	0	0	0	111.2	T458 E459 F460	N456-T458 VanDerWaalsContact C-N 3.32Å; N456-T458 PolarHBondContact O-N 3.06Å; N456-T458 PolarHBondContact OD1-N 2.71Å; N456-E459 HydrophobicContact CB-CB 3.97Å; N456-E459 VanDerWaalsContact ND2-CB 3.28Å; N456-E459 WeakPolarHBondContact ND2-CB 3.13Å; N456-E459 PolarHBondContact ND2-OE2 3.47Å; N456-E459 PolarHBondContact O-N 2.88Å; N456-E459 PolarHBondContact OD1-N 3.23Å; N456-E459 VanDerWaalsContact OD1-N 3.09Å; N456-F460 WeakPolarHBondContact O-CB 3.39Å; N456-F460 PolarHBondContact O-N 3.12Å
457	L	92.4	Very high	91.9	Very high	12 Å²	12	50.8 Å²	50.8	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-38.2	-178.9	-68.6	173.9	0	0	0	113.3	A438 A451 V455 F461 Y487 F491 Q494	A438-L457 HydrophobicContact CB-CD2 3.61Å; A438-L457 HydrophobicContact CB-CG 4.42Å; A451-L457 HydrophobicContact CB-CD1 3.69Å; V455-L457 HydrophobicContact CG1-CD2 4.31Å; V455-L457 PolarHBondContact O-N 2.75Å; L457-F461 VanDerWaalsContact O-CB 3.28Å; L457-F461 WeakPolarHBondContact O-CB 3.29Å; L457-F461 PolarHBondContact O-N 3.04Å; L457-Y487 VanDerWaalsContact CA-OH 3.3Å; L457-Y487 WeakPolarHBondContact CA-OH 3.13Å; L457-Y487 HydrophobicContact CD2-CE2 4.44Å; L457-Y487 WeakPolarHBondContact CD2-OH 3.14Å; L457-Y487 PolarHBondContact O-OH 3.39Å; L457-F491 HydrophobicContact CD1-CD1 3.45Å; L457-F491 VanDerWaalsContact CD1-CD1 3.45Å; L457-F491 HydrophobicContact CD1-CE1 3.73Å; L457-F491 HydrophobicContact CD1-CG 4.25Å; L457-F491 HydrophobicContact CD2-CD1 3.8Å; L457-F491 HydrophobicContact CD2-CD2 4.31Å; L457-F491 HydrophobicContact CD2-CE1 3.59Å; L457-F491 HydrophobicContact CD2-CE2 4.14Å; L457-F491 HydrophobicContact CD2-CG 4.16Å; L457-F491 HydrophobicContact CD2-CZ 3.79Å; L457-F491 HydrophobicContact CG-CD1 4.26Å; L457-F491 HydrophobicContact CG-CE1 4.33Å; L457-Q494 HydrophobicContact CD1-CB 3.8Å; L457-Q494 HydrophobicContact CD1-CG 4.23Å
458	T	93.3	Very high	92.3	Very high	42 Å²	42	51 Å²	51	26%	0.258	27%	0.269	S	S	.	.	H	α-helix	trans	-70.2	-42.6	-178.3	-60.9	0	0	0	0	110.9	N456 F461 V462 P496	N456-T458 VanDerWaalsContact C-N 3.32Å; N456-T458 PolarHBondContact O-N 3.06Å; N456-T458 PolarHBondContact OD1-N 2.71Å; T458-F461 WeakPolarHBondContact O-CB 3.38Å; T458-F461 PolarHBondContact O-N 2.87Å; T458-V462 WeakPolarHBondContact O-CG2 3.46Å; T458-V462 PolarHBondContact O-N 3.13Å; T458-P496 HydrophobicContact CG2-CG 4.29Å; T458-P496 WeakPolarHBondContact OG1-CD 3.42Å
459	E	94.8	Very high	92.8	Very high	104 Å²	104	51.1 Å²	51.1	49%	0.486	27%	0.27	S	S	.	.	H	α-helix	trans	-64.7	-44.1	175.7	-179.3	177	-176	0	0	111.8	N456 F461 V462 N463	N456-E459 HydrophobicContact CB-CB 3.97Å; N456-E459 VanDerWaalsContact ND2-CB 3.28Å; N456-E459 WeakPolarHBondContact ND2-CB 3.13Å; N456-E459 PolarHBondContact ND2-OE2 3.47Å; N456-E459 PolarHBondContact O-N 2.88Å; N456-E459 PolarHBondContact OD1-N 3.23Å; N456-E459 VanDerWaalsContact OD1-N 3.09Å; E459-F461 VanDerWaalsContact C-N 3.31Å; E459-F461 PolarHBondContact O-N 3.17Å; E459-V462 PolarHBondContact O-N 2.82Å; E459-N463 VanDerWaalsContact CG-ND2 3.31Å; E459-N463 WeakPolarHBondContact CG-ND2 3.42Å; E459-N463 WeakPolarHBondContact O-CB 3.42Å; E459-N463 PolarHBondContact O-N 3.01Å; E459-N463 PolarHBondContact O-ND2 3.21Å
460	F	95.8	Very high	93.3	Very high	19 Å²	19	54.1 Å²	54.1	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-42.6	176.2	-168.7	-93.4	0	0	0	111.5	V409 L413 I431 V434 N456 N463 H464 I465 Y487	V409-F460 HydrophobicContact CG1-CE2 4.39Å; L413-F460 HydrophobicContact CD1-CE2 4.3Å; I431-F460 HydrophobicContact CG1-CE1 4.17Å; I431-F460 HydrophobicContact CG1-CZ 4.11Å; V434-F460 HydrophobicContact CB-CE1 4.22Å; V434-F460 HydrophobicContact CB-CE2 4.22Å; V434-F460 HydrophobicContact CB-CZ 3.99Å; V434-F460 HydrophobicContact CG1-CD1 3.94Å; V434-F460 HydrophobicContact CG1-CD2 4.13Å; V434-F460 HydrophobicContact CG1-CE1 3.98Å; V434-F460 HydrophobicContact CG1-CE2 4.2Å; V434-F460 HydrophobicContact CG1-CG 4Å; V434-F460 HydrophobicContact CG1-CZ 4.12Å; V434-F460 HydrophobicContact CG2-CD2 4.15Å; V434-F460 HydrophobicContact CG2-CE2 3.64Å; V434-F460 HydrophobicContact CG2-CZ 3.84Å; N456-F460 WeakPolarHBondContact O-CB 3.39Å; N456-F460 PolarHBondContact O-N 3.12Å; F460-N463 PolarHBondContact O-N 3.45Å; F460-H464 AromaticContact CD2-CD2 3.52Å; F460-H464 HydrophobicContact CE1-CB 4.31Å; F460-H464 HydrophobicContact CE2-CB 4.23Å; F460-H464 AromaticContact CE2-CD2 3.63Å; F460-H464 HydrophobicContact CZ-CB 4.14Å; F460-H464 WeakPolarHBondContact O-CB 3.3Å; F460-H464 PolarHBondContact O-N 3.35Å; F460-I465 HydrophobicContact CD1-CD1 4.36Å; F460-I465 HydrophobicContact CD1-CG1 4.12Å; F460-I465 HydrophobicContact CE1-CD1 3.9Å; F460-I465 HydrophobicContact CE1-CG1 4.18Å; F460-I465 PolarHBondContact O-N 3.4Å; F460-Y487 HydrophobicContact CD1-CD2 4.41Å; F460-Y487 AromaticContact CD1-CE2 3.66Å; F460-Y487 HydrophobicContact CD1-CE2 3.66Å; F460-Y487 AromaticContact CD1-CZ 3.95Å; F460-Y487 HydrophobicContact CE1-CD2 4.47Å; F460-Y487 HydrophobicContact CE1-CE2 4.06Å
461	F	96.3	Very high	93.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-56.8	-51.7	173.4	175	-100	0	0	0	111.8	L457 T458 E459 N463 I465 L466 Y487 I488 V495 H499 S503	L457-F461 VanDerWaalsContact O-CB 3.28Å; L457-F461 WeakPolarHBondContact O-CB 3.29Å; L457-F461 PolarHBondContact O-N 3.04Å; T458-F461 WeakPolarHBondContact O-CB 3.38Å; T458-F461 PolarHBondContact O-N 2.87Å; E459-F461 VanDerWaalsContact C-N 3.31Å; E459-F461 PolarHBondContact O-N 3.17Å; F461-N463 PolarHBondContact O-N 3.37Å; F461-I465 HydrophobicContact CD2-CB 3.85Å; F461-I465 HydrophobicContact CD2-CG1 4.46Å; F461-I465 HydrophobicContact CD2-CG2 3.8Å; F461-I465 HydrophobicContact CE2-CB 4.31Å; F461-I465 HydrophobicContact CE2-CG2 3.87Å; F461-I465 WeakPolarHBondContact O-CB 3.46Å; F461-I465 PolarHBondContact O-N 2.8Å; F461-L466 HydrophobicContact CE1-CB 4.16Å; F461-L466 HydrophobicContact CE1-CD1 4.31Å; F461-L466 HydrophobicContact CE1-CD2 4.35Å; F461-L466 HydrophobicContact CZ-CB 4.22Å; F461-L466 HydrophobicContact CZ-CD1 4.07Å; F461-L466 WeakPolarHBondContact O-CB 3.17Å; F461-L466 PolarHBondContact O-N 3.48Å; F461-Y487 HydrophobicContact CB-CE1 3.89Å; F461-Y487 HydrophobicContact CD2-CD1 4.05Å; F461-Y487 HydrophobicContact CD2-CE1 4.17Å; F461-Y487 HydrophobicContact CG-CE1 4.5Å; F461-I488 HydrophobicContact CD2-CG1 4.44Å; F461-I488 HydrophobicContact CE2-CD1 4.04Å; F461-I488 HydrophobicContact CE2-CG1 3.69Å; F461-V495 HydrophobicContact CD1-CG1 4.39Å; F461-H499 HydrophobicContact CD1-CB 4.18Å; F461-H499 HydrophobicContact CE1-CB 3.77Å; F461-S503 WeakPolarHBondContact CZ-OG 3.11Å
462	V	96.4	Very high	93.6	Very high	53 Å²	53	53.6 Å²	53.6	32%	0.321	29%	0.292	S	S	.	.	I	π-helix	trans	-65.4	-40	-177	171.4	0	0	0	0	112.1	T458 E459 P467	T458-V462 WeakPolarHBondContact O-CG2 3.46Å; T458-V462 PolarHBondContact O-N 3.13Å; E459-V462 PolarHBondContact O-N 2.82Å; V462-P467 WeakPolarHBondContact O-CD 3.37Å
463	N	96.1	Very high	94	Very high	82 Å²	82	57.3 Å²	57.3	44%	0.439	31%	0.312	S	S	.	.	I	π-helix	trans	-88.6	-29.5	-171.2	-68.7	-20	0	0	0	114	E459 F460 F461 P467	E459-N463 VanDerWaalsContact CG-ND2 3.31Å; E459-N463 WeakPolarHBondContact CG-ND2 3.42Å; E459-N463 WeakPolarHBondContact O-CB 3.42Å; E459-N463 PolarHBondContact O-N 3.01Å; E459-N463 PolarHBondContact O-ND2 3.21Å; F460-N463 PolarHBondContact O-N 3.45Å; F461-N463 PolarHBondContact O-N 3.37Å; N463-P467 WeakPolarHBondContact O-CG 3.42Å
464	H	96.1	Very high	94.4	Very high	54 Å²	54	49 Å²	49	25%	0.25	27%	0.274	C	S	.	.	I	π-helix	trans	-122.8	-30.4	-170.8	-59.7	-59	0	0	0	114.2	K427 F460	K427-H464 VanDerWaalsContact CE-O 3.28Å; K427-H464 WeakPolarHBondContact CE-O 3.41Å; K427-H464 PolarHBondContact NZ-O 3.42Å; F460-H464 AromaticContact CD2-CD2 3.52Å; F460-H464 HydrophobicContact CE1-CB 4.31Å; F460-H464 HydrophobicContact CE2-CB 4.23Å; F460-H464 AromaticContact CE2-CD2 3.63Å; F460-H464 HydrophobicContact CZ-CB 4.14Å; F460-H464 WeakPolarHBondContact O-CB 3.3Å; F460-H464 PolarHBondContact O-N 3.35Å
465	I	97.2	Very high	94.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-93	-53.9	-178.1	-55.3	-54.9	0	0	0	111.9	I431 F460 F461 P467 D468 L469 G484 Y487	I431-I465 HydrophobicContact CD1-CD1 3.89Å; I431-I465 HydrophobicContact CG1-CD1 3.95Å; I431-I465 HydrophobicContact CG2-CD1 4.13Å; F460-I465 HydrophobicContact CD1-CD1 4.36Å; F460-I465 HydrophobicContact CD1-CG1 4.12Å; F460-I465 HydrophobicContact CE1-CD1 3.9Å; F460-I465 HydrophobicContact CE1-CG1 4.18Å; F460-I465 PolarHBondContact O-N 3.4Å; F461-I465 HydrophobicContact CD2-CB 3.85Å; F461-I465 HydrophobicContact CD2-CG1 4.46Å; F461-I465 HydrophobicContact CD2-CG2 3.8Å; F461-I465 HydrophobicContact CE2-CB 4.31Å; F461-I465 HydrophobicContact CE2-CG2 3.87Å; F461-I465 WeakPolarHBondContact O-CB 3.46Å; F461-I465 PolarHBondContact O-N 2.8Å; I465-P467 VanDerWaalsContact C-CD 3.42Å; I465-D468 PolarHBondContact O-N 2.89Å; I465-D468 VanDerWaalsContact O-N 3.14Å; I465-L469 HydrophobicContact CG2-CD1 3.99Å; I465-L469 HydrophobicContact CG2-CG 4.43Å; I465-L469 PolarHBondContact O-N 3.15Å; I465-G484 WeakPolarHBondContact CG2-O 3.38Å; I465-Y487 HydrophobicContact CD1-CD2 4.17Å; I465-Y487 HydrophobicContact CD1-CG 4.11Å; I465-Y487 HydrophobicContact CG1-CD1 3.98Å; I465-Y487 HydrophobicContact CG1-CD2 4.14Å; I465-Y487 HydrophobicContact CG1-CE1 4.37Å; I465-Y487 HydrophobicContact CG1-CG 3.85Å
466	L	96.4	Very high	95.1	Very high	14 Å²	14	49 Å²	49	7%	0.073	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-37.1	-176.7	-174.8	62.5	0	0	0	113.8	F461 D468 L469 K470 V502 L506	F461-L466 HydrophobicContact CE1-CB 4.16Å; F461-L466 HydrophobicContact CE1-CD1 4.31Å; F461-L466 HydrophobicContact CE1-CD2 4.35Å; F461-L466 HydrophobicContact CZ-CB 4.22Å; F461-L466 HydrophobicContact CZ-CD1 4.07Å; F461-L466 WeakPolarHBondContact O-CB 3.17Å; F461-L466 PolarHBondContact O-N 3.48Å; L466-D468 VanDerWaalsContact C-N 3.33Å; L466-D468 PolarHBondContact O-N 3.2Å; L466-L469 PolarHBondContact O-N 3.49Å; L466-K470 HydrophobicContact CD1-CD 4.41Å; L466-K470 HydrophobicContact CD1-CG 4.35Å; L466-K470 HydrophobicContact CG-CD 4.12Å; L466-K470 HydrophobicContact CG-CG 4.46Å; L466-K470 WeakPolarHBondContact O-CB 3.23Å; L466-K470 WeakPolarHBondContact O-CG 3.26Å; L466-K470 PolarHBondContact O-N 3.15Å; L466-V502 HydrophobicContact CD1-CG1 4.47Å; L466-L506 HydrophobicContact CD1-CD1 3.76Å
467	P	95.7	Very high	95.3	Very high	63 Å²	63	46.8 Å²	46.8	41%	0.409	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-38.9	176.2	-25.3	37.4	0	0	0	112.9	V462 N463 I465 K470 S471	V462-P467 WeakPolarHBondContact O-CD 3.37Å; N463-P467 WeakPolarHBondContact O-CG 3.42Å; I465-P467 VanDerWaalsContact C-CD 3.42Å; P467-K470 PolarHBondContact O-N 2.82Å; P467-S471 PolarHBondContact O-N 2.85Å
468	D	95.1	Very high	95.5	Very high	14 Å²	14	47.9 Å²	47.9	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-66.2	-46.3	177.6	-66.2	-13.7	0	0	0	109.8	K427 I465 L466 K470 S471 K481	K427-D468 WeakPolarHBondContact CE-OD2 3.4Å; K427-D468 IonicContact NZ-OD1 2.67Å; K427-D468 PolarHBondContact NZ-OD1 3.29Å; K427-D468 IonicContact NZ-OD2 3.4Å; K427-D468 PolarHBondContact NZ-OD2 3.02Å; I465-D468 PolarHBondContact O-N 2.89Å; I465-D468 VanDerWaalsContact O-N 3.14Å; L466-D468 VanDerWaalsContact C-N 3.33Å; L466-D468 PolarHBondContact O-N 3.2Å; D468-K470 PolarHBondContact O-N 3.38Å; D468-K470 VanDerWaalsContact O-N 3.16Å; D468-S471 WeakPolarHBondContact O-CB 3.3Å; D468-S471 PolarHBondContact O-N 3.45Å; D468-K481 HydrophobicContact CB-CD 4.34Å; D468-K481 PolarHBondContact O-NZ 3.43Å
469	L	96.5	Very high	95.7	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-17.3	178.2	-59	-179.8	0	0	0	113.6	I465 L466 I485 I488 L506 H510	I465-L469 HydrophobicContact CG2-CD1 3.99Å; I465-L469 HydrophobicContact CG2-CG 4.43Å; I465-L469 PolarHBondContact O-N 3.15Å; L466-L469 PolarHBondContact O-N 3.49Å; L469-I485 HydrophobicContact CD2-CG1 3.83Å; L469-I488 HydrophobicContact CD1-CD1 3.32Å; L469-I488 HydrophobicContact CD1-CG1 4.31Å; L469-L506 HydrophobicContact CB-CB 4.43Å; L469-L506 HydrophobicContact CB-CD1 4.02Å; L469-H510 PolarHBondContact O-CE1 3.03Å; L469-H510 VanDerWaalsContact O-CE1 3.31Å
470	K	96.5	Very high	95.8	Very high	126 Å²	126	41.3 Å²	41.3	55%	0.548	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-8.3	174.2	-78	178.6	175.6	176.1	0	113.9	L466 P467 D468 A472 L506	L466-K470 HydrophobicContact CD1-CD 4.41Å; L466-K470 HydrophobicContact CD1-CG 4.35Å; L466-K470 HydrophobicContact CG-CD 4.12Å; L466-K470 HydrophobicContact CG-CG 4.46Å; L466-K470 WeakPolarHBondContact O-CB 3.23Å; L466-K470 WeakPolarHBondContact O-CG 3.26Å; L466-K470 PolarHBondContact O-N 3.15Å; P467-K470 PolarHBondContact O-N 2.82Å; D468-K470 PolarHBondContact O-N 3.38Å; D468-K470 VanDerWaalsContact O-N 3.16Å; K470-A472 PolarHBondContact O-N 3.45Å; K470-L506 HydrophobicContact CG-CD1 3.84Å; K470-L506 HydrophobicContact CG-CD2 4.31Å
471	S	93.2	Very high	95.9	Very high	29 Å²	29	40.5 Å²	40.5	20%	0.203	23%	0.229	C	C	.	.			trans	-57.4	137.3	178.5	-176.3	0	0	0	0	110.3	P467 D468 N473 E476	P467-S471 PolarHBondContact O-N 2.85Å; D468-S471 WeakPolarHBondContact O-CB 3.3Å; D468-S471 PolarHBondContact O-N 3.45Å; S471-N473 PolarHBondContact O-N 3.1Å; S471-N473 PolarHBondContact OG-N 3.3Å; S471-E476 PolarHBondContact OG-OE2 3.24Å
472	A	91.5	Very high	95.9	Very high	102 Å²	102	40.5 Å²	40.5	84%	0.843	23%	0.229	S	C	*	.	S	Bend	trans	-65.9	-30.3	179	0	0	0	0	0	112.1	K470	K470-A472 PolarHBondContact O-N 3.45Å
473	N	95.6	Very high	95.9	Very high	81 Å²	81	38.5 Å²	38.5	43%	0.433	22%	0.216	S	C	.	.			trans	-93	104.9	176	-175.1	4.4	0	0	0	110.1	S471 N475 E476	S471-N473 PolarHBondContact O-N 3.1Å; S471-N473 PolarHBondContact OG-N 3.3Å; N473-N475 PolarHBondContact O-N 3.22Å; N473-N475 WeakPolarHBondContact OD1-CB 3.41Å; N473-N475 PolarHBondContact OD1-N 3.17Å; N473-E476 HydrophobicContact CB-CB 3.89Å; N473-E476 WeakPolarHBondContact O-CB 3.18Å; N473-E476 PolarHBondContact O-N 2.88Å
474	V	95.1	Very high	96	Very high	16 Å²	16	34.6 Å²	34.6	10%	0.097	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.4	177.5	-63.3	0	0	0	0	113.4	N509 A513	V474-N509 WeakPolarHBondContact CG1-ND2 3.46Å; V474-A513 HydrophobicContact CB-CB 4.47Å; V474-A513 HydrophobicContact CG2-CB 4.39Å
475	N	96.3	Very high	96	Very high	50 Å²	50	32 Å²	32	27%	0.267	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.5	-179.8	-61.6	-30.1	0	0	0	112.9	N473 F477 A513 E514	N473-N475 PolarHBondContact O-N 3.22Å; N473-N475 WeakPolarHBondContact OD1-CB 3.41Å; N473-N475 PolarHBondContact OD1-N 3.17Å; N475-F477 PolarHBondContact O-N 3.47Å; N475-A513 VanDerWaalsContact OD1-CA 3.26Å; N475-A513 WeakPolarHBondContact OD1-CA 3.33Å; N475-E514 VanDerWaalsContact ND2-CD 3.34Å; N475-E514 WeakPolarHBondContact ND2-CG 3.39Å; N475-E514 PolarHBondContact ND2-OE1 3Å; N475-E514 VanDerWaalsContact ND2-OE1 3.09Å; N475-E514 PolarHBondContact OD1-N 3.4Å
476	E	95	Very high	95.9	Very high	76 Å²	76	33.1 Å²	33.1	36%	0.355	19%	0.188	S	C	.	.	S	Bend	trans	-73	126.2	176	-173.6	-172.4	-151.6	0	0	109.8	S471 N473 K481	S471-E476 PolarHBondContact OG-OE2 3.24Å; N473-E476 HydrophobicContact CB-CB 3.89Å; N473-E476 WeakPolarHBondContact O-CB 3.18Å; N473-E476 PolarHBondContact O-N 2.88Å; E476-K481 WeakPolarHBondContact O-CE 3.46Å
477	F	95.5	Very high	95.9	Very high	44 Å²	44	32.5 Å²	32.5	19%	0.193	19%	0.185	C	C	.	.	S	Bend	trans	50	63.9	-179.6	-49.9	-55.9	0	0	0	113.8	P420 W424 N475 V479 L480 K481	P420-F477 HydrophobicContact CB-CE2 4.5Å; P420-F477 HydrophobicContact CB-CZ 4.35Å; W424-F477 HydrophobicContact CB-CD1 4.01Å; W424-F477 HydrophobicContact CB-CE1 4.37Å; W424-F477 HydrophobicContact CG-CD1 4.21Å; N475-F477 PolarHBondContact O-N 3.47Å; F477-V479 VanDerWaalsContact C-N 3.26Å; F477-V479 PolarHBondContact O-N 3.09Å; F477-L480 HydrophobicContact CB-CB 4.03Å; F477-L480 HydrophobicContact CB-CD1 3.91Å; F477-L480 HydrophobicContact CB-CG 4.08Å; F477-L480 HydrophobicContact CD2-CD1 4.5Å; F477-L480 HydrophobicContact CG-CD1 4.19Å; F477-L480 PolarHBondContact O-N 3.29Å; F477-K481 PolarHBondContact O-N 2.98Å; F477-K481 VanDerWaalsContact O-N 3.1Å
478	P	97	Very high	95.9	Very high	35 Å²	35	29.5 Å²	29.5	23%	0.227	17%	0.165	C	C	.	.	H	α-helix	trans	-58.8	-35.4	-172	25.3	-35.3	0	0	0	113.1	F362 K481 A482 V518	F362-P478 HydrophobicContact CE1-CB 3.87Å; F362-P478 HydrophobicContact CE1-CG 4.05Å; F362-P478 HydrophobicContact CZ-CB 4.04Å; P478-K481 PolarHBondContact O-N 3.33Å; P478-A482 WeakPolarHBondContact O-CB 3.34Å; P478-A482 PolarHBondContact O-N 2.72Å; P478-V518 HydrophobicContact CB-CG2 3.79Å; P478-V518 WeakPolarHBondContact O-CG2 3.47Å
479	V	96.8	Very high	95.8	Very high	7 Å²	7	29.2 Å²	29.2	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-60.2	-48.2	174.8	-178.7	0	0	0	0	111.2	F354 F362 W424 D428 F477 K481 A482 D483	F354-V479 HydrophobicContact CD2-CG1 4.03Å; F354-V479 HydrophobicContact CE1-CG2 3.99Å; F354-V479 HydrophobicContact CE2-CG1 3.67Å; F354-V479 HydrophobicContact CE2-CG2 4.31Å; F354-V479 HydrophobicContact CZ-CG1 3.96Å; F354-V479 HydrophobicContact CZ-CG2 3.72Å; F362-V479 HydrophobicContact CD1-CG2 4.04Å; F362-V479 HydrophobicContact CD2-CG2 4.15Å; F362-V479 HydrophobicContact CE1-CG2 3.97Å; F362-V479 HydrophobicContact CE2-CG2 4.06Å; F362-V479 HydrophobicContact CG-CG2 4.15Å; F362-V479 HydrophobicContact CZ-CG2 3.98Å; W424-V479 HydrophobicContact CE3-CB 4.29Å; W424-V479 HydrophobicContact CH2-CB 4.19Å; W424-V479 HydrophobicContact CH2-CG2 3.85Å; W424-V479 HydrophobicContact CZ3-CB 3.6Å; W424-V479 HydrophobicContact CZ3-CG1 3.79Å; W424-V479 HydrophobicContact CZ3-CG2 3.8Å; D428-V479 HydrophobicContact CB-CG1 4.32Å; F477-V479 VanDerWaalsContact C-N 3.26Å; F477-V479 PolarHBondContact O-N 3.09Å; V479-K481 VanDerWaalsContact C-N 3.28Å; V479-K481 PolarHBondContact O-N 2.89Å; V479-A482 CarbonylContact O-C 3.6Å; V479-A482 WeakPolarHBondContact O-CA 2.93Å; V479-A482 WeakPolarHBondContact O-CB 3.38Å; V479-A482 PolarHBondContact O-N 3.47Å; V479-D483 VanDerWaalsContact O-CG 3.3Å; V479-D483 PolarHBondContact O-N 3.49Å
480	L	97.4	Very high	95.5	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-32.2	177.7	-62.2	-176.1	0	0	0	112.8	Y416 W424 K427 D428 I431 F477 G484	Y416-L480 HydrophobicContact CE2-CD1 3.91Å; W424-L480 HydrophobicContact CB-CD1 3.91Å; W424-L480 HydrophobicContact CB-CG 4.44Å; K427-L480 HydrophobicContact CB-CD1 4.32Å; K427-L480 HydrophobicContact CB-CD2 3.88Å; K427-L480 HydrophobicContact CD-CD1 4.04Å; K427-L480 HydrophobicContact CD-CD2 4.39Å; K427-L480 HydrophobicContact CG-CD1 4.43Å; K427-L480 HydrophobicContact CG-CD2 3.96Å; D428-L480 HydrophobicContact CB-CD2 4.05Å; I431-L480 HydrophobicContact CD1-CD2 4.43Å; F477-L480 HydrophobicContact CB-CB 4.03Å; F477-L480 HydrophobicContact CB-CD1 3.91Å; F477-L480 HydrophobicContact CB-CG 4.08Å; F477-L480 HydrophobicContact CD2-CD1 4.5Å; F477-L480 HydrophobicContact CG-CD1 4.19Å; F477-L480 PolarHBondContact O-N 3.29Å; L480-G484 PolarHBondContact O-N 3.06Å
481	K	98	Very high	95.4	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.009	15%	0.145	C	C	.	.	H	α-helix	trans	-66.5	-45.7	171.3	-55.7	-53.4	178.6	-166.9	0	110.8	D468 E476 F477 P478 V479 D483 G484 I485 V518	D468-K481 HydrophobicContact CB-CD 4.34Å; D468-K481 PolarHBondContact O-NZ 3.43Å; E476-K481 WeakPolarHBondContact O-CE 3.46Å; F477-K481 PolarHBondContact O-N 2.98Å; F477-K481 VanDerWaalsContact O-N 3.1Å; P478-K481 PolarHBondContact O-N 3.33Å; V479-K481 VanDerWaalsContact C-N 3.28Å; V479-K481 PolarHBondContact O-N 2.89Å; K481-D483 VanDerWaalsContact C-N 3.34Å; K481-D483 PolarHBondContact O-N 3.23Å; K481-G484 PolarHBondContact O-N 3.36Å; K481-I485 WeakPolarHBondContact O-CD1 3.48Å; K481-I485 WeakPolarHBondContact O-CG1 3.16Å; K481-I485 PolarHBondContact O-N 3.36Å; K481-V518 HydrophobicContact CB-CG1 3.98Å; K481-V518 HydrophobicContact CB-CG2 4.12Å
482	A	97.4	Very high	95.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-46.2	176.8	0	0	0	0	0	110.7	F362 P478 V479 G484 I485 K486 V517 V518 Y521	F362-A482 HydrophobicContact CE2-CB 3.85Å; F362-A482 HydrophobicContact CZ-CB 4.21Å; P478-A482 WeakPolarHBondContact O-CB 3.34Å; P478-A482 PolarHBondContact O-N 2.72Å; V479-A482 CarbonylContact O-C 3.6Å; V479-A482 WeakPolarHBondContact O-CA 2.93Å; V479-A482 WeakPolarHBondContact O-CB 3.38Å; V479-A482 PolarHBondContact O-N 3.47Å; A482-G484 PolarHBondContact O-N 3.2Å; A482-I485 PolarHBondContact O-N 2.82Å; A482-K486 VanDerWaalsContact O-CB 3.24Å; A482-K486 WeakPolarHBondContact O-CB 3.49Å; A482-K486 PolarHBondContact O-N 3.34Å; A482-V517 HydrophobicContact CB-CG1 4.05Å; A482-V518 HydrophobicContact CB-CG2 4.29Å; A482-Y521 HydrophobicContact CB-CD2 3.82Å; A482-Y521 HydrophobicContact CB-CE2 3.99Å; A482-Y521 WeakPolarHBondContact O-CD2 3.28Å
483	D	96	Very high	95.4	Very high	10 Å²	10	22.3 Å²	22.3	5%	0.053	12%	0.115	C	C	.	.	H	α-helix	trans	-57.6	-46.6	174.7	-68	-28.9	0	0	0	112.1	D428 I431 V479 K481 I485 K486 Y487	D428-D483 WeakPolarHBondContact CA-OD2 3.48Å; D428-D483 WeakPolarHBondContact CB-OD2 3.28Å; I431-D483 HydrophobicContact CB-CB 4.44Å; I431-D483 HydrophobicContact CD1-CB 3.91Å; I431-D483 HydrophobicContact CG2-CB 4Å; V479-D483 VanDerWaalsContact O-CG 3.3Å; V479-D483 PolarHBondContact O-N 3.49Å; K481-D483 VanDerWaalsContact C-N 3.34Å; K481-D483 PolarHBondContact O-N 3.23Å; D483-I485 PolarHBondContact O-N 2.86Å; D483-K486 PolarHBondContact O-N 3.49Å; D483-Y487 WeakPolarHBondContact O-CB 3.36Å; D483-Y487 PolarHBondContact O-N 2.83Å
484	G	96.7	Very high	95.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.9	-39.8	179.5	0	0	0	0	0	113.3	I465 L480 K481 A482 Y487 I488	I465-G484 WeakPolarHBondContact CG2-O 3.38Å; L480-G484 PolarHBondContact O-N 3.06Å; K481-G484 PolarHBondContact O-N 3.36Å; A482-G484 PolarHBondContact O-N 3.2Å; G484-Y487 WeakPolarHBondContact O-CB 3.25Å; G484-I488 PolarHBondContact O-N 2.9Å
485	I	98	Very high	95	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.7	-45.1	174	-63.7	163.5	0	0	0	109.7	L469 K481 A482 D483 Y487 I488 M489 L507 H510 V518 Y521 A522 A525	L469-I485 HydrophobicContact CD2-CG1 3.83Å; K481-I485 WeakPolarHBondContact O-CD1 3.48Å; K481-I485 WeakPolarHBondContact O-CG1 3.16Å; K481-I485 PolarHBondContact O-N 3.36Å; A482-I485 PolarHBondContact O-N 2.82Å; D483-I485 PolarHBondContact O-N 2.86Å; I485-Y487 VanDerWaalsContact C-N 3.28Å; I485-Y487 PolarHBondContact O-N 3.35Å; I485-I488 WeakPolarHBondContact O-CB 3.47Å; I485-I488 PolarHBondContact O-N 2.82Å; I485-M489 WeakPolarHBondContact O-CG 3.31Å; I485-M489 PolarHBondContact O-N 3.41Å; I485-L507 HydrophobicContact CB-CD2 4.31Å; I485-L507 HydrophobicContact CG1-CD2 3.82Å; I485-L507 HydrophobicContact CG2-CD2 3.79Å; I485-H510 HydrophobicContact CD1-CB 4.1Å; I485-V518 HydrophobicContact CD1-CG1 3.96Å; I485-Y521 VanDerWaalsContact CG2-C 3.45Å; I485-Y521 VanDerWaalsContact CG2-O 3.3Å; I485-Y521 WeakPolarHBondContact CG2-O 3.41Å; I485-A522 HydrophobicContact CD1-CB 4.08Å; I485-A525 HydrophobicContact CG2-CB 3.61Å
486	K	94.7	Very high	94.8	Very high	23 Å²	23	21 Å²	21	10%	0.1	11%	0.108	C	C	.	.	H	α-helix	trans	-60	-39.5	178.3	-177.8	-176.1	178.5	179.1	0	112.3	D373 A482 D483 I488 M489 I490 Y521	D373-K486 IonicContact OD1-NZ 3.57Å; D373-K486 PolarHBondContact OD1-NZ 2.89Å; D373-K486 VanDerWaalsContact OD2-CD 3.25Å; D373-K486 WeakPolarHBondContact OD2-CD 3.32Å; D373-K486 WeakPolarHBondContact OD2-CE 3.42Å; D373-K486 IonicContact OD2-NZ 3.34Å; D373-K486 PolarHBondContact OD2-NZ 3.17Å; A482-K486 VanDerWaalsContact O-CB 3.24Å; A482-K486 WeakPolarHBondContact O-CB 3.49Å; A482-K486 PolarHBondContact O-N 3.34Å; D483-K486 PolarHBondContact O-N 3.49Å; K486-I488 VanDerWaalsContact C-N 3.33Å; K486-I488 PolarHBondContact O-N 3.45Å; K486-M489 HydrophobicContact CB-CE 4.39Å; K486-M489 HydrophobicContact CG-CE 4.39Å; K486-M489 WeakPolarHBondContact O-CB 3.38Å; K486-M489 PolarHBondContact O-N 3.08Å; K486-M489 VanDerWaalsContact O-N 3.07Å; K486-I490 HydrophobicContact CD-CD1 4.16Å; K486-I490 VanDerWaalsContact CE-CD1 3.48Å; K486-I490 HydrophobicContact CG-CD1 3.69Å; K486-I490 HydrophobicContact CG-CG1 4.21Å; K486-I490 WeakPolarHBondContact O-CB 3.24Å; K486-I490 WeakPolarHBondContact O-CG1 3.35Å; K486-I490 PolarHBondContact O-N 3.35Å; K486-Y521 HydrophobicContact CB-CD2 4.21Å; K486-Y521 HydrophobicContact CB-CE2 4.22Å; K486-Y521 HydrophobicContact CD-CE2 4.49Å
487	Y	95.3	Very high	94.8	Very high	1 Å²	1	21.1 Å²	21.1	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-56.6	-46.8	173.1	-170.1	-80.6	0	0	0	111.5	I431 L457 F460 F461 I465 D483 G484 I485 M489 I490 F491 V495	I431-Y487 HydrophobicContact CG2-CD2 4.49Å; L457-Y487 VanDerWaalsContact CA-OH 3.3Å; L457-Y487 WeakPolarHBondContact CA-OH 3.13Å; L457-Y487 HydrophobicContact CD2-CE2 4.44Å; L457-Y487 WeakPolarHBondContact CD2-OH 3.14Å; L457-Y487 PolarHBondContact O-OH 3.39Å; F460-Y487 HydrophobicContact CD1-CD2 4.41Å; F460-Y487 AromaticContact CD1-CE2 3.66Å; F460-Y487 HydrophobicContact CD1-CE2 3.66Å; F460-Y487 AromaticContact CD1-CZ 3.95Å; F460-Y487 HydrophobicContact CE1-CD2 4.47Å; F460-Y487 HydrophobicContact CE1-CE2 4.06Å; F461-Y487 HydrophobicContact CB-CE1 3.89Å; F461-Y487 HydrophobicContact CD2-CD1 4.05Å; F461-Y487 HydrophobicContact CD2-CE1 4.17Å; F461-Y487 HydrophobicContact CG-CE1 4.5Å; I465-Y487 HydrophobicContact CD1-CD2 4.17Å; I465-Y487 HydrophobicContact CD1-CG 4.11Å; I465-Y487 HydrophobicContact CG1-CD1 3.98Å; I465-Y487 HydrophobicContact CG1-CD2 4.14Å; I465-Y487 HydrophobicContact CG1-CE1 4.37Å; I465-Y487 HydrophobicContact CG1-CG 3.85Å; D483-Y487 WeakPolarHBondContact O-CB 3.36Å; D483-Y487 PolarHBondContact O-N 2.83Å; G484-Y487 WeakPolarHBondContact O-CB 3.25Å; I485-Y487 VanDerWaalsContact C-N 3.28Å; I485-Y487 PolarHBondContact O-N 3.35Å; Y487-M489 VanDerWaalsContact C-N 3.31Å; Y487-M489 PolarHBondContact O-N 3.02Å; Y487-I490 PolarHBondContact O-N 3.11Å; Y487-F491 AromaticContact CD1-CD2 3.97Å; Y487-F491 HydrophobicContact CD1-CD2 3.97Å; Y487-F491 AromaticContact CD2-CD2 3.71Å; Y487-F491 HydrophobicContact CD2-CD2 3.71Å; Y487-F491 AromaticContact CD2-CE2 3.8Å; Y487-F491 HydrophobicContact CD2-CE2 3.8Å; Y487-F491 HydrophobicContact CE1-CB 4.28Å; Y487-F491 AromaticContact CE1-CD2 3.84Å; Y487-F491 HydrophobicContact CE1-CD2 3.84Å; Y487-F491 HydrophobicContact CE1-CG 4.35Å; Y487-F491 AromaticContact CE2-CD2 3.59Å; Y487-F491 HydrophobicContact CE2-CD2 3.59Å; Y487-F491 AromaticContact CE2-CE2 3.6Å; Y487-F491 HydrophobicContact CE2-CE2 3.6Å; Y487-F491 AromaticContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CE2 4.44Å; Y487-F491 AromaticContact CZ-CD2 3.67Å; Y487-F491 WeakPolarHBondContact O-CB 3.28Å; Y487-F491 PolarHBondContact O-N 2.67Å; Y487-V495 HydrophobicContact CE1-CG2 4.47Å
488	I	95.7	Very high	94.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.6	-44.8	174.1	-66.4	170.5	0	0	0	110.4	F461 L469 G484 I485 K486 R492 L500 L507 L529	F461-I488 HydrophobicContact CD2-CG1 4.44Å; F461-I488 HydrophobicContact CE2-CD1 4.04Å; F461-I488 HydrophobicContact CE2-CG1 3.69Å; L469-I488 HydrophobicContact CD1-CD1 3.32Å; L469-I488 HydrophobicContact CD1-CG1 4.31Å; G484-I488 PolarHBondContact O-N 2.9Å; I485-I488 WeakPolarHBondContact O-CB 3.47Å; I485-I488 PolarHBondContact O-N 2.82Å; K486-I488 VanDerWaalsContact C-N 3.33Å; K486-I488 PolarHBondContact O-N 3.45Å; I488-R492 WeakPolarHBondContact O-CA 3.4Å; I488-R492 VanDerWaalsContact O-CB 3.26Å; I488-R492 WeakPolarHBondContact O-CB 3.43Å; I488-R492 PolarHBondContact O-N 2.79Å; I488-L500 HydrophobicContact CG2-CD2 4Å; I488-L507 HydrophobicContact CD1-CD2 4.27Å; I488-L529 HydrophobicContact CG2-CD1 4.29Å; I488-L529 HydrophobicContact CG2-CD2 4.3Å
489	M	93	Very high	94.7	Very high	8 Å²	8	25.8 Å²	25.8	4%	0.039	13%	0.126	C	C	.	.	H	α-helix	trans	-61.1	-54.8	179.9	-57.3	-167.6	-46.4	0	0	110.8	L374 I485 K486 Y487 R492 Y521 H524 A525	L374-M489 HydrophobicContact CD2-CE 3.42Å; L374-M489 VanDerWaalsContact CD2-CE 3.42Å; I485-M489 WeakPolarHBondContact O-CG 3.31Å; I485-M489 PolarHBondContact O-N 3.41Å; K486-M489 HydrophobicContact CB-CE 4.39Å; K486-M489 HydrophobicContact CG-CE 4.39Å; K486-M489 WeakPolarHBondContact O-CB 3.38Å; K486-M489 PolarHBondContact O-N 3.08Å; K486-M489 VanDerWaalsContact O-N 3.07Å; Y487-M489 VanDerWaalsContact C-N 3.31Å; Y487-M489 PolarHBondContact O-N 3.02Å; M489-R492 VanDerWaalsContact O-CD 3.29Å; M489-R492 WeakPolarHBondContact O-CD 3.38Å; M489-R492 VanDerWaalsContact O-CG 3.27Å; M489-R492 WeakPolarHBondContact O-CG 3.23Å; M489-R492 PolarHBondContact O-NH1 3.38Å; M489-Y521 HydrophobicContact CE-CG 4.49Å; M489-H524 HydrophobicContact SD-CB 3.88Å; M489-H524 PolarHBondContact SD-CD2 2.94Å; M489-A525 HydrophobicContact CG-CB 3.51Å; M489-A525 HydrophobicContact SD-CB 3.83Å; M489-A525 PolarHBondContact SD-N 2.95Å
490	I	91.8	Very high	94.6	Very high	32 Å²	32	25.5 Å²	25.5	16%	0.164	13%	0.125	C	C	.	.	H	α-helix	trans	-65.4	-44.4	-173.3	-70.9	179.6	0	0	0	111.2	T435 I448 K486 Y487	T435-I490 HydrophobicContact CG2-CD1 4.1Å; T435-I490 HydrophobicContact CG2-CG2 4.26Å; I448-I490 HydrophobicContact CD1-CG2 3.72Å; I448-I490 HydrophobicContact CG1-CG2 3.39Å; I448-I490 WeakPolarHBondContact CG1-O 3.3Å; I448-I490 PolarHBondContact N-O 2.89Å; K486-I490 HydrophobicContact CD-CD1 4.16Å; K486-I490 VanDerWaalsContact CE-CD1 3.48Å; K486-I490 HydrophobicContact CG-CD1 3.69Å; K486-I490 HydrophobicContact CG-CG1 4.21Å; K486-I490 WeakPolarHBondContact O-CB 3.24Å; K486-I490 WeakPolarHBondContact O-CG1 3.35Å; K486-I490 PolarHBondContact O-N 3.35Å; Y487-I490 PolarHBondContact O-N 3.11Å
491	F	94	Very high	94.5	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-96.7	14.4	-176.6	-63.7	-72.2	0	0	0	114.7	T435 A438 I448 L457 Y487 N493 Q494 V495	T435-F491 HydrophobicContact CG2-CE2 3.88Å; T435-F491 HydrophobicContact CG2-CZ 4.16Å; A438-F491 HydrophobicContact CB-CE1 3.84Å; A438-F491 HydrophobicContact CB-CZ 3.75Å; I448-F491 HydrophobicContact CB-CD1 4.08Å; I448-F491 HydrophobicContact CB-CE1 4.26Å; I448-F491 HydrophobicContact CG1-CD1 3.75Å; I448-F491 HydrophobicContact CG1-CE1 3.62Å; I448-F491 HydrophobicContact CG1-CZ 4.3Å; I448-F491 HydrophobicContact CG2-CD1 4.35Å; I448-F491 HydrophobicContact CG2-CE1 4.28Å; L457-F491 HydrophobicContact CD1-CD1 3.45Å; L457-F491 VanDerWaalsContact CD1-CD1 3.45Å; L457-F491 HydrophobicContact CD1-CE1 3.73Å; L457-F491 HydrophobicContact CD1-CG 4.25Å; L457-F491 HydrophobicContact CD2-CD1 3.8Å; L457-F491 HydrophobicContact CD2-CD2 4.31Å; L457-F491 HydrophobicContact CD2-CE1 3.59Å; L457-F491 HydrophobicContact CD2-CE2 4.14Å; L457-F491 HydrophobicContact CD2-CG 4.16Å; L457-F491 HydrophobicContact CD2-CZ 3.79Å; L457-F491 HydrophobicContact CG-CD1 4.26Å; L457-F491 HydrophobicContact CG-CE1 4.33Å; Y487-F491 AromaticContact CD1-CD2 3.97Å; Y487-F491 HydrophobicContact CD1-CD2 3.97Å; Y487-F491 AromaticContact CD2-CD2 3.71Å; Y487-F491 HydrophobicContact CD2-CD2 3.71Å; Y487-F491 AromaticContact CD2-CE2 3.8Å; Y487-F491 HydrophobicContact CD2-CE2 3.8Å; Y487-F491 HydrophobicContact CE1-CB 4.28Å; Y487-F491 AromaticContact CE1-CD2 3.84Å; Y487-F491 HydrophobicContact CE1-CD2 3.84Å; Y487-F491 HydrophobicContact CE1-CG 4.35Å; Y487-F491 AromaticContact CE2-CD2 3.59Å; Y487-F491 HydrophobicContact CE2-CD2 3.59Å; Y487-F491 AromaticContact CE2-CE2 3.6Å; Y487-F491 HydrophobicContact CE2-CE2 3.6Å; Y487-F491 AromaticContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CD2 3.91Å; Y487-F491 HydrophobicContact CG-CE2 4.44Å; Y487-F491 AromaticContact CZ-CD2 3.67Å; Y487-F491 WeakPolarHBondContact O-CB 3.28Å; Y487-F491 PolarHBondContact O-N 2.67Å; F491-N493 PolarHBondContact O-N 3.37Å; F491-Q494 HydrophobicContact CB-CB 4.47Å; F491-Q494 HydrophobicContact CD1-CG 4.37Å; F491-Q494 WeakPolarHBondContact O-CA 3.28Å; F491-Q494 PolarHBondContact O-N 3.5Å; F491-V495 HydrophobicContact CB-CG2 4.11Å; F491-V495 PolarHBondContact O-N 3.49Å
492	R	93.4	Very high	94.4	Very high	13 Å²	13	31.3 Å²	31.3	5%	0.049	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-29.4	-178.6	64.7	-168.5	-179.9	-90.5	7.4	115.2	Q444 K445 H446 G447 I488 M489 L500 L529 M532	Q444-R492 PolarHBondContact O-NH2 2.92Å; K445-R492 VanDerWaalsContact C-NH2 3.27Å; K445-R492 PolarHBondContact O-NH2 3.2Å; H446-R492 VanDerWaalsContact C-NH2 3.32Å; G447-R492 VanDerWaalsContact N-NH2 3.12Å; I488-R492 WeakPolarHBondContact O-CA 3.4Å; I488-R492 VanDerWaalsContact O-CB 3.26Å; I488-R492 WeakPolarHBondContact O-CB 3.43Å; I488-R492 PolarHBondContact O-N 2.79Å; M489-R492 VanDerWaalsContact O-CD 3.29Å; M489-R492 WeakPolarHBondContact O-CD 3.38Å; M489-R492 VanDerWaalsContact O-CG 3.27Å; M489-R492 WeakPolarHBondContact O-CG 3.23Å; M489-R492 PolarHBondContact O-NH1 3.38Å; R492-L500 VanDerWaalsContact O-CD1 3.25Å; R492-L500 WeakPolarHBondContact O-CD1 3.32Å; R492-L529 HydrophobicContact CB-CD2 4.23Å; R492-M532 HydrophobicContact CB-CE 4.14Å; R492-M532 HydrophobicContact CB-SD 3.92Å; R492-M532 HydrophobicContact CG-CE 4.35Å; R492-M532 HydrophobicContact CG-SD 4.24Å; R492-M532 WeakPolarHBondContact O-CE 3.47Å
493	N	91	Very high	94.4	Very high	70 Å²	70	31.3 Å²	31.3	37%	0.374	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-8.1	177.3	-75.5	-33.3	0	0	0	114.3	H446 F491 M532	H446-N493 PolarHBondContact O-ND2 2.92Å; F491-N493 PolarHBondContact O-N 3.37Å; N493-M532 WeakPolarHBondContact OD1-CE 3.26Å
494	Q	90.7	Very high	94.5	Very high	66 Å²	66	30.9 Å²	30.9	31%	0.308	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-20.9	-178	-51	-55.9	-35.8	0	0	112.2	I448 A451 L457 F491	I448-Q494 HydrophobicContact CB-CG 4.37Å; I448-Q494 HydrophobicContact CG2-CG 4.18Å; I448-Q494 PolarHBondContact O-NE2 3.01Å; A451-Q494 HydrophobicContact CB-CG 4.35Å; L457-Q494 HydrophobicContact CD1-CB 3.8Å; L457-Q494 HydrophobicContact CD1-CG 4.23Å; F491-Q494 HydrophobicContact CB-CB 4.47Å; F491-Q494 HydrophobicContact CD1-CG 4.37Å; F491-Q494 WeakPolarHBondContact O-CA 3.28Å; F491-Q494 PolarHBondContact O-N 3.5Å
495	V	91.4	Very high	94.5	Very high	7 Å²	7	33 Å²	33	4%	0.042	17%	0.17	C	C	.	.	S	Bend	trans	-86.9	132.1	175.7	177.5	0	0	0	0	109.9	F461 Y487 F491 H499 L500	F461-V495 HydrophobicContact CD1-CG1 4.39Å; Y487-V495 HydrophobicContact CE1-CG2 4.47Å; F491-V495 HydrophobicContact CB-CG2 4.11Å; F491-V495 PolarHBondContact O-N 3.49Å; V495-H499 HydrophobicContact CG1-CB 3.7Å; V495-L500 HydrophobicContact CB-CD2 3.92Å; V495-L500 HydrophobicContact CB-CG 4.24Å; V495-L500 HydrophobicContact CG1-CD2 3.83Å; V495-L500 HydrophobicContact CG1-CG 4.02Å
496	P	93.2	Very high	94.6	Very high	47 Å²	47	34.6 Å²	34.6	31%	0.305	18%	0.178	S	C	.	.			trans	-54	143	177.4	-28.6	35	0	0	0	114.2	T458 E498 H499 L500	T458-P496 HydrophobicContact CG2-CG 4.29Å; T458-P496 WeakPolarHBondContact OG1-CD 3.42Å; P496-E498 HydrophobicContact CB-CG 4.02Å; P496-E498 PolarHBondContact O-N 2.98Å; P496-E498 VanDerWaalsContact O-N 3.1Å; P496-H499 PolarHBondContact O-N 3.49Å; P496-L500 PolarHBondContact O-N 3.45Å
497	K	94	Very high	94.7	Very high	78 Å²	78	33.5 Å²	33.5	34%	0.339	17%	0.173	S	C	.	.	H	α-helix	trans	-50.6	-39.7	-179.6	177.9	-177.2	169.8	173.1	0	112.7	H499 L500 L501 L540 F541 E545	K497-H499 PolarHBondContact O-N 3.19Å; K497-L500 PolarHBondContact O-N 3.04Å; K497-L501 WeakPolarHBondContact O-CB 3.36Å; K497-L501 PolarHBondContact O-N 3.48Å; K497-L540 HydrophobicContact CD-CD1 3.88Å; K497-L540 HydrophobicContact CD-CG 4.13Å; K497-L540 WeakPolarHBondContact CE-O 3.46Å; K497-L540 HydrophobicContact CG-CD1 4.34Å; K497-L540 HydrophobicContact CG-CD2 4.46Å; K497-L540 HydrophobicContact CG-CG 4.27Å; K497-L540 PolarHBondContact NZ-O 2.86Å; K497-F541 HydrophobicContact CG-CE1 4.28Å; K497-E545 VanDerWaalsContact CE-OE1 3.22Å; K497-E545 WeakPolarHBondContact CE-OE1 3.41Å; K497-E545 IonicContact NZ-OE1 3.64Å; K497-E545 PolarHBondContact NZ-OE1 3.31Å; K497-E545 IonicContact NZ-OE2 3.75Å; K497-E545 PolarHBondContact NZ-OE2 3.25Å
498	E	94.7	Very high	94.9	Very high	131 Å²	131	33.6 Å²	33.6	61%	0.612	17%	0.174	S	C	*	.	H	α-helix	trans	-60.7	-41.4	-179.3	62.9	-160.4	178.8	0	0	112.9	P496 L501 V502	P496-E498 HydrophobicContact CB-CG 4.02Å; P496-E498 PolarHBondContact O-N 2.98Å; P496-E498 VanDerWaalsContact O-N 3.1Å; E498-L501 PolarHBondContact O-N 3.38Å; E498-V502 WeakPolarHBondContact O-CG2 3.46Å; E498-V502 PolarHBondContact O-N 3.43Å
499	H	94.8	Very high	95	Very high	45 Å²	45	36.2 Å²	36.2	21%	0.208	19%	0.188	C	C	.	.	H	α-helix	trans	-70.7	-40.1	176.2	-70.4	-51.5	0	0	0	111.6	F461 V495 P496 K497 L501 V502 S503	F461-H499 HydrophobicContact CD1-CB 4.18Å; F461-H499 HydrophobicContact CE1-CB 3.77Å; V495-H499 HydrophobicContact CG1-CB 3.7Å; P496-H499 PolarHBondContact O-N 3.49Å; K497-H499 PolarHBondContact O-N 3.19Å; H499-L501 VanDerWaalsContact C-N 3.35Å; H499-L501 PolarHBondContact O-N 3.32Å; H499-V502 PolarHBondContact O-N 3.32Å; H499-S503 PolarHBondContact O-N 2.89Å; H499-S503 VanDerWaalsContact O-N 3.14Å; H499-S503 PolarHBondContact O-OG 3.1Å; H499-S503 VanDerWaalsContact O-OG 3.12Å
500	L	95.7	Very high	95.3	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-40.1	175.3	-61.4	176.5	0	0	0	112.1	I488 R492 V495 P496 K497 V502 S503 I504 L529 M532 F541	I488-L500 HydrophobicContact CG2-CD2 4Å; R492-L500 VanDerWaalsContact O-CD1 3.25Å; R492-L500 WeakPolarHBondContact O-CD1 3.32Å; V495-L500 HydrophobicContact CB-CD2 3.92Å; V495-L500 HydrophobicContact CB-CG 4.24Å; V495-L500 HydrophobicContact CG1-CD2 3.83Å; V495-L500 HydrophobicContact CG1-CG 4.02Å; P496-L500 PolarHBondContact O-N 3.45Å; K497-L500 PolarHBondContact O-N 3.04Å; L500-V502 VanDerWaalsContact C-N 3.33Å; L500-V502 PolarHBondContact O-N 2.77Å; L500-S503 WeakPolarHBondContact O-CB 3.47Å; L500-S503 PolarHBondContact O-N 3.35Å; L500-S503 VanDerWaalsContact O-N 3.13Å; L500-I504 PolarHBondContact O-N 3.24Å; L500-L529 HydrophobicContact CB-CD2 4.38Å; L500-L529 HydrophobicContact CD1-CD2 4.24Å; L500-L529 HydrophobicContact CD2-CD2 4.13Å; L500-L529 HydrophobicContact CG-CD2 4.5Å; L500-M532 HydrophobicContact CD1-CE 4.04Å; L500-M532 HydrophobicContact CD1-SD 4.19Å; L500-F541 HydrophobicContact CB-CE1 4.47Å; L500-F541 HydrophobicContact CB-CZ 3.79Å
501	L	95.5	Very high	95.6	Very high	53 Å²	53	34.4 Å²	34.4	28%	0.277	18%	0.179	S	C	.	.	H	α-helix	trans	-62.4	-40.9	176.8	-176.6	59.9	0	0	0	111.4	K497 E498 H499 S503 I504 P505 F541 E545	K497-L501 WeakPolarHBondContact O-CB 3.36Å; K497-L501 PolarHBondContact O-N 3.48Å; E498-L501 PolarHBondContact O-N 3.38Å; H499-L501 VanDerWaalsContact C-N 3.35Å; H499-L501 PolarHBondContact O-N 3.32Å; L501-S503 VanDerWaalsContact C-N 3.25Å; L501-S503 PolarHBondContact O-N 3.1Å; L501-I504 HydrophobicContact CD1-CD1 4.12Å; L501-I504 PolarHBondContact O-N 2.85Å; L501-P505 WeakPolarHBondContact O-CD 3.43Å; L501-F541 HydrophobicContact CB-CE1 4.09Å; L501-F541 HydrophobicContact CD1-CD1 4.06Å; L501-F541 HydrophobicContact CD1-CE1 4.2Å; L501-E545 HydrophobicContact CD1-CB 4.4Å
502	V	96.1	Very high	95.7	Very high	73 Å²	73	37.4 Å²	37.4	44%	0.442	19%	0.193	S	C	.	.	H	α-helix	trans	-63	-32.5	174.4	170.1	0	0	0	0	111.8	L466 E498 H499 L500 P505	L466-V502 HydrophobicContact CD1-CG1 4.47Å; E498-V502 WeakPolarHBondContact O-CG2 3.46Å; E498-V502 PolarHBondContact O-N 3.43Å; H499-V502 PolarHBondContact O-N 3.32Å; L500-V502 VanDerWaalsContact C-N 3.33Å; L500-V502 PolarHBondContact O-N 2.77Å; V502-P505 WeakPolarHBondContact O-CD 3.28Å; V502-P505 WeakPolarHBondContact O-CG 3.23Å
503	S	97.1	Very high	95.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-72.3	-25.7	178.6	-59.8	0	0	0	0	113.9	F461 H499 L500 L501 L506 L507	F461-S503 WeakPolarHBondContact CZ-OG 3.11Å; H499-S503 PolarHBondContact O-N 2.89Å; H499-S503 VanDerWaalsContact O-N 3.14Å; H499-S503 PolarHBondContact O-OG 3.1Å; H499-S503 VanDerWaalsContact O-OG 3.12Å; L500-S503 WeakPolarHBondContact O-CB 3.47Å; L500-S503 PolarHBondContact O-N 3.35Å; L500-S503 VanDerWaalsContact O-N 3.13Å; L501-S503 VanDerWaalsContact C-N 3.25Å; L501-S503 PolarHBondContact O-N 3.1Å; S503-L506 CarbonylContact O-C 3.49Å; S503-L506 WeakPolarHBondContact O-CA 3.42Å; S503-L506 WeakPolarHBondContact O-CB 3.38Å; S503-L506 PolarHBondContact O-N 2.97Å; S503-L507 WeakPolarHBondContact O-CG 3.4Å; S503-L507 PolarHBondContact O-N 3.22Å
504	I	97.7	Very high	96.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54.4	-54.6	-176.6	-70.1	174.3	0	0	0	113.2	L500 L501 L506 L507 I508 L526 L529 F530 F541 I546	L500-I504 PolarHBondContact O-N 3.24Å; L501-I504 HydrophobicContact CD1-CD1 4.12Å; L501-I504 PolarHBondContact O-N 2.85Å; I504-L506 PolarHBondContact O-N 3.37Å; I504-L507 PolarHBondContact O-N 3.04Å; I504-I508 HydrophobicContact CG2-CD1 3.86Å; I504-I508 VanDerWaalsContact O-CG1 3.31Å; I504-I508 WeakPolarHBondContact O-CG1 3.26Å; I504-I508 PolarHBondContact O-N 3.17Å; I504-L526 HydrophobicContact CG2-CD2 4.19Å; I504-L529 HydrophobicContact CG1-CD1 4.08Å; I504-F530 HydrophobicContact CD1-CE1 4.22Å; I504-F541 HydrophobicContact CD1-CD1 3.77Å; I504-F541 HydrophobicContact CD1-CE1 3.8Å; I504-F541 HydrophobicContact CD1-CG 4.14Å; I504-F541 HydrophobicContact CD1-CZ 4.21Å; I504-I546 HydrophobicContact CD1-CD1 3.63Å; I504-I546 HydrophobicContact CG2-CD1 4.25Å
505	P	97.8	Very high	96.5	Very high	45 Å²	45	38.6 Å²	38.6	29%	0.292	20%	0.199	S	C	.	.	H	α-helix	trans	-62.7	-29.5	177	23.7	-34.3	0	0	0	113	L501 V502 N509 F549	L501-P505 WeakPolarHBondContact O-CD 3.43Å; V502-P505 WeakPolarHBondContact O-CD 3.28Å; V502-P505 WeakPolarHBondContact O-CG 3.23Å; P505-N509 PolarHBondContact O-N 2.8Å; P505-F549 HydrophobicContact CB-CD1 4.15Å; P505-F549 HydrophobicContact CB-CE1 3.85Å; P505-F549 HydrophobicContact CB-CZ 4.27Å; P505-F549 HydrophobicContact CG-CE1 4.26Å; P505-F549 HydrophobicContact CG-CZ 4.2Å
506	L	98.2	Very high	96.8	Very high	34 Å²	34	40 Å²	40	18%	0.178	21%	0.206	C	C	.	.	H	α-helix	trans	-67.9	-46.5	174.8	-55	179.8	0	0	0	110.7	L466 L469 K470 S503 I504 I508 N509 H510	L466-L506 HydrophobicContact CD1-CD1 3.76Å; L469-L506 HydrophobicContact CB-CB 4.43Å; L469-L506 HydrophobicContact CB-CD1 4.02Å; K470-L506 HydrophobicContact CG-CD1 3.84Å; K470-L506 HydrophobicContact CG-CD2 4.31Å; S503-L506 CarbonylContact O-C 3.49Å; S503-L506 WeakPolarHBondContact O-CA 3.42Å; S503-L506 WeakPolarHBondContact O-CB 3.38Å; S503-L506 PolarHBondContact O-N 2.97Å; I504-L506 PolarHBondContact O-N 3.37Å; L506-I508 VanDerWaalsContact C-N 3.32Å; L506-I508 PolarHBondContact O-N 3.36Å; L506-N509 WeakPolarHBondContact O-CB 3.28Å; L506-N509 PolarHBondContact O-N 3.48Å; L506-N509 VanDerWaalsContact O-N 3.07Å; L506-H510 PolarHBondContact O-N 2.86Å; L506-H510 PolarHBondContact O-ND1 3.46Å
507	L	98.5	Very high	97	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-42	175.3	-66.5	172.5	0	0	0	111.3	I485 I488 S503 I504 N509 H510 L511 A525 L526 L529	I485-L507 HydrophobicContact CB-CD2 4.31Å; I485-L507 HydrophobicContact CG1-CD2 3.82Å; I485-L507 HydrophobicContact CG2-CD2 3.79Å; I488-L507 HydrophobicContact CD1-CD2 4.27Å; S503-L507 WeakPolarHBondContact O-CG 3.4Å; S503-L507 PolarHBondContact O-N 3.22Å; I504-L507 PolarHBondContact O-N 3.04Å; L507-N509 PolarHBondContact O-N 3.33Å; L507-H510 PolarHBondContact O-N 3.5Å; L507-H510 VanDerWaalsContact O-N 3.11Å; L507-L511 PolarHBondContact O-N 3.17Å; L507-A525 HydrophobicContact CD1-CB 3.93Å; L507-A525 HydrophobicContact CD2-CB 4.03Å; L507-L526 HydrophobicContact CB-CD1 4.35Å; L507-L526 HydrophobicContact CB-CD2 3.87Å; L507-L526 HydrophobicContact CB-CG 3.91Å; L507-L526 HydrophobicContact CD1-CD2 4.23Å; L507-L526 HydrophobicContact CD1-CG 4.41Å; L507-L529 HydrophobicContact CD1-CD1 3.59Å
508	I	98.5	Very high	97.2	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-37.7	174.4	-68	166.5	0	0	0	111.3	I504 L506 L511 L526 F549 I552 L553 N556	I504-I508 HydrophobicContact CG2-CD1 3.86Å; I504-I508 VanDerWaalsContact O-CG1 3.31Å; I504-I508 WeakPolarHBondContact O-CG1 3.26Å; I504-I508 PolarHBondContact O-N 3.17Å; L506-I508 VanDerWaalsContact C-N 3.32Å; L506-I508 PolarHBondContact O-N 3.36Å; I508-L511 WeakPolarHBondContact O-CB 3.28Å; I508-L511 PolarHBondContact O-N 2.84Å; I508-L526 HydrophobicContact CG1-CD1 4.09Å; I508-L526 HydrophobicContact CG1-CD2 4.09Å; I508-F549 HydrophobicContact CD1-CB 3.71Å; I508-F549 HydrophobicContact CD1-CG 4.34Å; I508-I552 HydrophobicContact CG2-CB 4.49Å; I508-I552 HydrophobicContact CG2-CG1 4.02Å; I508-I552 HydrophobicContact CG2-CG2 4.1Å; I508-L553 HydrophobicContact CD1-CB 3.94Å; I508-L553 HydrophobicContact CD1-CD1 4.12Å; I508-L553 HydrophobicContact CG1-CB 4.3Å; I508-L553 HydrophobicContact CG1-CD1 3.8Å; I508-N556 HydrophobicContact CG2-CB 4.45Å; I508-N556 PolarHBondContact O-ND2 3.01Å
509	N	98.1	Very high	97.4	Very high	56 Å²	56	27.9 Å²	27.9	30%	0.299	15%	0.146	S	C	.	.	H	α-helix	trans	-68	-38.4	175.9	-166.7	42.4	0	0	0	112.2	V474 P505 L506 L507 L511 Q512	V474-N509 WeakPolarHBondContact CG1-ND2 3.46Å; P505-N509 PolarHBondContact O-N 2.8Å; L506-N509 WeakPolarHBondContact O-CB 3.28Å; L506-N509 PolarHBondContact O-N 3.48Å; L506-N509 VanDerWaalsContact O-N 3.07Å; L507-N509 PolarHBondContact O-N 3.33Å; N509-L511 PolarHBondContact O-N 3.09Å; N509-Q512 WeakPolarHBondContact O-CB 3.3Å; N509-Q512 PolarHBondContact O-N 3.43Å; N509-Q512 VanDerWaalsContact O-N 3.1Å; N509-Q512 PolarHBondContact OD1-NE2 3.37Å
510	H	98.4	Very high	97.6	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-69.3	-14.8	179.1	-73.3	78.7	0	0	0	114.2	L469 I485 L506 L507 Q512 A513 V518 H519 A522	L469-H510 PolarHBondContact O-CE1 3.03Å; L469-H510 VanDerWaalsContact O-CE1 3.31Å; I485-H510 HydrophobicContact CD1-CB 4.1Å; L506-H510 PolarHBondContact O-N 2.86Å; L506-H510 PolarHBondContact O-ND1 3.46Å; L507-H510 PolarHBondContact O-N 3.5Å; L507-H510 VanDerWaalsContact O-N 3.11Å; H510-Q512 PolarHBondContact O-N 2.87Å; H510-Q512 VanDerWaalsContact O-N 3.1Å; H510-A513 VanDerWaalsContact O-CB 3.28Å; H510-A513 WeakPolarHBondContact O-CB 3.13Å; H510-A513 PolarHBondContact O-N 3.14Å; H510-V518 HydrophobicContact CB-CG1 4.27Å; H510-H519 WeakPolarHBondContact O-CB 3.35Å; H510-A522 HydrophobicContact CB-CB 3.86Å
511	L	98.4	Very high	97.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-17.3	167.4	-67.4	173.1	0	0	0	113	L507 I508 N509 A522 A523 L526 N556 L557	L507-L511 PolarHBondContact O-N 3.17Å; I508-L511 WeakPolarHBondContact O-CB 3.28Å; I508-L511 PolarHBondContact O-N 2.84Å; N509-L511 PolarHBondContact O-N 3.09Å; L511-A522 HydrophobicContact CD2-CB 4.04Å; L511-A522 HydrophobicContact CG-CB 4.38Å; L511-A523 HydrophobicContact CD2-CB 3.79Å; L511-L526 HydrophobicContact CD1-CD1 3.83Å; L511-L526 HydrophobicContact CD2-CD1 4.38Å; L511-L526 HydrophobicContact CG-CD1 4.21Å; L511-N556 HydrophobicContact CB-CB 3.92Å; L511-N556 HydrophobicContact CD1-CB 3.93Å; L511-L557 HydrophobicContact CD1-CD2 3.68Å; L511-L557 HydrophobicContact CD1-CG 3.73Å; L511-L557 HydrophobicContact CD2-CD2 3.88Å; L511-L557 HydrophobicContact CG-CD2 4.46Å
512	Q	97.4	Very high	97.8	Very high	64 Å²	64	23.2 Å²	23.2	30%	0.299	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-0.8	177.6	-55.6	-172.2	83.1	0	0	113.7	N509 H510 N556 K559	N509-Q512 WeakPolarHBondContact O-CB 3.3Å; N509-Q512 PolarHBondContact O-N 3.43Å; N509-Q512 VanDerWaalsContact O-N 3.1Å; N509-Q512 PolarHBondContact OD1-NE2 3.37Å; H510-Q512 PolarHBondContact O-N 2.87Å; H510-Q512 VanDerWaalsContact O-N 3.1Å; Q512-N556 HydrophobicContact CG-CB 4.45Å; Q512-K559 VanDerWaalsContact OE1-NZ 3.08Å
513	A	97.6	Very high	97.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.102	C	C	.	.			trans	-64.1	143.1	-178.5	0	0	0	0	0	111.6	V474 N475 H510 S515 V518 H519 L563	V474-A513 HydrophobicContact CB-CB 4.47Å; V474-A513 HydrophobicContact CG2-CB 4.39Å; N475-A513 VanDerWaalsContact OD1-CA 3.26Å; N475-A513 WeakPolarHBondContact OD1-CA 3.33Å; H510-A513 VanDerWaalsContact O-CB 3.28Å; H510-A513 WeakPolarHBondContact O-CB 3.13Å; H510-A513 PolarHBondContact O-N 3.14Å; A513-S515 VanDerWaalsContact C-N 3.34Å; A513-V518 HydrophobicContact CB-CB 3.78Å; A513-V518 HydrophobicContact CB-CG1 3.49Å; A513-V518 VanDerWaalsContact CB-CG1 3.49Å; A513-H519 PolarHBondContact O-ND1 3.41Å; A513-L563 WeakPolarHBondContact O-CD1 3.37Å
514	E	96.8	Very high	98	Very high	151 Å²	151	21.1 Å²	21.1	71%	0.706	11%	0.108	S	C	*	.	S	Bend	trans	-68.9	-34.6	176.8	-71.8	172	-156.8	0	0	111.7	N475 I516	N475-E514 VanDerWaalsContact ND2-CD 3.34Å; N475-E514 WeakPolarHBondContact ND2-CG 3.39Å; N475-E514 PolarHBondContact ND2-OE1 3Å; N475-E514 VanDerWaalsContact ND2-OE1 3.09Å; N475-E514 PolarHBondContact OD1-N 3.4Å; E514-I516 PolarHBondContact O-N 3.14Å
515	S	97.4	Very high	97.9	Very high	23 Å²	23	21.1 Å²	21.1	16%	0.161	11%	0.109	C	C	.	.	S	Bend	trans	-64.9	124.3	175.3	169.6	0	0	0	0	111.1	F362 A513 V517 V518 H519	F362-S515 WeakPolarHBondContact CE1-OG 3.16Å; A513-S515 VanDerWaalsContact C-N 3.34Å; S515-V517 VanDerWaalsContact C-N 3.28Å; S515-V517 PolarHBondContact O-N 3.37Å; S515-V517 PolarHBondContact OG-N 3.49Å; S515-V518 PolarHBondContact O-N 3.12Å; S515-V518 PolarHBondContact OG-N 3.31Å; S515-H519 PolarHBondContact O-N 3.13Å; S515-H519 PolarHBondContact O-ND1 3.41Å
516	I	97.7	Very high	98	Very high	37 Å²	37	19 Å²	19	19%	0.19	10%	0.095	C	C	.	.	H	α-helix	trans	-56.3	-44.6	175.6	-62.7	170.8	0	0	0	110.7	S366 I370 E514 V518 H519 T520	S366-I516 WeakPolarHBondContact OG-CB 3.07Å; S366-I516 WeakPolarHBondContact OG-CD1 3.47Å; S366-I516 WeakPolarHBondContact OG-CG2 3.2Å; I370-I516 HydrophobicContact CD1-CG2 4.22Å; E514-I516 PolarHBondContact O-N 3.14Å; I516-V518 PolarHBondContact O-N 3.31Å; I516-H519 WeakPolarHBondContact CA-CE1 3.41Å; I516-H519 PolarHBondContact O-CD2 2.82Å; I516-T520 WeakPolarHBondContact O-CB 3.43Å; I516-T520 PolarHBondContact O-N 2.97Å; I516-T520 PolarHBondContact O-OG1 3.07Å
517	V	97.6	Very high	97.8	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61	-46.7	-180	-174	0	0	0	0	111.2	F362 Y369 I370 A482 S515 T520 Y521	F362-V517 HydrophobicContact CD1-CG2 4.49Å; F362-V517 HydrophobicContact CD2-CB 3.98Å; F362-V517 HydrophobicContact CD2-CG1 3.96Å; F362-V517 HydrophobicContact CD2-CG2 3.76Å; F362-V517 HydrophobicContact CE1-CB 4.44Å; F362-V517 HydrophobicContact CE2-CB 3.48Å; F362-V517 VanDerWaalsContact CE2-CB 3.48Å; F362-V517 HydrophobicContact CE2-CG1 3.44Å; F362-V517 VanDerWaalsContact CE2-CG1 3.44Å; F362-V517 HydrophobicContact CE2-CG2 3.81Å; F362-V517 HydrophobicContact CG-CG2 4.12Å; F362-V517 HydrophobicContact CZ-CB 3.74Å; F362-V517 HydrophobicContact CZ-CG1 4.14Å; F362-V517 HydrophobicContact CZ-CG2 4.19Å; Y369-V517 HydrophobicContact CD1-CG1 4Å; Y369-V517 HydrophobicContact CD1-CG2 4.07Å; Y369-V517 HydrophobicContact CE1-CG1 4Å; I370-V517 HydrophobicContact CD1-CG2 4.34Å; I370-V517 HydrophobicContact CG1-CG1 4.28Å; I370-V517 HydrophobicContact CG1-CG2 4.22Å; A482-V517 HydrophobicContact CB-CG1 4.05Å; S515-V517 VanDerWaalsContact C-N 3.28Å; S515-V517 PolarHBondContact O-N 3.37Å; S515-V517 PolarHBondContact OG-N 3.49Å; V517-T520 PolarHBondContact O-N 3.42Å; V517-Y521 HydrophobicContact CG1-CD1 4.09Å; V517-Y521 HydrophobicContact CG1-CD2 4.24Å; V517-Y521 HydrophobicContact CG1-CE1 3.77Å; V517-Y521 HydrophobicContact CG1-CE2 3.91Å; V517-Y521 HydrophobicContact CG1-CG 4.31Å; V517-Y521 WeakPolarHBondContact O-CB 3.36Å; V517-Y521 WeakPolarHBondContact O-CD1 3.37Å; V517-Y521 PolarHBondContact O-N 2.94Å
518	V	98.2	Very high	97.6	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.6	-52	-175.8	176.8	0	0	0	0	112	F362 P478 K481 A482 I485 H510 A513 S515 I516 T520 Y521 A522	F362-V518 HydrophobicContact CZ-CG2 4.29Å; P478-V518 HydrophobicContact CB-CG2 3.79Å; P478-V518 WeakPolarHBondContact O-CG2 3.47Å; K481-V518 HydrophobicContact CB-CG1 3.98Å; K481-V518 HydrophobicContact CB-CG2 4.12Å; A482-V518 HydrophobicContact CB-CG2 4.29Å; I485-V518 HydrophobicContact CD1-CG1 3.96Å; H510-V518 HydrophobicContact CB-CG1 4.27Å; A513-V518 HydrophobicContact CB-CB 3.78Å; A513-V518 HydrophobicContact CB-CG1 3.49Å; A513-V518 VanDerWaalsContact CB-CG1 3.49Å; S515-V518 PolarHBondContact O-N 3.12Å; S515-V518 PolarHBondContact OG-N 3.31Å; I516-V518 PolarHBondContact O-N 3.31Å; V518-T520 VanDerWaalsContact C-N 3.29Å; V518-T520 PolarHBondContact O-N 3.08Å; V518-Y521 PolarHBondContact O-N 3.4Å; V518-A522 WeakPolarHBondContact O-CB 3.41Å; V518-A522 PolarHBondContact O-N 3.08Å
519	H	98.3	Very high	97.4	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-72.1	-27.1	-178.9	63	-122.1	0	0	0	112.1	H510 A513 S515 I516 A522 A523 L563 S566	H510-H519 WeakPolarHBondContact O-CB 3.35Å; A513-H519 PolarHBondContact O-ND1 3.41Å; S515-H519 PolarHBondContact O-N 3.13Å; S515-H519 PolarHBondContact O-ND1 3.41Å; I516-H519 WeakPolarHBondContact CA-CE1 3.41Å; I516-H519 PolarHBondContact O-CD2 2.82Å; H519-A522 PolarHBondContact O-N 3.38Å; H519-A523 WeakPolarHBondContact O-CB 3.49Å; H519-A523 PolarHBondContact O-N 2.94Å; H519-L563 WeakPolarHBondContact ND1-CD1 3.47Å; H519-S566 WeakPolarHBondContact NE2-CB 3.49Å; H519-S566 PolarHBondContact NE2-OG 3Å
520	T	98.3	Very high	97.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65.7	-47.4	172.5	-61.4	0	0	0	0	111	I370 I516 V517 V518 A522 A523 H524 N569 Y571	I370-T520 HydrophobicContact CD1-CG2 3.85Å; I370-T520 HydrophobicContact CG1-CG2 4.46Å; I370-T520 HydrophobicContact CG2-CG2 4.14Å; I516-T520 WeakPolarHBondContact O-CB 3.43Å; I516-T520 PolarHBondContact O-N 2.97Å; I516-T520 PolarHBondContact O-OG1 3.07Å; V517-T520 PolarHBondContact O-N 3.42Å; V518-T520 VanDerWaalsContact C-N 3.29Å; V518-T520 PolarHBondContact O-N 3.08Å; T520-A522 VanDerWaalsContact C-N 3.31Å; T520-A522 PolarHBondContact O-N 2.9Å; T520-A523 PolarHBondContact O-N 2.98Å; T520-H524 WeakPolarHBondContact O-CB 3.24Å; T520-H524 PolarHBondContact O-N 3.36Å; T520-N569 PolarHBondContact OG1-ND2 2.93Å; T520-Y571 HydrophobicContact CG2-CD1 4.45Å; T520-Y571 HydrophobicContact CG2-CD2 3.51Å; T520-Y571 HydrophobicContact CG2-CE2 4.28Å; T520-Y571 HydrophobicContact CG2-CG 3.64Å
521	Y	98	Very high	96.9	Very high	1 Å²	1	18.2 Å²	18.2	0%	0.004	9%	0.09	C	C	.	.	H	α-helix	trans	-63.9	-39.8	176.6	-78.2	17.2	0	0	0	110.7	Y369 I370 D373 L374 A482 I485 K486 M489 V517 V518 A523 H524 A525	Y369-Y521 WeakPolarHBondContact CE1-OH 3.43Å; I370-Y521 HydrophobicContact CB-CE1 4.48Å; I370-Y521 HydrophobicContact CG1-CE1 3.95Å; I370-Y521 HydrophobicContact CG2-CE1 4.3Å; D373-Y521 WeakPolarHBondContact CB-OH 3.36Å; D373-Y521 PolarHBondContact OD2-OH 2.85Å; L374-Y521 HydrophobicContact CD1-CD1 3.92Å; L374-Y521 HydrophobicContact CD1-CE1 3.72Å; L374-Y521 HydrophobicContact CD2-CD1 4.43Å; L374-Y521 HydrophobicContact CD2-CE1 3.92Å; L374-Y521 HydrophobicContact CG-CD1 4.41Å; L374-Y521 HydrophobicContact CG-CE1 3.77Å; A482-Y521 HydrophobicContact CB-CD2 3.82Å; A482-Y521 HydrophobicContact CB-CE2 3.99Å; A482-Y521 WeakPolarHBondContact O-CD2 3.28Å; I485-Y521 VanDerWaalsContact CG2-C 3.45Å; I485-Y521 VanDerWaalsContact CG2-O 3.3Å; I485-Y521 WeakPolarHBondContact CG2-O 3.41Å; K486-Y521 HydrophobicContact CB-CD2 4.21Å; K486-Y521 HydrophobicContact CB-CE2 4.22Å; K486-Y521 HydrophobicContact CD-CE2 4.49Å; M489-Y521 HydrophobicContact CE-CG 4.49Å; V517-Y521 HydrophobicContact CG1-CD1 4.09Å; V517-Y521 HydrophobicContact CG1-CD2 4.24Å; V517-Y521 HydrophobicContact CG1-CE1 3.77Å; V517-Y521 HydrophobicContact CG1-CE2 3.91Å; V517-Y521 HydrophobicContact CG1-CG 4.31Å; V517-Y521 WeakPolarHBondContact O-CB 3.36Å; V517-Y521 WeakPolarHBondContact O-CD1 3.37Å; V517-Y521 PolarHBondContact O-N 2.94Å; V518-Y521 PolarHBondContact O-N 3.4Å; Y521-A523 PolarHBondContact O-N 3Å; Y521-H524 PolarHBondContact O-N 2.7Å; Y521-A525 VanDerWaalsContact O-CB 3.24Å; Y521-A525 WeakPolarHBondContact O-CB 3.36Å; Y521-A525 PolarHBondContact O-N 2.83Å
522	A	98.5	Very high	96.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60	-45.7	175.8	0	0	0	0	0	111.5	I485 H510 L511 V518 H519 T520 A525 L526	I485-A522 HydrophobicContact CD1-CB 4.08Å; H510-A522 HydrophobicContact CB-CB 3.86Å; L511-A522 HydrophobicContact CD2-CB 4.04Å; L511-A522 HydrophobicContact CG-CB 4.38Å; V518-A522 WeakPolarHBondContact O-CB 3.41Å; V518-A522 PolarHBondContact O-N 3.08Å; H519-A522 PolarHBondContact O-N 3.38Å; T520-A522 VanDerWaalsContact C-N 3.31Å; T520-A522 PolarHBondContact O-N 2.9Å; A522-A525 PolarHBondContact O-N 3.46Å; A522-L526 WeakPolarHBondContact O-CG 3.32Å; A522-L526 PolarHBondContact O-N 3.4Å
523	A	98.6	Very high	96	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62	-46.9	175	0	0	0	0	0	111.8	L511 H519 T520 Y521 A525 L526 E527 L557 I572 A575	L511-A523 HydrophobicContact CD2-CB 3.79Å; H519-A523 WeakPolarHBondContact O-CB 3.49Å; H519-A523 PolarHBondContact O-N 2.94Å; T520-A523 PolarHBondContact O-N 2.98Å; Y521-A523 PolarHBondContact O-N 3Å; A523-A525 VanDerWaalsContact C-N 3.34Å; A523-A525 PolarHBondContact O-N 3.19Å; A523-L526 PolarHBondContact O-N 3.12Å; A523-E527 WeakPolarHBondContact O-CB 3.22Å; A523-E527 PolarHBondContact O-N 3.24Å; A523-L557 HydrophobicContact CB-CD2 4.4Å; A523-I572 HydrophobicContact CB-CB 4.34Å; A523-I572 HydrophobicContact CB-CG1 3.76Å; A523-A575 HydrophobicContact CB-CB 3.97Å; A523-A575 WeakPolarHBondContact O-CB 3.46Å
524	H	97.1	Very high	95.4	Very high	29 Å²	29	23.4 Å²	23.4	13%	0.134	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-41.7	178.1	-167.5	59.9	0	0	0	111.9	M489 T520 Y521 E527 R528 Y571	M489-H524 HydrophobicContact SD-CB 3.88Å; M489-H524 PolarHBondContact SD-CD2 2.94Å; T520-H524 WeakPolarHBondContact O-CB 3.24Å; T520-H524 PolarHBondContact O-N 3.36Å; Y521-H524 PolarHBondContact O-N 2.7Å; H524-E527 WeakPolarHBondContact O-CB 3.28Å; H524-E527 PolarHBondContact O-N 3.39Å; H524-R528 PolarHBondContact CE1-NH1 2.84Å; H524-R528 PolarHBondContact ND1-NH1 3.44Å; H524-R528 VanDerWaalsContact O-CG 3.25Å; H524-R528 WeakPolarHBondContact O-CG 3.44Å; H524-R528 PolarHBondContact O-N 3.38Å; H524-Y571 HydrophobicContact CB-CD1 3.87Å; H524-Y571 AromaticContact CE1-CD1 3.99Å; H524-Y571 AromaticContact CE1-CE1 3.9Å; H524-Y571 AromaticContact CG-CD1 3.73Å; H524-Y571 AromaticContact ND1-CD1 3.37Å; H524-Y571 WeakPolarHBondContact ND1-CD1 3.33Å; H524-Y571 AromaticContact ND1-CE1 3.75Å
525	A	97.3	Very high	94.5	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-47.8	177	0	0	0	0	0	111.8	I485 M489 L507 Y521 A522 A523 E527 R528 L529	I485-A525 HydrophobicContact CG2-CB 3.61Å; M489-A525 HydrophobicContact CG-CB 3.51Å; M489-A525 HydrophobicContact SD-CB 3.83Å; M489-A525 PolarHBondContact SD-N 2.95Å; L507-A525 HydrophobicContact CD1-CB 3.93Å; L507-A525 HydrophobicContact CD2-CB 4.03Å; Y521-A525 VanDerWaalsContact O-CB 3.24Å; Y521-A525 WeakPolarHBondContact O-CB 3.36Å; Y521-A525 PolarHBondContact O-N 2.83Å; A522-A525 PolarHBondContact O-N 3.46Å; A523-A525 VanDerWaalsContact C-N 3.34Å; A523-A525 PolarHBondContact O-N 3.19Å; A525-E527 VanDerWaalsContact C-N 3.28Å; A525-E527 PolarHBondContact O-N 3.25Å; A525-R528 PolarHBondContact O-N 2.94Å; A525-L529 WeakPolarHBondContact O-CB 3.37Å; A525-L529 VanDerWaalsContact O-CG 3.28Å; A525-L529 WeakPolarHBondContact O-CG 3.42Å; A525-L529 PolarHBondContact O-N 3.42Å
526	L	98.3	Very high	93.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.3	-44.6	174.9	-72.6	166.7	0	0	0	111.2	I504 L507 I508 L511 A522 A523 R528 L529 F530 L553	I504-L526 HydrophobicContact CG2-CD2 4.19Å; L507-L526 HydrophobicContact CB-CD1 4.35Å; L507-L526 HydrophobicContact CB-CD2 3.87Å; L507-L526 HydrophobicContact CB-CG 3.91Å; L507-L526 HydrophobicContact CD1-CD2 4.23Å; L507-L526 HydrophobicContact CD1-CG 4.41Å; I508-L526 HydrophobicContact CG1-CD1 4.09Å; I508-L526 HydrophobicContact CG1-CD2 4.09Å; L511-L526 HydrophobicContact CD1-CD1 3.83Å; L511-L526 HydrophobicContact CD2-CD1 4.38Å; L511-L526 HydrophobicContact CG-CD1 4.21Å; A522-L526 WeakPolarHBondContact O-CG 3.32Å; A522-L526 PolarHBondContact O-N 3.4Å; A523-L526 PolarHBondContact O-N 3.12Å; L526-R528 PolarHBondContact O-N 2.61Å; L526-L529 PolarHBondContact O-N 3.07Å; L526-F530 HydrophobicContact CB-CE2 4.31Å; L526-F530 HydrophobicContact CD2-CZ 4.04Å; L526-F530 WeakPolarHBondContact O-CB 3.41Å; L526-F530 WeakPolarHBondContact O-CD2 3.3Å; L526-F530 WeakPolarHBondContact O-CG 3.45Å; L526-F530 PolarHBondContact O-N 3.01Å; L526-L553 HydrophobicContact CD1-CD1 3.96Å
527	E	95.4	Very high	92.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-63.1	-42.3	178.3	-159.5	-92.6	124.8	0	0	112.6	A523 H524 A525 T531 K574 A575 R578	A523-E527 WeakPolarHBondContact O-CB 3.22Å; A523-E527 PolarHBondContact O-N 3.24Å; H524-E527 WeakPolarHBondContact O-CB 3.28Å; H524-E527 PolarHBondContact O-N 3.39Å; A525-E527 VanDerWaalsContact C-N 3.28Å; A525-E527 PolarHBondContact O-N 3.25Å; E527-T531 WeakPolarHBondContact O-CG2 3.47Å; E527-T531 PolarHBondContact O-N 3.06Å; E527-T531 PolarHBondContact O-OG1 3.47Å; E527-T531 VanDerWaalsContact O-OG1 3.11Å; E527-K574 HydrophobicContact CG-CB 4.41Å; E527-K574 HydrophobicContact CG-CD 4.43Å; E527-K574 HydrophobicContact CG-CG 3.94Å; E527-K574 VanDerWaalsContact OE2-CD 3.25Å; E527-K574 WeakPolarHBondContact OE2-CD 3.36Å; E527-K574 VanDerWaalsContact OE2-CE 3.27Å; E527-K574 WeakPolarHBondContact OE2-CE 3.27Å; E527-A575 HydrophobicContact CB-CB 4.12Å; E527-R578 HydrophobicContact CG-CB 3.62Å; E527-R578 HydrophobicContact CG-CG 3.96Å; E527-R578 IonicContact OE1-NE 2.75Å; E527-R578 PolarHBondContact OE1-NE 2.94Å; E527-R578 IonicContact OE1-NH2 3.41Å
528	R	93.3	Very high	92.1	Very high	32 Å²	32	35.5 Å²	35.5	12%	0.121	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-45.6	173.9	-67.1	-74.4	72.7	69.8	2.2	111.8	H524 A525 L526 F530 T531 M532	H524-R528 PolarHBondContact CE1-NH1 2.84Å; H524-R528 PolarHBondContact ND1-NH1 3.44Å; H524-R528 VanDerWaalsContact O-CG 3.25Å; H524-R528 WeakPolarHBondContact O-CG 3.44Å; H524-R528 PolarHBondContact O-N 3.38Å; A525-R528 PolarHBondContact O-N 2.94Å; L526-R528 PolarHBondContact O-N 2.61Å; R528-F530 VanDerWaalsContact C-N 3.35Å; R528-F530 PolarHBondContact O-N 3.43Å; R528-T531 PolarHBondContact O-N 3.38Å; R528-T531 PolarHBondContact O-OG1 3.27Å; R528-M532 WeakPolarHBondContact O-CG 3.37Å; R528-M532 PolarHBondContact O-N 2.99Å
529	L	95.5	Very high	91.5	Very high	2 Å²	2	38 Å²	38	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-43.5	178.9	-69.5	178.6	0	0	0	111.2	I488 R492 L500 I504 L507 A525 L526 T531 M532 F541	I488-L529 HydrophobicContact CG2-CD1 4.29Å; I488-L529 HydrophobicContact CG2-CD2 4.3Å; R492-L529 HydrophobicContact CB-CD2 4.23Å; L500-L529 HydrophobicContact CB-CD2 4.38Å; L500-L529 HydrophobicContact CD1-CD2 4.24Å; L500-L529 HydrophobicContact CD2-CD2 4.13Å; L500-L529 HydrophobicContact CG-CD2 4.5Å; I504-L529 HydrophobicContact CG1-CD1 4.08Å; L507-L529 HydrophobicContact CD1-CD1 3.59Å; A525-L529 WeakPolarHBondContact O-CB 3.37Å; A525-L529 VanDerWaalsContact O-CG 3.28Å; A525-L529 WeakPolarHBondContact O-CG 3.42Å; A525-L529 PolarHBondContact O-N 3.42Å; L526-L529 PolarHBondContact O-N 3.07Å; L529-T531 PolarHBondContact O-N 3.42Å; L529-M532 HydrophobicContact CD2-SD 3.66Å; L529-M532 WeakPolarHBondContact O-CB 3.38Å; L529-M532 PolarHBondContact O-N 3.44Å; L529-F541 HydrophobicContact CB-CD2 4.38Å; L529-F541 HydrophobicContact CB-CE2 3.91Å; L529-F541 HydrophobicContact CD2-CE2 4.2Å; L529-F541 VanDerWaalsContact O-CD2 3.3Å; L529-F541 WeakPolarHBondContact O-CD2 3.49Å
530	F	94.4	Very high	91.2	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.022	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-9.5	179.6	-63.1	-15.4	0	0	0	114.5	I504 L526 R528 I546 L553 R578 L582	I504-F530 HydrophobicContact CD1-CE1 4.22Å; L526-F530 HydrophobicContact CB-CE2 4.31Å; L526-F530 HydrophobicContact CD2-CZ 4.04Å; L526-F530 WeakPolarHBondContact O-CB 3.41Å; L526-F530 WeakPolarHBondContact O-CD2 3.3Å; L526-F530 WeakPolarHBondContact O-CG 3.45Å; L526-F530 PolarHBondContact O-N 3.01Å; R528-F530 VanDerWaalsContact C-N 3.35Å; R528-F530 PolarHBondContact O-N 3.43Å; F530-I546 HydrophobicContact CE1-CD1 3.87Å; F530-I546 HydrophobicContact CE1-CG1 4.09Å; F530-I546 HydrophobicContact CZ-CG2 4.21Å; F530-L553 HydrophobicContact CE2-CD2 3.99Å; F530-L553 HydrophobicContact CZ-CD2 4.12Å; F530-R578 HydrophobicContact CB-CG 3.62Å; F530-R578 HydrophobicContact CD2-CG 4.38Å; F530-L582 HydrophobicContact CB-CD2 3.92Å; F530-L582 HydrophobicContact CD1-CD2 3.47Å; F530-L582 VanDerWaalsContact CD1-CD2 3.47Å; F530-L582 HydrophobicContact CD2-CD2 4.09Å; F530-L582 HydrophobicContact CE1-CD2 3.96Å; F530-L582 HydrophobicContact CG-CD2 3.55Å; F530-L582 HydrophobicContact CZ-CD2 4.46Å
531	T	90.3	Very high	91	Very high	36 Å²	36	39.8 Å²	39.8	22%	0.221	22%	0.222	C	C	.	.	H	α-helix	trans	-100.3	-7.4	173.9	47.9	0	0	0	0	114.2	E527 R528 L529 R578	E527-T531 WeakPolarHBondContact O-CG2 3.47Å; E527-T531 PolarHBondContact O-N 3.06Å; E527-T531 PolarHBondContact O-OG1 3.47Å; E527-T531 VanDerWaalsContact O-OG1 3.11Å; R528-T531 PolarHBondContact O-N 3.38Å; R528-T531 PolarHBondContact O-OG1 3.27Å; L529-T531 PolarHBondContact O-N 3.42Å; T531-R578 VanDerWaalsContact CG2-CD 3.46Å; T531-R578 HydrophobicContact CG2-CG 4.18Å
532	M	90.3	Very high	90.7	Very high	15 Å²	15	42.6 Å²	42.6	7%	0.074	24%	0.239	C	C	.	.			trans	-60.9	142	179.3	-69.1	179.5	73.7	0	0	111.6	R492 N493 L500 R528 L529 T539 L540 F541	R492-M532 HydrophobicContact CB-CE 4.14Å; R492-M532 HydrophobicContact CB-SD 3.92Å; R492-M532 HydrophobicContact CG-CE 4.35Å; R492-M532 HydrophobicContact CG-SD 4.24Å; R492-M532 WeakPolarHBondContact O-CE 3.47Å; N493-M532 WeakPolarHBondContact OD1-CE 3.26Å; L500-M532 HydrophobicContact CD1-CE 4.04Å; L500-M532 HydrophobicContact CD1-SD 4.19Å; R528-M532 WeakPolarHBondContact O-CG 3.37Å; R528-M532 PolarHBondContact O-N 2.99Å; L529-M532 HydrophobicContact CD2-SD 3.66Å; L529-M532 WeakPolarHBondContact O-CB 3.38Å; L529-M532 PolarHBondContact O-N 3.44Å; M532-T539 CarbonylContact O-C 3.56Å; M532-T539 WeakPolarHBondContact O-CA 3.44Å; M532-L540 HydrophobicContact CB-CB 3.8Å; M532-L540 HydrophobicContact CB-CD2 4.09Å; M532-L540 HydrophobicContact CE-CD2 3.49Å; M532-L540 VanDerWaalsContact CE-CD2 3.49Å; M532-L540 PolarHBondContact O-N 3.26Å; M532-L540 HydrophobicContact SD-CD2 3.96Å; M532-F541 HydrophobicContact SD-CE2 4.2Å
533	R	87.3	Confident	90.4	Very high	139 Å²	139	44.3 Å²	44.3	53%	0.525	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-110.7	135.4	179.4	-58.5	-60.2	-175.9	176.5	-3.7	110.3	N537 A538	R533-N537 WeakPolarHBondContact CD-O 3.11Å; R533-A538 CarbonylContact C-O 3.31Å; R533-A538 VanDerWaalsContact CA-O 3.28Å; R533-A538 WeakPolarHBondContact CA-O 3.47Å
534	G	84	Confident	90.2	Very high	20 Å²	20	48.1 Å²	48.1	21%	0.206	28%	0.284	C	S	.	.			trans	-85.8	-173.9	170.1	0	0	0	0	0	112.7	N536 N537 A538	G534-N536 PolarHBondContact O-N 3.42Å; G534-N536 VanDerWaalsContact O-N 3.12Å; G534-N537 PolarHBondContact O-N 3.3Å; G534-A538 PolarHBondContact N-O 2.87Å
535	P	79.5	Confident	90.1	Very high	138 Å²	138	49.3 Å²	49.3	90%	0.896	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.6	-175.6	-26	34	0	0	0	115.1
536	N	80	Confident	90.1	Very high	149 Å²	149	49.2 Å²	49.2	80%	0.797	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	18.1	-178.5	-63.9	-15.2	0	0	0	113.5	G534 A538	G534-N536 PolarHBondContact O-N 3.42Å; G534-N536 VanDerWaalsContact O-N 3.12Å; N536-A538 PolarHBondContact O-N 2.78Å
537	N	79.5	Confident	89.9	Confident	121 Å²	121	51.7 Å²	51.7	65%	0.647	31%	0.31	S	S	*	.	S	Bend	trans	59.1	9.9	-171.7	-155.2	24.3	0	0	0	114.8	R533 G534	R533-N537 WeakPolarHBondContact CD-O 3.11Å; G534-N537 PolarHBondContact O-N 3.3Å
538	A	82.3	Confident	89.9	Confident	57 Å²	57	56.4 Å²	56.4	47%	0.471	34%	0.34	S	S	.	.	S	Bend	trans	-77.1	159.2	170.7	0	0	0	0	0	110.7	R533 G534 N536 L540	R533-A538 CarbonylContact C-O 3.31Å; R533-A538 VanDerWaalsContact CA-O 3.28Å; R533-A538 WeakPolarHBondContact CA-O 3.47Å; G534-A538 PolarHBondContact N-O 2.87Å; N536-A538 PolarHBondContact O-N 2.78Å; A538-L540 PolarHBondContact O-N 3.14Å
539	T	86.2	Confident	90.1	Very high	51 Å²	51	57.6 Å²	57.6	31%	0.313	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-61.7	136.9	174	53.7	0	0	0	0	110.4	M532 F541 L582	M532-T539 CarbonylContact O-C 3.56Å; M532-T539 WeakPolarHBondContact O-CA 3.44Å; T539-F541 VanDerWaalsContact C-N 3.31Å; T539-F541 WeakPolarHBondContact CB-O 3.42Å; T539-F541 PolarHBondContact O-N 2.9Å; T539-F541 PolarHBondContact OG1-O 2.94Å; T539-L582 HydrophobicContact CG2-CD1 4.43Å
540	L	91.7	Very high	90.2	Very high	38 Å²	38	57.8 Å²	57.8	20%	0.199	35%	0.348	C	S	.	.	S	Bend	trans	-63.8	-39.3	-178.1	-177.8	64.6	0	0	0	111.9	K497 M532 A538	K497-L540 HydrophobicContact CD-CD1 3.88Å; K497-L540 HydrophobicContact CD-CG 4.13Å; K497-L540 WeakPolarHBondContact CE-O 3.46Å; K497-L540 HydrophobicContact CG-CD1 4.34Å; K497-L540 HydrophobicContact CG-CD2 4.46Å; K497-L540 HydrophobicContact CG-CG 4.27Å; K497-L540 PolarHBondContact NZ-O 2.86Å; M532-L540 HydrophobicContact CB-CB 3.8Å; M532-L540 HydrophobicContact CB-CD2 4.09Å; M532-L540 HydrophobicContact CE-CD2 3.49Å; M532-L540 VanDerWaalsContact CE-CD2 3.49Å; M532-L540 PolarHBondContact O-N 3.26Å; M532-L540 HydrophobicContact SD-CD2 3.96Å; A538-L540 PolarHBondContact O-N 3.14Å
541	F	93.6	Very high	90.3	Very high	1 Å²	1	63.5 Å²	63.5	0%	0.004	38%	0.375	C	S	.	.	S	Bend	trans	-99.8	137.7	171.7	-54.8	-79.2	0	0	0	109.3	K497 L500 L501 I504 L529 M532 T539 I546 L582	K497-F541 HydrophobicContact CG-CE1 4.28Å; L500-F541 HydrophobicContact CB-CE1 4.47Å; L500-F541 HydrophobicContact CB-CZ 3.79Å; L501-F541 HydrophobicContact CB-CE1 4.09Å; L501-F541 HydrophobicContact CD1-CD1 4.06Å; L501-F541 HydrophobicContact CD1-CE1 4.2Å; I504-F541 HydrophobicContact CD1-CD1 3.77Å; I504-F541 HydrophobicContact CD1-CE1 3.8Å; I504-F541 HydrophobicContact CD1-CG 4.14Å; I504-F541 HydrophobicContact CD1-CZ 4.21Å; L529-F541 HydrophobicContact CB-CD2 4.38Å; L529-F541 HydrophobicContact CB-CE2 3.91Å; L529-F541 HydrophobicContact CD2-CE2 4.2Å; L529-F541 VanDerWaalsContact O-CD2 3.3Å; L529-F541 WeakPolarHBondContact O-CD2 3.49Å; M532-F541 HydrophobicContact SD-CE2 4.2Å; T539-F541 VanDerWaalsContact C-N 3.31Å; T539-F541 WeakPolarHBondContact CB-O 3.42Å; T539-F541 PolarHBondContact O-N 2.9Å; T539-F541 PolarHBondContact OG1-O 2.94Å; F541-I546 HydrophobicContact CB-CD1 4.32Å; F541-L582 WeakPolarHBondContact O-CD1 3.33Å
542	T	92.5	Very high	90.7	Very high	60 Å²	60	65.8 Å²	65.8	37%	0.368	38%	0.384	S	S	.	.			trans	-99.6	156.9	179.5	62.3	0	0	0	0	111	A544 E545 I546	T542-A544 PolarHBondContact O-N 3.42Å; T542-E545 WeakPolarHBondContact CB-OE2 3.31Å; T542-E545 PolarHBondContact N-OE2 2.87Å; T542-E545 PolarHBondContact O-N 2.85Å; T542-E545 VanDerWaalsContact O-N 3.1Å; T542-E545 WeakPolarHBondContact OG1-CG 3.49Å; T542-E545 PolarHBondContact OG1-N 3.48Å; T542-E545 PolarHBondContact OG1-OE2 3.33Å; T542-I546 PolarHBondContact O-N 3.01Å
543	A	92.3	Very high	91.1	Very high	35 Å²	35	65 Å²	65	29%	0.289	38%	0.381	S	S	.	.	H	α-helix	trans	-55.7	-34.3	174.2	0	0	0	0	0	112.4	I546 A547	A543-I546 PolarHBondContact O-N 3.26Å; A543-A547 WeakPolarHBondContact O-CB 3.49Å; A543-A547 PolarHBondContact O-N 3.39Å
544	A	94.3	Very high	91.6	Very high	80 Å²	80	58.6 Å²	58.6	66%	0.661	36%	0.357	S	S	*	.	H	α-helix	trans	-66.3	-36.5	178	0	0	0	0	0	113.2	T542 I546 A547	T542-A544 PolarHBondContact O-N 3.42Å; A544-I546 VanDerWaalsContact C-N 3.32Å; A544-A547 WeakPolarHBondContact O-CB 3.46Å
545	E	95.2	Very high	92.3	Very high	54 Å²	54	61.5 Å²	61.5	25%	0.252	37%	0.371	S	S	.	.	H	α-helix	trans	-70.7	-30.3	176.5	-72.7	164.5	122.9	0	0	112.1	K497 L501 T542	K497-E545 VanDerWaalsContact CE-OE1 3.22Å; K497-E545 WeakPolarHBondContact CE-OE1 3.41Å; K497-E545 IonicContact NZ-OE1 3.64Å; K497-E545 PolarHBondContact NZ-OE1 3.31Å; K497-E545 IonicContact NZ-OE2 3.75Å; K497-E545 PolarHBondContact NZ-OE2 3.25Å; L501-E545 HydrophobicContact CD1-CB 4.4Å; T542-E545 WeakPolarHBondContact CB-OE2 3.31Å; T542-E545 PolarHBondContact N-OE2 2.87Å; T542-E545 PolarHBondContact O-N 2.85Å; T542-E545 VanDerWaalsContact O-N 3.1Å; T542-E545 WeakPolarHBondContact OG1-CG 3.49Å; T542-E545 PolarHBondContact OG1-N 3.48Å; T542-E545 PolarHBondContact OG1-OE2 3.33Å
546	I	96	Very high	93.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-90.4	-19.5	179.5	-50.8	-51.5	0	0	0	112.2	I504 F530 F541 T542 A543 A544 P548 F549 V550 L553 L582 L583	I504-I546 HydrophobicContact CD1-CD1 3.63Å; I504-I546 HydrophobicContact CG2-CD1 4.25Å; F530-I546 HydrophobicContact CE1-CD1 3.87Å; F530-I546 HydrophobicContact CE1-CG1 4.09Å; F530-I546 HydrophobicContact CZ-CG2 4.21Å; F541-I546 HydrophobicContact CB-CD1 4.32Å; T542-I546 PolarHBondContact O-N 3.01Å; A543-I546 PolarHBondContact O-N 3.26Å; A544-I546 VanDerWaalsContact C-N 3.32Å; I546-P548 VanDerWaalsContact C-N 3.3Å; I546-P548 VanDerWaalsContact O-N 3.12Å; I546-F549 PolarHBondContact O-N 2.95Å; I546-V550 PolarHBondContact O-N 3.14Å; I546-L553 HydrophobicContact CG2-CD2 4.12Å; I546-L582 HydrophobicContact CG1-CD2 3.81Å; I546-L583 HydrophobicContact CB-CD2 3.98Å; I546-L583 HydrophobicContact CG2-CD2 3.94Å
547	A	93.9	Very high	94.1	Very high	51 Å²	51	48.2 Å²	48.2	42%	0.421	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-45.4	-42.8	-179.3	0	0	0	0	0	114.7	A543 A544 F549 V550	A543-A547 WeakPolarHBondContact O-CB 3.49Å; A543-A547 PolarHBondContact O-N 3.39Å; A544-A547 WeakPolarHBondContact O-CB 3.46Å; A547-F549 PolarHBondContact O-N 3.35Å; A547-F549 VanDerWaalsContact O-N 3.14Å; A547-V550 WeakPolarHBondContact O-CG2 3.37Å; A547-V550 PolarHBondContact O-N 3.41Å
548	P	96.3	Very high	95	Very high	100 Å²	100	43 Å²	43	65%	0.649	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-63.2	-19.7	178.9	-22.7	35.2	0	0	0	114.6	I546	I546-P548 VanDerWaalsContact C-N 3.3Å; I546-P548 VanDerWaalsContact O-N 3.12Å
549	F	97	Very high	95.7	Very high	57 Å²	57	44.7 Å²	44.7	25%	0.25	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-110.3	3.4	-174	-46.7	-67.1	0	0	0	113.2	P505 I508 I546 A547 E551 I552 L553	P505-F549 HydrophobicContact CB-CD1 4.15Å; P505-F549 HydrophobicContact CB-CE1 3.85Å; P505-F549 HydrophobicContact CB-CZ 4.27Å; P505-F549 HydrophobicContact CG-CE1 4.26Å; P505-F549 HydrophobicContact CG-CZ 4.2Å; I508-F549 HydrophobicContact CD1-CB 3.71Å; I508-F549 HydrophobicContact CD1-CG 4.34Å; I546-F549 PolarHBondContact O-N 2.95Å; A547-F549 PolarHBondContact O-N 3.35Å; A547-F549 VanDerWaalsContact O-N 3.14Å; F549-E551 PolarHBondContact O-N 3.22Å; F549-I552 HydrophobicContact CB-CG2 4.2Å; F549-I552 VanDerWaalsContact O-CG2 3.26Å; F549-I552 WeakPolarHBondContact O-CG2 3.49Å; F549-I552 PolarHBondContact O-N 2.91Å; F549-L553 WeakPolarHBondContact O-CB 3.35Å; F549-L553 PolarHBondContact O-N 3.3Å
550	V	97.1	Very high	96.3	Very high	6 Å²	6	42.2 Å²	42.2	4%	0.036	25%	0.245	C	C	.	.	H	α-helix	trans	-57.9	-50.4	-171.6	171.9	0	0	0	0	112.2	I546 A547 L553 L554 L583 Y590	I546-V550 PolarHBondContact O-N 3.14Å; A547-V550 WeakPolarHBondContact O-CG2 3.37Å; A547-V550 PolarHBondContact O-N 3.41Å; V550-L553 PolarHBondContact O-N 3.23Å; V550-L554 HydrophobicContact CG1-CD1 3.79Å; V550-L554 HydrophobicContact CG1-CG 4.33Å; V550-L554 WeakPolarHBondContact O-CB 3.41Å; V550-L554 VanDerWaalsContact O-CG 3.23Å; V550-L554 WeakPolarHBondContact O-CG 3.43Å; V550-L554 PolarHBondContact O-N 3.5Å; V550-L583 HydrophobicContact CB-CD1 4.46Å; V550-L583 HydrophobicContact CG1-CD1 4.11Å; V550-L583 HydrophobicContact CG2-CD1 3.81Å; V550-L583 HydrophobicContact CG2-CD2 3.52Å; V550-L583 HydrophobicContact CG2-CG 4.29Å; V550-Y590 HydrophobicContact CG1-CD2 4.12Å; V550-Y590 HydrophobicContact CG1-CE2 3.65Å
551	E	97.7	Very high	96.6	Very high	126 Å²	126	40.8 Å²	40.8	59%	0.589	24%	0.238	S	C	*	.	H	α-helix	trans	-59.6	-52.8	-178.3	-174.7	172.1	173.3	0	0	111.2	F549 L553 L554 T555 Y590	F549-E551 PolarHBondContact O-N 3.22Å; E551-L553 PolarHBondContact O-N 3.14Å; E551-L554 PolarHBondContact O-N 3.35Å; E551-T555 WeakPolarHBondContact O-CB 3.5Å; E551-T555 PolarHBondContact O-N 2.91Å; E551-T555 PolarHBondContact O-OG1 3.18Å; E551-Y590 HydrophobicContact CB-CE1 4.01Å; E551-Y590 HydrophobicContact CG-CE1 3.99Å
552	I	98	Very high	96.7	Very high	83 Å²	83	46 Å²	46	43%	0.426	27%	0.27	S	S	.	.	H	α-helix	trans	-67.6	-35	-178.7	-169.8	161.7	0	0	0	112.8	I508 F549 N556	I508-I552 HydrophobicContact CG2-CB 4.49Å; I508-I552 HydrophobicContact CG2-CG1 4.02Å; I508-I552 HydrophobicContact CG2-CG2 4.1Å; F549-I552 HydrophobicContact CB-CG2 4.2Å; F549-I552 VanDerWaalsContact O-CG2 3.26Å; F549-I552 WeakPolarHBondContact O-CG2 3.49Å; F549-I552 PolarHBondContact O-N 2.91Å; I552-N556 WeakPolarHBondContact O-CB 3.31Å; I552-N556 PolarHBondContact O-N 2.85Å
553	L	98.6	Very high	96.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-52.5	173.6	171.6	63.8	0	0	0	110.7	I508 L526 F530 I546 F549 V550 E551 N556 L557 L583	I508-L553 HydrophobicContact CD1-CB 3.94Å; I508-L553 HydrophobicContact CD1-CD1 4.12Å; I508-L553 HydrophobicContact CG1-CB 4.3Å; I508-L553 HydrophobicContact CG1-CD1 3.8Å; L526-L553 HydrophobicContact CD1-CD1 3.96Å; F530-L553 HydrophobicContact CE2-CD2 3.99Å; F530-L553 HydrophobicContact CZ-CD2 4.12Å; I546-L553 HydrophobicContact CG2-CD2 4.12Å; F549-L553 WeakPolarHBondContact O-CB 3.35Å; F549-L553 PolarHBondContact O-N 3.3Å; V550-L553 PolarHBondContact O-N 3.23Å; E551-L553 PolarHBondContact O-N 3.14Å; L553-N556 PolarHBondContact O-N 3.34Å; L553-L557 HydrophobicContact CD1-CD1 3.69Å; L553-L557 HydrophobicContact CD1-CG 4.1Å; L553-L557 HydrophobicContact CG-CD1 4.02Å; L553-L557 WeakPolarHBondContact O-CB 3.31Å; L553-L557 VanDerWaalsContact O-CG 3.27Å; L553-L557 WeakPolarHBondContact O-CG 3.42Å; L553-L557 PolarHBondContact O-N 3.28Å; L553-L583 HydrophobicContact CD2-CD1 4.28Å
554	L	98.3	Very high	96.9	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-45.7	-178.2	-66.5	-179.7	0	0	0	111.3	V550 E551 N556 L557 F558 F580 I587 Y590 L594	V550-L554 HydrophobicContact CG1-CD1 3.79Å; V550-L554 HydrophobicContact CG1-CG 4.33Å; V550-L554 WeakPolarHBondContact O-CB 3.41Å; V550-L554 VanDerWaalsContact O-CG 3.23Å; V550-L554 WeakPolarHBondContact O-CG 3.43Å; V550-L554 PolarHBondContact O-N 3.5Å; E551-L554 PolarHBondContact O-N 3.35Å; L554-N556 PolarHBondContact O-N 2.82Å; L554-L557 PolarHBondContact O-N 3.43Å; L554-F558 WeakPolarHBondContact O-CD2 3.49Å; L554-F558 PolarHBondContact O-N 3.42Å; L554-F558 VanDerWaalsContact O-N 3.11Å; L554-F580 HydrophobicContact CD2-CD1 4.16Å; L554-F580 HydrophobicContact CD2-CE1 3.69Å; L554-I587 HydrophobicContact CD1-CG2 4.44Å; L554-Y590 HydrophobicContact CD1-CD2 4.04Å; L554-Y590 HydrophobicContact CD1-CG 3.96Å; L554-L594 HydrophobicContact CD1-CD1 3.9Å; L554-L594 HydrophobicContact CD2-CD1 4.35Å
555	T	98.1	Very high	96.7	Very high	80 Å²	80	47.9 Å²	47.9	49%	0.491	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-46.4	176.7	-63.1	0	0	0	0	111.5	E551 K559	E551-T555 WeakPolarHBondContact O-CB 3.5Å; E551-T555 PolarHBondContact O-N 2.91Å; E551-T555 PolarHBondContact O-OG1 3.18Å; T555-K559 WeakPolarHBondContact O-CB 3.48Å; T555-K559 PolarHBondContact O-N 3.38Å
556	N	98.5	Very high	96.7	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.043	27%	0.271	C	S	.	.	H	α-helix	trans	-72.5	-37.5	-177.3	-71.9	-1.1	0	0	0	112.7	I508 L511 Q512 I552 L553 L554 K559 A560	I508-N556 HydrophobicContact CG2-CB 4.45Å; I508-N556 PolarHBondContact O-ND2 3.01Å; L511-N556 HydrophobicContact CB-CB 3.92Å; L511-N556 HydrophobicContact CD1-CB 3.93Å; Q512-N556 HydrophobicContact CG-CB 4.45Å; I552-N556 WeakPolarHBondContact O-CB 3.31Å; I552-N556 PolarHBondContact O-N 2.85Å; L553-N556 PolarHBondContact O-N 3.34Å; L554-N556 PolarHBondContact O-N 2.82Å; N556-K559 PolarHBondContact O-N 3.3Å; N556-A560 WeakPolarHBondContact O-CB 3.48Å; N556-A560 PolarHBondContact O-N 3.4Å
557	L	98.7	Very high	96.7	Very high	0 Å²	0	48 Å²	48	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-46.7	175	-78.2	171.5	0	0	0	111.7	L511 A523 L553 L554 A560 L561 I572 A575 I576	L511-L557 HydrophobicContact CD1-CD2 3.68Å; L511-L557 HydrophobicContact CD1-CG 3.73Å; L511-L557 HydrophobicContact CD2-CD2 3.88Å; L511-L557 HydrophobicContact CG-CD2 4.46Å; A523-L557 HydrophobicContact CB-CD2 4.4Å; L553-L557 HydrophobicContact CD1-CD1 3.69Å; L553-L557 HydrophobicContact CD1-CG 4.1Å; L553-L557 HydrophobicContact CG-CD1 4.02Å; L553-L557 WeakPolarHBondContact O-CB 3.31Å; L553-L557 VanDerWaalsContact O-CG 3.27Å; L553-L557 WeakPolarHBondContact O-CG 3.42Å; L553-L557 PolarHBondContact O-N 3.28Å; L554-L557 PolarHBondContact O-N 3.43Å; L557-A560 PolarHBondContact O-N 2.9Å; L557-L561 PolarHBondContact O-N 2.9Å; L557-I572 HydrophobicContact CD2-CG2 4.23Å; L557-I572 VanDerWaalsContact O-CG2 3.27Å; L557-I572 WeakPolarHBondContact O-CG2 3.35Å; L557-A575 HydrophobicContact CD2-CB 3.76Å; L557-I576 HydrophobicContact CB-CD1 4.27Å; L557-I576 HydrophobicContact CB-CG1 3.71Å; L557-I576 HydrophobicContact CD1-CG1 3.98Å; L557-I576 HydrophobicContact CG-CG1 4.3Å
558	F	98.4	Very high	96.8	Very high	12 Å²	12	47.6 Å²	47.6	5%	0.053	28%	0.28	C	S	.	.	H	α-helix	trans	-71.1	-34.6	178.2	-84.1	-97.6	0	0	0	112.4	L554 A560 L561 I576 F580 L594 Q597 L598	L554-F558 WeakPolarHBondContact O-CD2 3.49Å; L554-F558 PolarHBondContact O-N 3.42Å; L554-F558 VanDerWaalsContact O-N 3.11Å; F558-A560 VanDerWaalsContact C-N 3.32Å; F558-A560 PolarHBondContact O-N 2.87Å; F558-L561 WeakPolarHBondContact O-CB 3.33Å; F558-L561 PolarHBondContact O-N 3.41Å; F558-I576 HydrophobicContact CD2-CD1 3.9Å; F558-I576 HydrophobicContact CD2-CG1 4.26Å; F558-I576 HydrophobicContact CE1-CD1 4.47Å; F558-I576 HydrophobicContact CE2-CD1 3.76Å; F558-I576 HydrophobicContact CE2-CG1 3.99Å; F558-I576 HydrophobicContact CE2-CG2 3.69Å; F558-I576 HydrophobicContact CG-CD1 4.33Å; F558-I576 HydrophobicContact CZ-CD1 4.08Å; F558-I576 HydrophobicContact CZ-CG2 3.94Å; F558-F580 HydrophobicContact CE2-CZ 4.16Å; F558-F580 HydrophobicContact CZ-CZ 4.25Å; F558-L594 HydrophobicContact CD2-CD2 3.83Å; F558-L594 HydrophobicContact CE2-CB 4.49Å; F558-L594 HydrophobicContact CE2-CD1 4.5Å; F558-L594 HydrophobicContact CE2-CD2 3.61Å; F558-L594 HydrophobicContact CE2-CG 4.38Å; F558-L594 HydrophobicContact CG-CD2 4.39Å; F558-L594 HydrophobicContact CZ-CB 4.13Å; F558-L594 HydrophobicContact CZ-CD2 3.97Å; F558-L594 HydrophobicContact CZ-CG 4.49Å; F558-Q597 VanDerWaalsContact CB-OE1 3.29Å; F558-Q597 HydrophobicContact CD1-CB 3.83Å; F558-Q597 HydrophobicContact CE1-CB 3.85Å; F558-L598 HydrophobicContact CE1-CD2 4Å; F558-L598 HydrophobicContact CE1-CG 3.94Å; F558-L598 HydrophobicContact CZ-CD1 4.37Å; F558-L598 HydrophobicContact CZ-CD2 4.02Å; F558-L598 HydrophobicContact CZ-CG 3.94Å
559	K	97.8	Very high	96.8	Very high	92 Å²	92	43.7 Å²	43.7	40%	0.4	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-39.4	171.4	-176.9	-179.3	172.9	-172.9	0	111.6	Q512 T555 N556 L561 T562	Q512-K559 VanDerWaalsContact OE1-NZ 3.08Å; T555-K559 WeakPolarHBondContact O-CB 3.48Å; T555-K559 PolarHBondContact O-N 3.38Å; N556-K559 PolarHBondContact O-N 3.3Å; K559-L561 PolarHBondContact O-N 3.33Å; K559-T562 WeakPolarHBondContact O-CA 3.41Å; K559-T562 WeakPolarHBondContact O-CB 3.24Å; K559-T562 PolarHBondContact O-N 2.92Å; K559-T562 PolarHBondContact O-OG1 3.16Å
560	A	98.3	Very high	96.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-34.6	177.6	0	0	0	0	0	112.1	N556 L557 F558 T562 L563 I572	N556-A560 WeakPolarHBondContact O-CB 3.48Å; N556-A560 PolarHBondContact O-N 3.4Å; L557-A560 PolarHBondContact O-N 2.9Å; F558-A560 VanDerWaalsContact C-N 3.32Å; F558-A560 PolarHBondContact O-N 2.87Å; A560-T562 PolarHBondContact O-N 3.28Å; A560-T562 VanDerWaalsContact O-N 3.14Å; A560-L563 WeakPolarHBondContact O-CB 3.19Å; A560-L563 PolarHBondContact O-N 3.23Å; A560-L563 VanDerWaalsContact O-N 3.13Å; A560-I572 HydrophobicContact CB-CD1 3.53Å; A560-I572 HydrophobicContact CB-CG1 4.32Å; A560-I572 HydrophobicContact CB-CG2 4.37Å
561	L	97.9	Very high	96.7	Very high	8 Å²	8	44 Å²	44	4%	0.042	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-5.8	172.2	-66.5	179.2	0	0	0	114.8	L557 F558 K559 S567 N569 I572 M573 I576 K601 F614	L557-L561 PolarHBondContact O-N 2.9Å; F558-L561 WeakPolarHBondContact O-CB 3.33Å; F558-L561 PolarHBondContact O-N 3.41Å; K559-L561 PolarHBondContact O-N 3.33Å; L561-S567 WeakPolarHBondContact O-CA 3.36Å; L561-N569 HydrophobicContact CD2-CB 4.45Å; L561-I572 HydrophobicContact CD1-CG2 4.36Å; L561-I572 HydrophobicContact CD2-CB 3.78Å; L561-I572 HydrophobicContact CD2-CD1 4.34Å; L561-I572 HydrophobicContact CD2-CG2 3.63Å; L561-I572 HydrophobicContact CG-CB 4.35Å; L561-I572 HydrophobicContact CG-CG2 3.62Å; L561-M573 HydrophobicContact CD1-CE 3.73Å; L561-I576 HydrophobicContact CD1-CD1 3.6Å; L561-I576 HydrophobicContact CG-CD1 4.4Å; L561-K601 PolarHBondContact O-NZ 2.97Å; L561-F614 HydrophobicContact CD2-CE2 3.95Å
562	T	96.5	Very high	96.7	Very high	109 Å²	109	38 Å²	38	67%	0.669	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-9.3	174.5	72.4	0	0	0	0	112.7	K559 A560	K559-T562 WeakPolarHBondContact O-CA 3.41Å; K559-T562 WeakPolarHBondContact O-CB 3.24Å; K559-T562 PolarHBondContact O-N 2.92Å; K559-T562 PolarHBondContact O-OG1 3.16Å; A560-T562 PolarHBondContact O-N 3.28Å; A560-T562 VanDerWaalsContact O-N 3.14Å
563	L	96	Very high	96.8	Very high	35 Å²	35	34 Å²	34	18%	0.183	21%	0.206	C	C	.	.	S	Bend	trans	-71.1	145.4	177.8	-63.5	174.5	0	0	0	110.5	A513 H519 A560 G565 S566	A513-L563 WeakPolarHBondContact O-CD1 3.37Å; H519-L563 WeakPolarHBondContact ND1-CD1 3.47Å; A560-L563 WeakPolarHBondContact O-CB 3.19Å; A560-L563 PolarHBondContact O-N 3.23Å; A560-L563 VanDerWaalsContact O-N 3.13Å; L563-G565 PolarHBondContact O-N 3.03Å; L563-S566 PolarHBondContact O-N 3.08Å; L563-S566 VanDerWaalsContact O-N 3.09Å
564	P	92.1	Very high	96.7	Very high	112 Å²	112	36.3 Å²	36.3	73%	0.727	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	139.3	176.2	-25.6	34.7	0	0	0	112	S566	P564-S566 PolarHBondContact O-N 3.32Å; P564-S566 VanDerWaalsContact O-N 3.14Å
565	G	91.1	Very high	96.7	Very high	68 Å²	68	36.1 Å²	36.1	70%	0.701	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	-8	-178.3	0	0	0	0	0	115.7	L563	L563-G565 PolarHBondContact O-N 3.03Å
566	S	95.6	Very high	96.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.192	C	C	.	.			trans	-116.4	15.7	-174.7	-69.5	0	0	0	0	114.6	H519 L563 P564 E568 N569	H519-S566 WeakPolarHBondContact NE2-CB 3.49Å; H519-S566 PolarHBondContact NE2-OG 3Å; L563-S566 PolarHBondContact O-N 3.08Å; L563-S566 VanDerWaalsContact O-N 3.09Å; P564-S566 PolarHBondContact O-N 3.32Å; P564-S566 VanDerWaalsContact O-N 3.14Å; S566-E568 VanDerWaalsContact C-N 3.31Å; S566-E568 PolarHBondContact O-N 3.36Å; S566-N569 WeakPolarHBondContact O-CB 3.32Å; S566-N569 PolarHBondContact O-N 3.35Å
567	S	94.3	Very high	96.7	Very high	57 Å²	57	32.4 Å²	32.4	40%	0.399	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-41.7	178.4	54.4	0	0	0	0	112.2	L561 K601	L561-S567 WeakPolarHBondContact O-CA 3.36Å; S567-K601 VanDerWaalsContact CA-NZ 3.33Å; S567-K601 WeakPolarHBondContact O-CE 3.25Å; S567-K601 PolarHBondContact O-NZ 3.33Å
568	E	95.7	Very high	96.5	Very high	43 Å²	43	35 Å²	35	20%	0.201	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	32.7	-179.3	-65.7	178.4	-111.4	0	0	111.6	S566 E570 V605 S610 K611 F614	S566-E568 VanDerWaalsContact C-N 3.31Å; S566-E568 PolarHBondContact O-N 3.36Å; E568-E570 PolarHBondContact O-N 3.5Å; E568-E570 VanDerWaalsContact O-N 3.14Å; E568-V605 HydrophobicContact CG-CG1 3.65Å; E568-S610 PolarHBondContact OE2-OG 2.98Å; E568-K611 HydrophobicContact CB-CB 4.22Å; E568-K611 HydrophobicContact CB-CG 3.76Å; E568-F614 HydrophobicContact CB-CD1 4.19Å; E568-F614 HydrophobicContact CB-CD2 4.49Å; E568-F614 HydrophobicContact CB-CG 4.2Å; E568-F614 HydrophobicContact CG-CD1 4.33Å; E568-F614 HydrophobicContact CG-CE1 4.33Å; E568-F614 WeakPolarHBondContact O-CB 3.32Å; E568-F614 WeakPolarHBondContact O-CD2 3.5Å; E568-F614 WeakPolarHBondContact O-CG 3.32Å
569	N	96.7	Very high	96.5	Very high	18 Å²	18	34.4 Å²	34.4	10%	0.096	20%	0.199	C	C	.	.			trans	-71.6	107.8	-177.6	-171.8	-46.3	0	0	0	111.6	T520 L561 S566 Y571 I572 M573 F614	T520-N569 PolarHBondContact OG1-ND2 2.93Å; L561-N569 HydrophobicContact CD2-CB 4.45Å; S566-N569 WeakPolarHBondContact O-CB 3.32Å; S566-N569 PolarHBondContact O-N 3.35Å; N569-Y571 VanDerWaalsContact C-N 3.31Å; N569-Y571 PolarHBondContact O-N 3.27Å; N569-Y571 WeakPolarHBondContact OD1-CB 3.33Å; N569-Y571 PolarHBondContact OD1-N 3.08Å; N569-Y571 VanDerWaalsContact OD1-N 3.14Å; N569-I572 HydrophobicContact CB-CB 4.35Å; N569-I572 HydrophobicContact CB-CD1 3.81Å; N569-I572 HydrophobicContact CB-CG1 4.2Å; N569-I572 PolarHBondContact O-N 3.48Å; N569-I572 PolarHBondContact OD1-N 3.5Å; N569-M573 PolarHBondContact O-N 3.15Å; N569-F614 WeakPolarHBondContact O-CD2 3.33Å
570	E	95.5	Very high	96.4	Very high	44 Å²	44	30 Å²	30	21%	0.206	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-32.7	-174.9	59.5	174.6	-112.4	0	0	113.9	E568 M573 K574 H613 F614 Y617	E568-E570 PolarHBondContact O-N 3.5Å; E568-E570 VanDerWaalsContact O-N 3.14Å; E570-M573 PolarHBondContact O-N 2.91Å; E570-K574 VanDerWaalsContact O-CB 3.25Å; E570-K574 WeakPolarHBondContact O-CB 3.41Å; E570-K574 PolarHBondContact O-N 3.42Å; E570-H613 HydrophobicContact CB-CB 4.19Å; E570-H613 IonicContact OE1-CD2 2.71Å; E570-H613 VanDerWaalsContact OE2-CB 3.31Å; E570-H613 WeakPolarHBondContact OE2-CB 3.39Å; E570-H613 IonicContact OE2-CD2 2.77Å; E570-H613 IonicContact OE2-CG 3.76Å; E570-F614 HydrophobicContact CB-CB 4.01Å; E570-Y617 HydrophobicContact CB-CD2 4.44Å; E570-Y617 HydrophobicContact CB-CE2 4.48Å
571	Y	97	Very high	96.2	Very high	24 Å²	24	31.4 Å²	31.4	9%	0.094	19%	0.19	C	C	.	.	H	α-helix	trans	-67.8	-40.2	179.6	-63.7	-89.3	0	0	0	111.1	I370 L374 E375 T520 H524 N569 A575	I370-Y571 HydrophobicContact CG2-CD2 4.4Å; I370-Y571 HydrophobicContact CG2-CE2 3.71Å; L374-Y571 HydrophobicContact CD1-CD1 4.31Å; L374-Y571 HydrophobicContact CD1-CE1 3.71Å; E375-Y571 PolarHBondContact OE1-OH 2.99Å; T520-Y571 HydrophobicContact CG2-CD1 4.45Å; T520-Y571 HydrophobicContact CG2-CD2 3.51Å; T520-Y571 HydrophobicContact CG2-CE2 4.28Å; T520-Y571 HydrophobicContact CG2-CG 3.64Å; H524-Y571 HydrophobicContact CB-CD1 3.87Å; H524-Y571 AromaticContact CE1-CD1 3.99Å; H524-Y571 AromaticContact CE1-CE1 3.9Å; H524-Y571 AromaticContact CG-CD1 3.73Å; H524-Y571 AromaticContact ND1-CD1 3.37Å; H524-Y571 WeakPolarHBondContact ND1-CD1 3.33Å; H524-Y571 AromaticContact ND1-CE1 3.75Å; N569-Y571 VanDerWaalsContact C-N 3.31Å; N569-Y571 PolarHBondContact O-N 3.27Å; N569-Y571 WeakPolarHBondContact OD1-CB 3.33Å; N569-Y571 PolarHBondContact OD1-N 3.08Å; N569-Y571 VanDerWaalsContact OD1-N 3.14Å; Y571-A575 WeakPolarHBondContact O-CB 3.48Å; Y571-A575 PolarHBondContact O-N 3.39Å
572	I	98.6	Very high	96.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-46.6	174.6	-63.2	168.4	0	0	0	110.4	A523 L557 A560 L561 N569 K574 A575 I576	A523-I572 HydrophobicContact CB-CB 4.34Å; A523-I572 HydrophobicContact CB-CG1 3.76Å; L557-I572 HydrophobicContact CD2-CG2 4.23Å; L557-I572 VanDerWaalsContact O-CG2 3.27Å; L557-I572 WeakPolarHBondContact O-CG2 3.35Å; A560-I572 HydrophobicContact CB-CD1 3.53Å; A560-I572 HydrophobicContact CB-CG1 4.32Å; A560-I572 HydrophobicContact CB-CG2 4.37Å; L561-I572 HydrophobicContact CD1-CG2 4.36Å; L561-I572 HydrophobicContact CD2-CB 3.78Å; L561-I572 HydrophobicContact CD2-CD1 4.34Å; L561-I572 HydrophobicContact CD2-CG2 3.63Å; L561-I572 HydrophobicContact CG-CB 4.35Å; L561-I572 HydrophobicContact CG-CG2 3.62Å; N569-I572 HydrophobicContact CB-CB 4.35Å; N569-I572 HydrophobicContact CB-CD1 3.81Å; N569-I572 HydrophobicContact CB-CG1 4.2Å; N569-I572 PolarHBondContact O-N 3.48Å; N569-I572 PolarHBondContact OD1-N 3.5Å; I572-K574 VanDerWaalsContact C-N 3.33Å; I572-K574 PolarHBondContact O-N 2.96Å; I572-A575 WeakPolarHBondContact O-CB 3.38Å; I572-A575 PolarHBondContact O-N 3.34Å; I572-A575 VanDerWaalsContact O-N 3.14Å; I572-I576 HydrophobicContact CG2-CD1 4.17Å; I572-I576 WeakPolarHBondContact O-CG1 3.34Å; I572-I576 PolarHBondContact O-N 3.07Å
573	M	98.5	Very high	96	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-38.9	178.9	-171.1	56.7	71.5	0	0	112.3	L561 N569 E570 A575 I576 M577 L598 F614 M618 A621	L561-M573 HydrophobicContact CD1-CE 3.73Å; N569-M573 PolarHBondContact O-N 3.15Å; E570-M573 PolarHBondContact O-N 2.91Å; M573-A575 VanDerWaalsContact C-N 3.33Å; M573-A575 PolarHBondContact O-N 3.08Å; M573-I576 WeakPolarHBondContact O-CB 3.34Å; M573-I576 PolarHBondContact O-N 3.12Å; M573-I576 HydrophobicContact SD-CB 4.46Å; M573-I576 HydrophobicContact SD-CD1 4.28Å; M573-M577 PolarHBondContact O-N 3.21Å; M573-L598 HydrophobicContact CE-CD2 3.93Å; M573-L598 HydrophobicContact SD-CD2 3.98Å; M573-F614 HydrophobicContact CB-CD2 3.62Å; M573-F614 HydrophobicContact CB-CE2 3.71Å; M573-F614 HydrophobicContact CE-CD2 4.49Å; M573-F614 HydrophobicContact CE-CE1 4.41Å; M573-F614 HydrophobicContact CE-CE2 3.56Å; M573-F614 HydrophobicContact CE-CZ 3.51Å; M573-F614 HydrophobicContact CG-CD2 4.24Å; M573-F614 HydrophobicContact CG-CE2 4.18Å; M573-M618 HydrophobicContact CE-CB 3.92Å; M573-M618 HydrophobicContact CE-CG 3.89Å; M573-M618 HydrophobicContact CE-SD 4.42Å; M573-M618 HydrophobicContact CG-CB 3.88Å; M573-M618 VanDerWaalsContact CG-N 3.32Å; M573-M618 HydrophobicContact SD-CB 3.9Å; M573-M618 HydrophobicContact SD-CG 4.23Å; M573-A621 HydrophobicContact SD-CB 4.48Å
574	K	97.3	Very high	95.9	Very high	48 Å²	48	28.8 Å²	28.8	21%	0.209	17%	0.169	C	C	.	.	H	α-helix	trans	-62.4	-40.5	173.1	-162.7	177.6	-174.3	157.9	0	111.6	E527 E570 I572 M577 R578 Y617	E527-K574 HydrophobicContact CG-CB 4.41Å; E527-K574 HydrophobicContact CG-CD 4.43Å; E527-K574 HydrophobicContact CG-CG 3.94Å; E527-K574 VanDerWaalsContact OE2-CD 3.25Å; E527-K574 WeakPolarHBondContact OE2-CD 3.36Å; E527-K574 VanDerWaalsContact OE2-CE 3.27Å; E527-K574 WeakPolarHBondContact OE2-CE 3.27Å; E570-K574 VanDerWaalsContact O-CB 3.25Å; E570-K574 WeakPolarHBondContact O-CB 3.41Å; E570-K574 PolarHBondContact O-N 3.42Å; I572-K574 VanDerWaalsContact C-N 3.33Å; I572-K574 PolarHBondContact O-N 2.96Å; K574-M577 HydrophobicContact CG-CE 4.31Å; K574-M577 PolarHBondContact O-N 3.05Å; K574-R578 VanDerWaalsContact O-CB 3.3Å; K574-R578 WeakPolarHBondContact O-CB 3.49Å; K574-R578 PolarHBondContact O-N 2.93Å; K574-Y617 HydrophobicContact CB-CD1 4.39Å; K574-Y617 HydrophobicContact CB-CD2 3.69Å; K574-Y617 HydrophobicContact CB-CE2 3.91Å; K574-Y617 HydrophobicContact CB-CG 3.97Å; K574-Y617 HydrophobicContact CD-CD2 4.35Å; K574-Y617 HydrophobicContact CD-CE1 4.01Å; K574-Y617 HydrophobicContact CD-CE2 3.74Å; K574-Y617 WeakPolarHBondContact CE-OH 3.49Å; K574-Y617 HydrophobicContact CG-CD1 4.05Å; K574-Y617 HydrophobicContact CG-CD2 4.08Å; K574-Y617 HydrophobicContact CG-CE1 3.91Å; K574-Y617 HydrophobicContact CG-CE2 3.96Å; K574-Y617 HydrophobicContact CG-CG 4.15Å; K574-Y617 PolarHBondContact NZ-OH 2.91Å
575	A	98.2	Very high	96.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.5	-38	175.1	0	0	0	0	0	112.4	A523 E527 L557 Y571 I572 M573 R578 S579	A523-A575 HydrophobicContact CB-CB 3.97Å; A523-A575 WeakPolarHBondContact O-CB 3.46Å; E527-A575 HydrophobicContact CB-CB 4.12Å; L557-A575 HydrophobicContact CD2-CB 3.76Å; Y571-A575 WeakPolarHBondContact O-CB 3.48Å; Y571-A575 PolarHBondContact O-N 3.39Å; I572-A575 WeakPolarHBondContact O-CB 3.38Å; I572-A575 PolarHBondContact O-N 3.34Å; I572-A575 VanDerWaalsContact O-N 3.14Å; M573-A575 VanDerWaalsContact C-N 3.33Å; M573-A575 PolarHBondContact O-N 3.08Å; A575-R578 PolarHBondContact O-N 3.24Å; A575-S579 VanDerWaalsContact O-CB 3.3Å; A575-S579 WeakPolarHBondContact O-CB 3.34Å; A575-S579 PolarHBondContact O-N 2.9Å; A575-S579 PolarHBondContact O-OG 3.04Å
576	I	98.6	Very high	96.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.1	-55.6	172.1	-70	167	0	0	0	110.3	L557 F558 L561 I572 M573 R578 S579 F580 A621	L557-I576 HydrophobicContact CB-CD1 4.27Å; L557-I576 HydrophobicContact CB-CG1 3.71Å; L557-I576 HydrophobicContact CD1-CG1 3.98Å; L557-I576 HydrophobicContact CG-CG1 4.3Å; F558-I576 HydrophobicContact CD2-CD1 3.9Å; F558-I576 HydrophobicContact CD2-CG1 4.26Å; F558-I576 HydrophobicContact CE1-CD1 4.47Å; F558-I576 HydrophobicContact CE2-CD1 3.76Å; F558-I576 HydrophobicContact CE2-CG1 3.99Å; F558-I576 HydrophobicContact CE2-CG2 3.69Å; F558-I576 HydrophobicContact CG-CD1 4.33Å; F558-I576 HydrophobicContact CZ-CD1 4.08Å; F558-I576 HydrophobicContact CZ-CG2 3.94Å; L561-I576 HydrophobicContact CD1-CD1 3.6Å; L561-I576 HydrophobicContact CG-CD1 4.4Å; I572-I576 HydrophobicContact CG2-CD1 4.17Å; I572-I576 WeakPolarHBondContact O-CG1 3.34Å; I572-I576 PolarHBondContact O-N 3.07Å; M573-I576 WeakPolarHBondContact O-CB 3.34Å; M573-I576 PolarHBondContact O-N 3.12Å; M573-I576 HydrophobicContact SD-CB 4.46Å; M573-I576 HydrophobicContact SD-CD1 4.28Å; I576-R578 VanDerWaalsContact C-N 3.27Å; I576-R578 PolarHBondContact O-N 3.29Å; I576-S579 WeakPolarHBondContact O-CB 3.35Å; I576-S579 PolarHBondContact O-N 3.24Å; I576-S579 VanDerWaalsContact O-N 3.11Å; I576-F580 HydrophobicContact CG2-CD1 4.4Å; I576-F580 HydrophobicContact CG2-CD2 4.41Å; I576-F580 HydrophobicContact CG2-CE1 3.78Å; I576-F580 HydrophobicContact CG2-CE2 3.8Å; I576-F580 HydrophobicContact CG2-CZ 3.44Å; I576-F580 VanDerWaalsContact CG2-CZ 3.44Å; I576-F580 WeakPolarHBondContact O-CD1 3.42Å; I576-F580 WeakPolarHBondContact O-CG 3.35Å; I576-F580 PolarHBondContact O-N 3.47Å; I576-A621 HydrophobicContact CG2-CB 4.45Å
577	M	97.4	Very high	96.4	Very high	10 Å²	10	27.9 Å²	27.9	5%	0.049	14%	0.144	C	C	.	.	H	α-helix	trans	-54.7	-44.5	178.1	-179.7	-155.4	68.8	0	0	111.3	M573 K574 F580 S581 Y617 E620 A621 L624 F908	M573-M577 PolarHBondContact O-N 3.21Å; K574-M577 HydrophobicContact CG-CE 4.31Å; K574-M577 PolarHBondContact O-N 3.05Å; M577-F580 PolarHBondContact O-N 2.69Å; M577-S581 PolarHBondContact O-N 3.48Å; M577-Y617 HydrophobicContact CE-CD1 4.26Å; M577-Y617 HydrophobicContact SD-CD1 4.04Å; M577-E620 HydrophobicContact CG-CB 3.84Å; M577-E620 HydrophobicContact SD-CB 3.39Å; M577-E620 WeakPolarHBondContact SD-CB 3.38Å; M577-E620 HydrophobicContact SD-CG 3.97Å; M577-A621 HydrophobicContact CB-CB 4.16Å; M577-L624 WeakPolarHBondContact O-CD2 3.37Å; M577-F908 HydrophobicContact CG-CE2 4Å; M577-F908 HydrophobicContact SD-CE2 3.94Å
578	R	95.7	Very high	96.5	Very high	54 Å²	54	27.7 Å²	27.7	20%	0.204	14%	0.138	C	C	.	.	H	α-helix	trans	-67.2	-39.1	178.8	-175.5	59.3	59.8	-169.6	3.2	112.8	E527 F530 T531 K574 A575 I576 F580 S581 L582	E527-R578 HydrophobicContact CG-CB 3.62Å; E527-R578 HydrophobicContact CG-CG 3.96Å; E527-R578 IonicContact OE1-NE 2.75Å; E527-R578 PolarHBondContact OE1-NE 2.94Å; E527-R578 IonicContact OE1-NH2 3.41Å; F530-R578 HydrophobicContact CB-CG 3.62Å; F530-R578 HydrophobicContact CD2-CG 4.38Å; T531-R578 VanDerWaalsContact CG2-CD 3.46Å; T531-R578 HydrophobicContact CG2-CG 4.18Å; K574-R578 VanDerWaalsContact O-CB 3.3Å; K574-R578 WeakPolarHBondContact O-CB 3.49Å; K574-R578 PolarHBondContact O-N 2.93Å; A575-R578 PolarHBondContact O-N 3.24Å; I576-R578 VanDerWaalsContact C-N 3.27Å; I576-R578 PolarHBondContact O-N 3.29Å; R578-F580 VanDerWaalsContact C-N 3.32Å; R578-F580 PolarHBondContact O-N 2.91Å; R578-S581 WeakPolarHBondContact O-CB 3.5Å; R578-S581 PolarHBondContact O-N 3.11Å; R578-S581 VanDerWaalsContact O-N 3.16Å; R578-L582 PolarHBondContact O-N 3.4Å
579	S	97.4	Very high	96.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.2	-43.3	175.6	-60.3	0	0	0	0	110.5	A575 I576 S581 L582 L583	A575-S579 VanDerWaalsContact O-CB 3.3Å; A575-S579 WeakPolarHBondContact O-CB 3.34Å; A575-S579 PolarHBondContact O-N 2.9Å; A575-S579 PolarHBondContact O-OG 3.04Å; I576-S579 WeakPolarHBondContact O-CB 3.35Å; I576-S579 PolarHBondContact O-N 3.24Å; I576-S579 VanDerWaalsContact O-N 3.11Å; S579-S581 VanDerWaalsContact C-N 3.31Å; S579-S581 PolarHBondContact O-N 2.91Å; S579-L582 PolarHBondContact O-N 2.8Å; S579-L583 VanDerWaalsContact O-CB 3.24Å; S579-L583 WeakPolarHBondContact O-CB 3.49Å; S579-L583 VanDerWaalsContact O-CG 3.28Å; S579-L583 WeakPolarHBondContact O-CG 3.37Å; S579-L583 PolarHBondContact O-N 3.2Å
580	F	96.7	Very high	96.6	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-41.8	174.1	-64.4	-2.1	0	0	0	111.6	L554 F558 I576 M577 R578 L582 L583 Q584 I587 L594 L598 A621 L624 S625	L554-F580 HydrophobicContact CD2-CD1 4.16Å; L554-F580 HydrophobicContact CD2-CE1 3.69Å; F558-F580 HydrophobicContact CE2-CZ 4.16Å; F558-F580 HydrophobicContact CZ-CZ 4.25Å; I576-F580 HydrophobicContact CG2-CD1 4.4Å; I576-F580 HydrophobicContact CG2-CD2 4.41Å; I576-F580 HydrophobicContact CG2-CE1 3.78Å; I576-F580 HydrophobicContact CG2-CE2 3.8Å; I576-F580 HydrophobicContact CG2-CZ 3.44Å; I576-F580 VanDerWaalsContact CG2-CZ 3.44Å; I576-F580 WeakPolarHBondContact O-CD1 3.42Å; I576-F580 WeakPolarHBondContact O-CG 3.35Å; I576-F580 PolarHBondContact O-N 3.47Å; M577-F580 PolarHBondContact O-N 2.69Å; R578-F580 VanDerWaalsContact C-N 3.32Å; R578-F580 PolarHBondContact O-N 2.91Å; F580-L582 PolarHBondContact O-N 3.06Å; F580-L583 PolarHBondContact O-N 3.39Å; F580-Q584 PolarHBondContact O-N 2.91Å; F580-I587 HydrophobicContact CB-CD1 3.62Å; F580-I587 HydrophobicContact CD1-CD1 3.7Å; F580-I587 HydrophobicContact CD1-CG2 4.36Å; F580-I587 HydrophobicContact CD2-CD1 4.2Å; F580-I587 HydrophobicContact CE1-CD1 4.41Å; F580-I587 HydrophobicContact CG-CD1 3.58Å; F580-L594 HydrophobicContact CE1-CD1 3.58Å; F580-L594 HydrophobicContact CZ-CB 4.42Å; F580-L594 HydrophobicContact CZ-CD1 3.62Å; F580-L598 HydrophobicContact CE2-CD1 4.2Å; F580-A621 HydrophobicContact CD2-CB 4.15Å; F580-A621 HydrophobicContact CE2-CB 4.02Å; F580-L624 HydrophobicContact CB-CD2 3.69Å; F580-L624 HydrophobicContact CB-CG 4.16Å; F580-S625 WeakPolarHBondContact CE2-OG 3.35Å
581	S	94.3	Very high	96.6	Very high	29 Å²	29	31.3 Å²	31.3	20%	0.203	16%	0.161	C	C	.	.	H	α-helix	trans	-66.3	-36	-179.6	-173.3	0	0	0	0	112.6	M577 R578 S579 Q584	M577-S581 PolarHBondContact O-N 3.48Å; R578-S581 WeakPolarHBondContact O-CB 3.5Å; R578-S581 PolarHBondContact O-N 3.11Å; R578-S581 VanDerWaalsContact O-N 3.16Å; S579-S581 VanDerWaalsContact C-N 3.31Å; S579-S581 PolarHBondContact O-N 2.91Å; S581-Q584 PolarHBondContact O-NE2 3.33Å
582	L	94.4	Very high	96.6	Very high	17 Å²	17	34.3 Å²	34.3	9%	0.089	18%	0.183	C	C	.	.	H	α-helix	trans	-75	-46	175.9	178.2	62.1	0	0	0	112	F530 T539 F541 I546 R578 S579 F580	F530-L582 HydrophobicContact CB-CD2 3.92Å; F530-L582 HydrophobicContact CD1-CD2 3.47Å; F530-L582 VanDerWaalsContact CD1-CD2 3.47Å; F530-L582 HydrophobicContact CD2-CD2 4.09Å; F530-L582 HydrophobicContact CE1-CD2 3.96Å; F530-L582 HydrophobicContact CG-CD2 3.55Å; F530-L582 HydrophobicContact CZ-CD2 4.46Å; T539-L582 HydrophobicContact CG2-CD1 4.43Å; F541-L582 WeakPolarHBondContact O-CD1 3.33Å; I546-L582 HydrophobicContact CG1-CD2 3.81Å; R578-L582 PolarHBondContact O-N 3.4Å; S579-L582 PolarHBondContact O-N 2.8Å; F580-L582 PolarHBondContact O-N 3.06Å
583	L	95.7	Very high	96.5	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-81	-25.2	-169.5	-70.1	170.5	0	0	0	114	I546 V550 L553 S579 F580 E585 A586 I587	I546-L583 HydrophobicContact CB-CD2 3.98Å; I546-L583 HydrophobicContact CG2-CD2 3.94Å; V550-L583 HydrophobicContact CB-CD1 4.46Å; V550-L583 HydrophobicContact CG1-CD1 4.11Å; V550-L583 HydrophobicContact CG2-CD1 3.81Å; V550-L583 HydrophobicContact CG2-CD2 3.52Å; V550-L583 HydrophobicContact CG2-CG 4.29Å; L553-L583 HydrophobicContact CD2-CD1 4.28Å; S579-L583 VanDerWaalsContact O-CB 3.24Å; S579-L583 WeakPolarHBondContact O-CB 3.49Å; S579-L583 VanDerWaalsContact O-CG 3.28Å; S579-L583 WeakPolarHBondContact O-CG 3.37Å; S579-L583 PolarHBondContact O-N 3.2Å; F580-L583 PolarHBondContact O-N 3.39Å; L583-E585 PolarHBondContact O-N 3.46Å; L583-A586 HydrophobicContact CB-CB 4.3Å; L583-A586 WeakPolarHBondContact O-CB 3.39Å; L583-A586 PolarHBondContact O-N 3.04Å; L583-A586 VanDerWaalsContact O-N 3.11Å; L583-I587 HydrophobicContact CB-CG2 3.49Å; L583-I587 VanDerWaalsContact CB-CG2 3.49Å; L583-I587 HydrophobicContact CD1-CG2 3.88Å; L583-I587 HydrophobicContact CG-CG2 4.35Å
584	Q	94.1	Very high	96.5	Very high	77 Å²	77	38.8 Å²	38.8	36%	0.36	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	49.9	-125	176.7	-62.5	-68.7	-37.7	0	0	111.4	F580 S581 A586 I587 I628	F580-Q584 PolarHBondContact O-N 2.91Å; S581-Q584 PolarHBondContact O-NE2 3.33Å; Q584-A586 PolarHBondContact O-N 3.15Å; Q584-I587 WeakPolarHBondContact O-CG1 3.48Å; Q584-I587 PolarHBondContact O-N 3.3Å; Q584-I587 VanDerWaalsContact O-N 3.17Å; Q584-I628 WeakPolarHBondContact O-CG2 3.48Å
585	E	95.4	Very high	96.4	Very high	121 Å²	121	37 Å²	37	57%	0.565	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-58.3	-22	-175.6	-65.3	174.5	-166.4	0	0	114	L583 I587 I588	L583-E585 PolarHBondContact O-N 3.46Å; E585-I587 PolarHBondContact O-N 3.37Å; E585-I587 VanDerWaalsContact O-N 3.16Å; E585-I588 HydrophobicContact CB-CD1 4.01Å; E585-I588 HydrophobicContact CG-CD1 4.15Å; E585-I588 WeakPolarHBondContact O-CB 3.37Å; E585-I588 WeakPolarHBondContact O-CG1 3.37Å; E585-I588 PolarHBondContact O-N 3.42Å; E585-I588 VanDerWaalsContact O-N 3.14Å
586	A	95.6	Very high	96.4	Very high	41 Å²	41	40.4 Å²	40.4	34%	0.339	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-63.8	-19.7	179.1	0	0	0	0	0	113.6	L583 Q584	L583-A586 HydrophobicContact CB-CB 4.3Å; L583-A586 WeakPolarHBondContact O-CB 3.39Å; L583-A586 PolarHBondContact O-N 3.04Å; L583-A586 VanDerWaalsContact O-N 3.11Å; Q584-A586 PolarHBondContact O-N 3.15Å
587	I	96.4	Very high	96.3	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-87.2	-13.7	178.3	77.7	-173.5	0	0	0	113.3	L554 F580 L583 Q584 E585 P589 Y590 I591 I628	L554-I587 HydrophobicContact CD1-CG2 4.44Å; F580-I587 HydrophobicContact CB-CD1 3.62Å; F580-I587 HydrophobicContact CD1-CD1 3.7Å; F580-I587 HydrophobicContact CD1-CG2 4.36Å; F580-I587 HydrophobicContact CD2-CD1 4.2Å; F580-I587 HydrophobicContact CE1-CD1 4.41Å; F580-I587 HydrophobicContact CG-CD1 3.58Å; L583-I587 HydrophobicContact CB-CG2 3.49Å; L583-I587 VanDerWaalsContact CB-CG2 3.49Å; L583-I587 HydrophobicContact CD1-CG2 3.88Å; L583-I587 HydrophobicContact CG-CG2 4.35Å; Q584-I587 WeakPolarHBondContact O-CG1 3.48Å; Q584-I587 PolarHBondContact O-N 3.3Å; Q584-I587 VanDerWaalsContact O-N 3.17Å; E585-I587 PolarHBondContact O-N 3.37Å; E585-I587 VanDerWaalsContact O-N 3.16Å; I587-P589 VanDerWaalsContact C-CD 3.4Å; I587-P589 VanDerWaalsContact C-N 3.32Å; I587-Y590 WeakPolarHBondContact O-CA 3.49Å; I587-Y590 WeakPolarHBondContact O-CB 3.23Å; I587-Y590 PolarHBondContact O-N 2.83Å; I587-I591 HydrophobicContact CD1-CD1 3.76Å; I587-I591 HydrophobicContact CG1-CD1 3.74Å; I587-I591 HydrophobicContact CG1-CG1 4.04Å; I587-I591 PolarHBondContact O-N 2.81Å; I587-I628 HydrophobicContact CD1-CD1 3.69Å; I587-I628 HydrophobicContact CG1-CD1 4.49Å; I587-I628 HydrophobicContact CG1-CG2 4.47Å
588	I	96.9	Very high	96.3	Very high	52 Å²	52	43.5 Å²	43.5	27%	0.267	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-50.5	-44.2	-173.6	-69.1	172.5	0	0	0	112.8	E585 Y590 I591 I628 A632	E585-I588 HydrophobicContact CB-CD1 4.01Å; E585-I588 HydrophobicContact CG-CD1 4.15Å; E585-I588 WeakPolarHBondContact O-CB 3.37Å; E585-I588 WeakPolarHBondContact O-CG1 3.37Å; E585-I588 PolarHBondContact O-N 3.42Å; E585-I588 VanDerWaalsContact O-N 3.14Å; I588-Y590 PolarHBondContact O-N 3.29Å; I588-Y590 VanDerWaalsContact O-N 3.15Å; I588-I591 PolarHBondContact O-N 3.39Å; I588-I628 HydrophobicContact CD1-CG2 4.17Å; I588-I628 HydrophobicContact CG1-CG2 3.84Å; I588-A632 HydrophobicContact CD1-CB 3.88Å
589	P	97.1	Very high	96.4	Very high	100 Å²	100	41.7 Å²	41.7	65%	0.649	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-60	-25.3	178.3	-24.9	36	0	0	0	114.4	I587	I587-P589 VanDerWaalsContact C-CD 3.4Å; I587-P589 VanDerWaalsContact C-N 3.32Å
590	Y	97.5	Very high	96.3	Very high	73 Å²	73	47.8 Å²	47.8	29%	0.286	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-94.7	-20.6	-176.6	-53.2	-85.5	0	0	0	112.6	V550 E551 L554 I587 I588 P592 T593 L594	V550-Y590 HydrophobicContact CG1-CD2 4.12Å; V550-Y590 HydrophobicContact CG1-CE2 3.65Å; E551-Y590 HydrophobicContact CB-CE1 4.01Å; E551-Y590 HydrophobicContact CG-CE1 3.99Å; L554-Y590 HydrophobicContact CD1-CD2 4.04Å; L554-Y590 HydrophobicContact CD1-CG 3.96Å; I587-Y590 WeakPolarHBondContact O-CA 3.49Å; I587-Y590 WeakPolarHBondContact O-CB 3.23Å; I587-Y590 PolarHBondContact O-N 2.83Å; I588-Y590 PolarHBondContact O-N 3.29Å; I588-Y590 VanDerWaalsContact O-N 3.15Å; Y590-P592 VanDerWaalsContact C-CD 3.42Å; Y590-T593 PolarHBondContact O-N 3.34Å; Y590-L594 WeakPolarHBondContact O-CG 3.21Å; Y590-L594 PolarHBondContact O-N 3.48Å; Y590-L594 VanDerWaalsContact O-N 3.08Å
591	I	96.8	Very high	96.3	Very high	8 Å²	8	49.7 Å²	49.7	4%	0.041	27%	0.27	C	S	.	.	H	α-helix	trans	-48.7	-44.5	-175.8	-71.8	-58.3	0	0	0	114	I587 I588 T593 L594 I595 F640	I587-I591 HydrophobicContact CD1-CD1 3.76Å; I587-I591 HydrophobicContact CG1-CD1 3.74Å; I587-I591 HydrophobicContact CG1-CG1 4.04Å; I587-I591 PolarHBondContact O-N 2.81Å; I588-I591 PolarHBondContact O-N 3.39Å; I591-T593 VanDerWaalsContact C-N 3.27Å; I591-T593 PolarHBondContact O-N 3.1Å; I591-L594 PolarHBondContact O-N 3.27Å; I591-I595 HydrophobicContact CG2-CG1 4.28Å; I591-I595 WeakPolarHBondContact O-CB 3.29Å; I591-I595 PolarHBondContact O-N 2.92Å; I591-F640 HydrophobicContact CG2-CE1 4.24Å; I591-F640 HydrophobicContact CG2-CZ 3.82Å
592	P	96.1	Very high	96.4	Very high	88 Å²	88	48.3 Å²	48.3	57%	0.571	26%	0.26	S	S	*	.	H	α-helix	trans	-54.7	-43.4	-179.9	-27.6	36.2	0	0	0	113	Y590 T596	Y590-P592 VanDerWaalsContact C-CD 3.42Å; P592-T596 PolarHBondContact O-N 2.8Å; P592-T596 PolarHBondContact O-OG1 3.34Å; P592-T596 VanDerWaalsContact O-OG1 3.12Å
593	T	96.7	Very high	96.5	Very high	84 Å²	84	49.7 Å²	49.7	52%	0.515	27%	0.268	S	S	.	.	H	α-helix	trans	-72.3	-44.8	177.4	-56.2	0	0	0	0	111.8	Y590 I591 I595 T596 Q597	Y590-T593 PolarHBondContact O-N 3.34Å; I591-T593 VanDerWaalsContact C-N 3.27Å; I591-T593 PolarHBondContact O-N 3.1Å; T593-I595 VanDerWaalsContact C-N 3.35Å; T593-I595 PolarHBondContact O-N 3.45Å; T593-T596 PolarHBondContact O-N 2.86Å; T593-Q597 WeakPolarHBondContact O-CG 3.44Å; T593-Q597 PolarHBondContact O-N 3.49Å
594	L	97.3	Very high	96.5	Very high	9 Å²	9	52.2 Å²	52.2	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-39.7	-177.6	-58.5	-178.6	0	0	0	111.7	L554 F558 F580 Y590 I591 Q597 L598	L554-L594 HydrophobicContact CD1-CD1 3.9Å; L554-L594 HydrophobicContact CD2-CD1 4.35Å; F558-L594 HydrophobicContact CD2-CD2 3.83Å; F558-L594 HydrophobicContact CE2-CB 4.49Å; F558-L594 HydrophobicContact CE2-CD1 4.5Å; F558-L594 HydrophobicContact CE2-CD2 3.61Å; F558-L594 HydrophobicContact CE2-CG 4.38Å; F558-L594 HydrophobicContact CG-CD2 4.39Å; F558-L594 HydrophobicContact CZ-CB 4.13Å; F558-L594 HydrophobicContact CZ-CD2 3.97Å; F558-L594 HydrophobicContact CZ-CG 4.49Å; F580-L594 HydrophobicContact CE1-CD1 3.58Å; F580-L594 HydrophobicContact CZ-CB 4.42Å; F580-L594 HydrophobicContact CZ-CD1 3.62Å; Y590-L594 WeakPolarHBondContact O-CG 3.21Å; Y590-L594 PolarHBondContact O-N 3.48Å; Y590-L594 VanDerWaalsContact O-N 3.08Å; I591-L594 PolarHBondContact O-N 3.27Å; L594-Q597 PolarHBondContact O-N 3.48Å; L594-L598 WeakPolarHBondContact O-CG 3.25Å; L594-L598 PolarHBondContact O-N 3.13Å
595	I	97	Very high	96.5	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.051	27%	0.273	C	S	.	.	H	α-helix	trans	-65.1	-41.6	176.9	-95.1	-54	0	0	0	111.8	I591 T593 Q597 L598 T599 I622 F640 A643	I591-I595 HydrophobicContact CG2-CG1 4.28Å; I591-I595 WeakPolarHBondContact O-CB 3.29Å; I591-I595 PolarHBondContact O-N 2.92Å; T593-I595 VanDerWaalsContact C-N 3.35Å; T593-I595 PolarHBondContact O-N 3.45Å; I595-Q597 VanDerWaalsContact C-N 3.25Å; I595-Q597 PolarHBondContact O-N 2.93Å; I595-L598 HydrophobicContact CD1-CD1 4.31Å; I595-L598 PolarHBondContact O-N 3.34Å; I595-T599 VanDerWaalsContact O-CB 3.3Å; I595-T599 WeakPolarHBondContact O-CB 3.41Å; I595-T599 PolarHBondContact O-N 2.99Å; I595-T599 PolarHBondContact O-OG1 2.99Å; I595-I622 HydrophobicContact CD1-CG1 4.34Å; I595-I622 HydrophobicContact CD1-CG2 4.46Å; I595-F640 HydrophobicContact CD1-CD1 4.01Å; I595-F640 HydrophobicContact CD1-CE1 3.88Å; I595-F640 HydrophobicContact CG1-CD1 3.84Å; I595-F640 HydrophobicContact CG1-CE1 3.47Å; I595-F640 VanDerWaalsContact CG1-CE1 3.47Å; I595-F640 HydrophobicContact CG1-CZ 4.49Å; I595-A643 HydrophobicContact CG2-CB 3.75Å
596	T	96.7	Very high	96.5	Very high	73 Å²	73	43.3 Å²	43.3	45%	0.448	25%	0.248	S	C	.	.	H	α-helix	trans	-57.2	-43.3	174.8	-59.1	0	0	0	0	111	P592 T593 Q600	P592-T596 PolarHBondContact O-N 2.8Å; P592-T596 PolarHBondContact O-OG1 3.34Å; P592-T596 VanDerWaalsContact O-OG1 3.12Å; T593-T596 PolarHBondContact O-N 2.86Å; T596-Q600 WeakPolarHBondContact O-CB 3.32Å; T596-Q600 VanDerWaalsContact O-CG 3.27Å; T596-Q600 WeakPolarHBondContact O-CG 3.42Å; T596-Q600 PolarHBondContact O-N 3.33Å
597	Q	97.1	Very high	96.4	Very high	74 Å²	74	48.6 Å²	48.6	35%	0.346	26%	0.263	S	S	.	.	H	α-helix	trans	-68.7	-43.5	178.9	-65.6	-179.7	21.2	0	0	112.5	F558 T593 L594 I595 Q600 K601	F558-Q597 VanDerWaalsContact CB-OE1 3.29Å; F558-Q597 HydrophobicContact CD1-CB 3.83Å; F558-Q597 HydrophobicContact CE1-CB 3.85Å; T593-Q597 WeakPolarHBondContact O-CG 3.44Å; T593-Q597 PolarHBondContact O-N 3.49Å; L594-Q597 PolarHBondContact O-N 3.48Å; I595-Q597 VanDerWaalsContact C-N 3.25Å; I595-Q597 PolarHBondContact O-N 2.93Å; Q597-Q600 PolarHBondContact O-N 3.07Å; Q597-K601 WeakPolarHBondContact O-CB 3.23Å; Q597-K601 PolarHBondContact O-N 3.04Å
598	L	97.8	Very high	96.1	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-41.9	176.1	-72.5	171.4	0	0	0	111.9	F558 M573 F580 L594 I595 K601 L602 M618 A621 I622	F558-L598 HydrophobicContact CE1-CD2 4Å; F558-L598 HydrophobicContact CE1-CG 3.94Å; F558-L598 HydrophobicContact CZ-CD1 4.37Å; F558-L598 HydrophobicContact CZ-CD2 4.02Å; F558-L598 HydrophobicContact CZ-CG 3.94Å; M573-L598 HydrophobicContact CE-CD2 3.93Å; M573-L598 HydrophobicContact SD-CD2 3.98Å; F580-L598 HydrophobicContact CE2-CD1 4.2Å; L594-L598 WeakPolarHBondContact O-CG 3.25Å; L594-L598 PolarHBondContact O-N 3.13Å; I595-L598 HydrophobicContact CD1-CD1 4.31Å; I595-L598 PolarHBondContact O-N 3.34Å; L598-K601 WeakPolarHBondContact O-CB 3.36Å; L598-K601 PolarHBondContact O-N 2.83Å; L598-L602 WeakPolarHBondContact O-CB 3.37Å; L598-L602 PolarHBondContact O-N 3.29Å; L598-M618 HydrophobicContact CD2-CG 4.2Å; L598-A621 HydrophobicContact CD1-CB 4.4Å; L598-I622 HydrophobicContact CB-CG1 4.18Å; L598-I622 HydrophobicContact CD1-CG1 4.16Å
599	T	97.2	Very high	95.7	Very high	16 Å²	16	52.7 Å²	52.7	10%	0.098	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-45.1	176.5	-65.9	0	0	0	0	111.8	I595 K601 L602 L603 A643 V647	I595-T599 VanDerWaalsContact O-CB 3.3Å; I595-T599 WeakPolarHBondContact O-CB 3.41Å; I595-T599 PolarHBondContact O-N 2.99Å; I595-T599 PolarHBondContact O-OG1 2.99Å; T599-K601 VanDerWaalsContact C-N 3.26Å; T599-K601 PolarHBondContact O-N 2.85Å; T599-L602 PolarHBondContact O-N 3.49Å; T599-L603 PolarHBondContact O-N 3.24Å; T599-A643 WeakPolarHBondContact CG2-O 3.37Å; T599-V647 HydrophobicContact CG2-CG2 3.5Å; T599-V647 VanDerWaalsContact CG2-CG2 3.5Å
600	Q	96.3	Very high	95.3	Very high	128 Å²	128	50.5 Å²	50.5	60%	0.598	28%	0.275	S	S	*	.	H	α-helix	trans	-60.6	-39.6	175	-75	173	-0.1	0	0	111.4	T596 Q597 L603 A604	T596-Q600 WeakPolarHBondContact O-CB 3.32Å; T596-Q600 VanDerWaalsContact O-CG 3.27Å; T596-Q600 WeakPolarHBondContact O-CG 3.42Å; T596-Q600 PolarHBondContact O-N 3.33Å; Q597-Q600 PolarHBondContact O-N 3.07Å; Q600-L603 PolarHBondContact O-N 2.8Å; Q600-A604 PolarHBondContact O-N 2.9Å
601	K	96	Very high	95	Very high	39 Å²	39	49.8 Å²	49.8	17%	0.17	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-47	177.1	-156.6	70.9	171.1	-167.6	0	111.8	L561 S567 Q597 L598 T599 L603 A604 V605 F614 M618	L561-K601 PolarHBondContact O-NZ 2.97Å; S567-K601 VanDerWaalsContact CA-NZ 3.33Å; S567-K601 WeakPolarHBondContact O-CE 3.25Å; S567-K601 PolarHBondContact O-NZ 3.33Å; Q597-K601 WeakPolarHBondContact O-CB 3.23Å; Q597-K601 PolarHBondContact O-N 3.04Å; L598-K601 WeakPolarHBondContact O-CB 3.36Å; L598-K601 PolarHBondContact O-N 2.83Å; T599-K601 VanDerWaalsContact C-N 3.26Å; T599-K601 PolarHBondContact O-N 2.85Å; K601-L603 VanDerWaalsContact C-N 3.28Å; K601-L603 PolarHBondContact O-N 2.94Å; K601-A604 WeakPolarHBondContact O-CB 3.42Å; K601-A604 PolarHBondContact O-N 3.44Å; K601-V605 WeakPolarHBondContact O-CG2 3.45Å; K601-V605 PolarHBondContact O-N 3.41Å; K601-F614 HydrophobicContact CG-CE1 4.37Å; K601-F614 HydrophobicContact CG-CZ 3.93Å; K601-M618 HydrophobicContact CB-SD 4.13Å; K601-M618 HydrophobicContact CG-SD 4.23Å
602	L	97.6	Very high	94.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-54.6	-45.3	176.2	175.2	61.6	0	0	0	111.4	L598 T599 A604 S606 M618 F619 I622 L644 V647 F648 I651 F659	L598-L602 WeakPolarHBondContact O-CB 3.37Å; L598-L602 PolarHBondContact O-N 3.29Å; T599-L602 PolarHBondContact O-N 3.49Å; L602-A604 VanDerWaalsContact C-N 3.35Å; L602-A604 PolarHBondContact O-N 3.09Å; L602-S606 VanDerWaalsContact O-CB 3.31Å; L602-S606 WeakPolarHBondContact O-CB 3.42Å; L602-S606 PolarHBondContact O-N 3.47Å; L602-S606 PolarHBondContact O-OG 3.1Å; L602-M618 HydrophobicContact CB-CE 4Å; L602-M618 HydrophobicContact CB-SD 4.09Å; L602-M618 HydrophobicContact CD1-CE 3.54Å; L602-M618 HydrophobicContact CG-CE 4.37Å; L602-F619 HydrophobicContact CD1-CE1 4.08Å; L602-F619 HydrophobicContact CD1-CE2 3.86Å; L602-F619 HydrophobicContact CD1-CZ 3.47Å; L602-F619 VanDerWaalsContact CD1-CZ 3.47Å; L602-F619 HydrophobicContact CD2-CE1 4.24Å; L602-F619 HydrophobicContact CD2-CZ 4.38Å; L602-I622 HydrophobicContact CD2-CD1 4.26Å; L602-L644 HydrophobicContact CD2-CD2 4.48Å; L602-V647 HydrophobicContact CB-CG1 4.38Å; L602-V647 HydrophobicContact CD2-CG1 3.88Å; L602-V647 HydrophobicContact CG-CG1 3.76Å; L602-F648 HydrophobicContact CD2-CD1 4.48Å; L602-F648 HydrophobicContact CD2-CE1 4.01Å; L602-I651 HydrophobicContact CD1-CD1 4.07Å; L602-I651 HydrophobicContact CD2-CD1 4.37Å; L602-I651 HydrophobicContact CG-CD1 4.15Å; L602-F659 HydrophobicContact CD1-CD2 3.92Å; L602-F659 HydrophobicContact CD1-CE2 3.84Å
603	L	96.2	Very high	94.5	Very high	47 Å²	47	52.1 Å²	52.1	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-35.1	176.5	179.4	60	0	0	0	113.1	T599 Q600 K601 S606 V647 E650	T599-L603 PolarHBondContact O-N 3.24Å; Q600-L603 PolarHBondContact O-N 2.8Å; K601-L603 VanDerWaalsContact C-N 3.28Å; K601-L603 PolarHBondContact O-N 2.94Å; L603-S606 PolarHBondContact O-OG 2.78Å; L603-V647 HydrophobicContact CB-CG1 3.94Å; L603-V647 HydrophobicContact CB-CG2 4.02Å; L603-V647 HydrophobicContact CD1-CG1 4.27Å; L603-E650 HydrophobicContact CD1-CG 4.3Å; L603-E650 WeakPolarHBondContact CD1-OE2 3.33Å
604	A	95	Very high	94.5	Very high	55 Å²	55	48.1 Å²	48.1	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-69.1	-48.1	177.1	0	0	0	0	0	111.2	Q600 K601 L602 K607	Q600-A604 PolarHBondContact O-N 2.9Å; K601-A604 WeakPolarHBondContact O-CB 3.42Å; K601-A604 PolarHBondContact O-N 3.44Å; L602-A604 VanDerWaalsContact C-N 3.35Å; L602-A604 PolarHBondContact O-N 3.09Å; A604-K607 WeakPolarHBondContact O-CB 3.29Å; A604-K607 PolarHBondContact O-N 3Å
605	V	94.9	Very high	94.4	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.03	26%	0.257	C	S	.	.	H	α-helix	trans	-75.5	-23	-177.6	-56.4	0	0	0	0	112.8	E568 K601 K607 N608 P609 F614 N615 M618 F659	E568-V605 HydrophobicContact CG-CG1 3.65Å; K601-V605 WeakPolarHBondContact O-CG2 3.45Å; K601-V605 PolarHBondContact O-N 3.41Å; V605-K607 PolarHBondContact O-N 3.29Å; V605-N608 CarbonylContact O-C 2.83Å; V605-N608 PolarHBondContact O-N 2.86Å; V605-N608 VanDerWaalsContact O-N 3.07Å; V605-P609 WeakPolarHBondContact O-CA 3.43Å; V605-P609 VanDerWaalsContact O-N 3.09Å; V605-F614 HydrophobicContact CG1-CD1 4.49Å; V605-F614 HydrophobicContact CG1-CE1 3.88Å; V605-F614 HydrophobicContact CG2-CE1 4.47Å; V605-N615 WeakPolarHBondContact CG2-OD1 3.44Å; V605-M618 HydrophobicContact CG2-CE 3.59Å; V605-M618 HydrophobicContact CG2-SD 4.35Å; V605-F659 HydrophobicContact CB-CZ 4.48Å; V605-F659 HydrophobicContact CG2-CE2 3.84Å; V605-F659 HydrophobicContact CG2-CZ 3.81Å
606	S	94.5	Very high	94.4	Very high	6 Å²	6	48.6 Å²	48.6	4%	0.042	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.7	173.9	65.5	0	0	0	0	113.5	L602 L603 N608 V656 F659	L602-S606 VanDerWaalsContact O-CB 3.31Å; L602-S606 WeakPolarHBondContact O-CB 3.42Å; L602-S606 PolarHBondContact O-N 3.47Å; L602-S606 PolarHBondContact O-OG 3.1Å; L603-S606 PolarHBondContact O-OG 2.78Å; S606-N608 VanDerWaalsContact C-N 3.31Å; S606-V656 WeakPolarHBondContact O-CG1 3.48Å; S606-V656 WeakPolarHBondContact O-CG2 3.45Å; S606-F659 VanDerWaalsContact CA-CE2 3.47Å
607	K	92.6	Very high	94.4	Very high	153 Å²	153	46.7 Å²	46.7	67%	0.665	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-24.4	175.1	-63.5	176	-177.6	179.2	0	112.5	A604 V605	A604-K607 WeakPolarHBondContact O-CB 3.29Å; A604-K607 PolarHBondContact O-N 3Å; V605-K607 PolarHBondContact O-N 3.29Å
608	N	90.4	Very high	94.4	Very high	109 Å²	109	43.1 Å²	43.1	58%	0.583	23%	0.229	S	C	*	.	S	Bend	trans	-155.7	81.8	177.4	-176.8	37.8	0	0	0	109.6	V605 S606 S610	V605-N608 CarbonylContact O-C 2.83Å; V605-N608 PolarHBondContact O-N 2.86Å; V605-N608 VanDerWaalsContact O-N 3.07Å; S606-N608 VanDerWaalsContact C-N 3.31Å; N608-S610 VanDerWaalsContact C-N 3.25Å; N608-S610 PolarHBondContact O-N 3.49Å
609	P	89.1	Confident	94.4	Very high	28 Å²	28	43.1 Å²	43.1	18%	0.182	23%	0.228	C	C	.	.			trans	-72.4	77.7	-174.7	30.5	-36.7	0	0	0	111.3	V605 V656 E658 F659	V605-P609 WeakPolarHBondContact O-CA 3.43Å; V605-P609 VanDerWaalsContact O-N 3.09Å; P609-V656 HydrophobicContact CB-CG1 4.47Å; P609-V656 HydrophobicContact CG-CG1 3.86Å; P609-E658 HydrophobicContact CB-CB 4.11Å; P609-E658 HydrophobicContact CB-CG 4.28Å; P609-E658 HydrophobicContact CG-CB 4.13Å; P609-E658 HydrophobicContact CG-CG 3.96Å; P609-E658 WeakPolarHBondContact CG-OE2 3.46Å; P609-F659 HydrophobicContact CB-CD1 4.22Å; P609-F659 HydrophobicContact CB-CE1 3.53Å; P609-F659 HydrophobicContact CB-CZ 3.69Å
610	S	87.9	Confident	94.4	Very high	55 Å²	55	42.7 Å²	42.7	39%	0.385	23%	0.225	S	C	.	.			trans	-92.9	-21.8	-167.7	73.1	0	0	0	0	115	E568 N608	E568-S610 PolarHBondContact OE2-OG 2.98Å; N608-S610 VanDerWaalsContact C-N 3.25Å; N608-S610 PolarHBondContact O-N 3.49Å
611	K	91.1	Very high	94.5	Very high	58 Å²	58	36.6 Å²	36.6	25%	0.252	20%	0.197	S	C	.	.			trans	-120.2	91.3	-176.3	-59.4	-59.7	-172.6	179.4	0	112.3	E367 E568 H613 F614 N615	E367-K611 IonicContact OE1-NZ 3.5Å; E367-K611 PolarHBondContact OE1-NZ 2.84Å; E367-K611 IonicContact OE2-NZ 3.79Å; E367-K611 PolarHBondContact OE2-NZ 3.27Å; E568-K611 HydrophobicContact CB-CB 4.22Å; E568-K611 HydrophobicContact CB-CG 3.76Å; K611-H613 PolarHBondContact O-N 2.87Å; K611-F614 HydrophobicContact CB-CB 3.83Å; K611-F614 PolarHBondContact O-N 3.14Å; K611-N615 PolarHBondContact O-N 3.24Å; K611-N615 VanDerWaalsContact O-N 3.08Å; K611-N615 PolarHBondContact O-ND2 2.94Å
612	P	91.6	Very high	94.6	Very high	85 Å²	85	34.7 Å²	34.7	55%	0.552	19%	0.189	S	C	*	.	H	α-helix	trans	-56.6	-43.7	-173.9	-27.9	35.5	0	0	0	115.3	N615 H616	P612-N615 PolarHBondContact O-N 2.85Å; P612-H616 WeakPolarHBondContact O-CB 3.5Å; P612-H616 PolarHBondContact O-N 2.85Å
613	H	91.8	Very high	94.6	Very high	59 Å²	59	34.7 Å²	34.7	27%	0.273	19%	0.189	S	C	.	.	H	α-helix	trans	-67.9	-42.2	179.7	-66.1	-50.4	0	0	0	112.6	E570 K611 N615 H616 Y617	E570-H613 HydrophobicContact CB-CB 4.19Å; E570-H613 IonicContact OE1-CD2 2.71Å; E570-H613 VanDerWaalsContact OE2-CB 3.31Å; E570-H613 WeakPolarHBondContact OE2-CB 3.39Å; E570-H613 IonicContact OE2-CD2 2.77Å; E570-H613 IonicContact OE2-CG 3.76Å; K611-H613 PolarHBondContact O-N 2.87Å; H613-N615 VanDerWaalsContact C-N 3.3Å; H613-N615 PolarHBondContact O-N 3.44Å; H613-H616 PolarHBondContact O-N 3.49Å; H613-Y617 HydrophobicContact CB-CD2 4.45Å; H613-Y617 HydrophobicContact CB-CE2 3.92Å; H613-Y617 WeakPolarHBondContact O-CD2 3.25Å; H613-Y617 PolarHBondContact O-N 3.32Å
614	F	96.5	Very high	94.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-54.5	-49.3	172.2	173.4	-92.4	0	0	0	111	L561 E568 N569 E570 M573 K601 V605 K611 H616 Y617 M618	L561-F614 HydrophobicContact CD2-CE2 3.95Å; E568-F614 HydrophobicContact CB-CD1 4.19Å; E568-F614 HydrophobicContact CB-CD2 4.49Å; E568-F614 HydrophobicContact CB-CG 4.2Å; E568-F614 HydrophobicContact CG-CD1 4.33Å; E568-F614 HydrophobicContact CG-CE1 4.33Å; E568-F614 WeakPolarHBondContact O-CB 3.32Å; E568-F614 WeakPolarHBondContact O-CD2 3.5Å; E568-F614 WeakPolarHBondContact O-CG 3.32Å; N569-F614 WeakPolarHBondContact O-CD2 3.33Å; E570-F614 HydrophobicContact CB-CB 4.01Å; M573-F614 HydrophobicContact CB-CD2 3.62Å; M573-F614 HydrophobicContact CB-CE2 3.71Å; M573-F614 HydrophobicContact CE-CD2 4.49Å; M573-F614 HydrophobicContact CE-CE1 4.41Å; M573-F614 HydrophobicContact CE-CE2 3.56Å; M573-F614 HydrophobicContact CE-CZ 3.51Å; M573-F614 HydrophobicContact CG-CD2 4.24Å; M573-F614 HydrophobicContact CG-CE2 4.18Å; K601-F614 HydrophobicContact CG-CE1 4.37Å; K601-F614 HydrophobicContact CG-CZ 3.93Å; V605-F614 HydrophobicContact CG1-CD1 4.49Å; V605-F614 HydrophobicContact CG1-CE1 3.88Å; V605-F614 HydrophobicContact CG2-CE1 4.47Å; K611-F614 HydrophobicContact CB-CB 3.83Å; K611-F614 PolarHBondContact O-N 3.14Å; F614-H616 PolarHBondContact O-N 3.21Å; F614-Y617 PolarHBondContact O-N 2.82Å; F614-M618 HydrophobicContact CE1-CE 4.45Å; F614-M618 HydrophobicContact CE1-SD 4.06Å; F614-M618 HydrophobicContact CZ-SD 4.47Å; F614-M618 WeakPolarHBondContact O-CB 3.48Å; F614-M618 PolarHBondContact O-N 2.92Å
615	N	95.9	Very high	94.7	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-46	180	-65.3	-34.3	0	0	0	111.4	V605 K611 P612 H613 M618 F619 F659	V605-N615 WeakPolarHBondContact CG2-OD1 3.44Å; K611-N615 PolarHBondContact O-N 3.24Å; K611-N615 VanDerWaalsContact O-N 3.08Å; K611-N615 PolarHBondContact O-ND2 2.94Å; P612-N615 PolarHBondContact O-N 2.85Å; H613-N615 VanDerWaalsContact C-N 3.3Å; H613-N615 PolarHBondContact O-N 3.44Å; N615-M618 WeakPolarHBondContact O-CB 3.12Å; N615-M618 PolarHBondContact O-N 2.9Å; N615-F619 VanDerWaalsContact O-CD2 3.25Å; N615-F619 WeakPolarHBondContact O-CD2 3.38Å; N615-F619 PolarHBondContact O-N 2.89Å; N615-F659 HydrophobicContact CB-CE1 3.66Å; N615-F659 HydrophobicContact CB-CZ 4.01Å; N615-F659 VanDerWaalsContact ND2-CE1 3.33Å; N615-F659 WeakPolarHBondContact ND2-CE1 3.49Å; N615-F659 WeakPolarHBondContact OD1-CZ 3.27Å
616	H	95.6	Very high	94.8	Very high	25 Å²	25	29.9 Å²	29.9	12%	0.116	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-53.3	176.4	-177	84.2	0	0	0	112	P612 H613 F614 M618 F619 E620 Y662	P612-H616 WeakPolarHBondContact O-CB 3.5Å; P612-H616 PolarHBondContact O-N 2.85Å; H613-H616 PolarHBondContact O-N 3.49Å; F614-H616 PolarHBondContact O-N 3.21Å; H616-M618 VanDerWaalsContact C-N 3.26Å; H616-M618 PolarHBondContact O-N 3.38Å; H616-F619 PolarHBondContact O-N 3.11Å; H616-E620 IonicContact CE1-OE1 3.25Å; H616-E620 IonicContact NE2-OE1 3.94Å; H616-E620 WeakPolarHBondContact O-CG 3.44Å; H616-E620 PolarHBondContact O-N 3.03Å; H616-Y662 HydrophobicContact CB-CE1 4.5Å; H616-Y662 WeakPolarHBondContact CB-OH 3.12Å; H616-Y662 AromaticContact ND1-CE1 3.52Å; H616-Y662 AromaticContact ND1-CZ 3.71Å; H616-Y662 PolarHBondContact ND1-OH 3.49Å
617	Y	97	Very high	94.8	Very high	33 Å²	33	33.2 Å²	33.2	13%	0.129	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-30.6	-180	-59.8	-46.7	0	0	0	112.8	E570 K574 M577 H613 F614 E620 A621	E570-Y617 HydrophobicContact CB-CD2 4.44Å; E570-Y617 HydrophobicContact CB-CE2 4.48Å; K574-Y617 HydrophobicContact CB-CD1 4.39Å; K574-Y617 HydrophobicContact CB-CD2 3.69Å; K574-Y617 HydrophobicContact CB-CE2 3.91Å; K574-Y617 HydrophobicContact CB-CG 3.97Å; K574-Y617 HydrophobicContact CD-CD2 4.35Å; K574-Y617 HydrophobicContact CD-CE1 4.01Å; K574-Y617 HydrophobicContact CD-CE2 3.74Å; K574-Y617 WeakPolarHBondContact CE-OH 3.49Å; K574-Y617 HydrophobicContact CG-CD1 4.05Å; K574-Y617 HydrophobicContact CG-CD2 4.08Å; K574-Y617 HydrophobicContact CG-CE1 3.91Å; K574-Y617 HydrophobicContact CG-CE2 3.96Å; K574-Y617 HydrophobicContact CG-CG 4.15Å; K574-Y617 PolarHBondContact NZ-OH 2.91Å; M577-Y617 HydrophobicContact CE-CD1 4.26Å; M577-Y617 HydrophobicContact SD-CD1 4.04Å; H613-Y617 HydrophobicContact CB-CD2 4.45Å; H613-Y617 HydrophobicContact CB-CE2 3.92Å; H613-Y617 WeakPolarHBondContact O-CD2 3.25Å; H613-Y617 PolarHBondContact O-N 3.32Å; F614-Y617 PolarHBondContact O-N 2.82Å; Y617-E620 PolarHBondContact O-N 3.48Å; Y617-A621 WeakPolarHBondContact O-CB 3.46Å; Y617-A621 PolarHBondContact O-N 3.41Å
618	M	98	Very high	94.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-45.9	174.5	-176.5	-179.5	56.2	0	0	111.3	M573 L598 K601 L602 V605 F614 N615 H616 E620 A621 I622	M573-M618 HydrophobicContact CE-CB 3.92Å; M573-M618 HydrophobicContact CE-CG 3.89Å; M573-M618 HydrophobicContact CE-SD 4.42Å; M573-M618 HydrophobicContact CG-CB 3.88Å; M573-M618 VanDerWaalsContact CG-N 3.32Å; M573-M618 HydrophobicContact SD-CB 3.9Å; M573-M618 HydrophobicContact SD-CG 4.23Å; L598-M618 HydrophobicContact CD2-CG 4.2Å; K601-M618 HydrophobicContact CB-SD 4.13Å; K601-M618 HydrophobicContact CG-SD 4.23Å; L602-M618 HydrophobicContact CB-CE 4Å; L602-M618 HydrophobicContact CB-SD 4.09Å; L602-M618 HydrophobicContact CD1-CE 3.54Å; L602-M618 HydrophobicContact CG-CE 4.37Å; V605-M618 HydrophobicContact CG2-CE 3.59Å; V605-M618 HydrophobicContact CG2-SD 4.35Å; F614-M618 HydrophobicContact CE1-CE 4.45Å; F614-M618 HydrophobicContact CE1-SD 4.06Å; F614-M618 HydrophobicContact CZ-SD 4.47Å; F614-M618 WeakPolarHBondContact O-CB 3.48Å; F614-M618 PolarHBondContact O-N 2.92Å; N615-M618 WeakPolarHBondContact O-CB 3.12Å; N615-M618 PolarHBondContact O-N 2.9Å; H616-M618 VanDerWaalsContact C-N 3.26Å; H616-M618 PolarHBondContact O-N 3.38Å; M618-E620 VanDerWaalsContact C-N 3.34Å; M618-A621 PolarHBondContact O-N 3.49Å; M618-I622 HydrophobicContact CG-CD1 4.43Å; M618-I622 WeakPolarHBondContact O-CG1 3.45Å; M618-I622 PolarHBondContact O-N 2.83Å
619	F	98	Very high	95.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.2	-38.6	174.6	-83.3	-71.4	0	0	0	112.2	L602 N615 H616 I622 C623 F659 Y662 V663 V666 L906	L602-F619 HydrophobicContact CD1-CE1 4.08Å; L602-F619 HydrophobicContact CD1-CE2 3.86Å; L602-F619 HydrophobicContact CD1-CZ 3.47Å; L602-F619 VanDerWaalsContact CD1-CZ 3.47Å; L602-F619 HydrophobicContact CD2-CE1 4.24Å; L602-F619 HydrophobicContact CD2-CZ 4.38Å; N615-F619 VanDerWaalsContact O-CD2 3.25Å; N615-F619 WeakPolarHBondContact O-CD2 3.38Å; N615-F619 PolarHBondContact O-N 2.89Å; H616-F619 PolarHBondContact O-N 3.11Å; F619-I622 PolarHBondContact O-N 2.86Å; F619-C623 PolarHBondContact O-N 2.95Å; F619-F659 HydrophobicContact CE2-CB 4.44Å; F619-F659 HydrophobicContact CE2-CD1 4.16Å; F619-F659 HydrophobicContact CE2-CD2 4.27Å; F619-F659 HydrophobicContact CE2-CG 4.04Å; F619-F659 HydrophobicContact CZ-CB 4.34Å; F619-F659 HydrophobicContact CZ-CD2 4.35Å; F619-F659 HydrophobicContact CZ-CG 4.28Å; F619-Y662 HydrophobicContact CB-CD1 3.95Å; F619-Y662 HydrophobicContact CB-CG 4.45Å; F619-Y662 HydrophobicContact CD1-CG 4.49Å; F619-Y662 AromaticContact CD2-CD1 3.85Å; F619-Y662 HydrophobicContact CD2-CD1 3.85Å; F619-Y662 AromaticContact CD2-CD2 4Å; F619-Y662 HydrophobicContact CD2-CD2 4Å; F619-Y662 AromaticContact CD2-CG 3.53Å; F619-Y662 HydrophobicContact CD2-CG 3.53Å; F619-Y662 VanDerWaalsContact CE2-CB 3.48Å; F619-Y662 HydrophobicContact CE2-CD2 4.03Å; F619-Y662 AromaticContact CE2-CG 3.79Å; F619-Y662 HydrophobicContact CE2-CG 3.79Å; F619-Y662 AromaticContact CG-CD1 3.94Å; F619-Y662 HydrophobicContact CG-CD1 3.94Å; F619-Y662 AromaticContact CG-CG 3.93Å; F619-Y662 HydrophobicContact CG-CG 3.93Å; F619-Y662 HydrophobicContact CZ-CG 4.36Å; F619-V663 HydrophobicContact CZ-CG2 4.45Å; F619-V666 HydrophobicContact CD1-CG2 3.77Å; F619-V666 HydrophobicContact CE1-CG2 4.27Å; F619-L906 HydrophobicContact CB-CD1 3.94Å; F619-L906 HydrophobicContact CB-CD2 3.67Å; F619-L906 HydrophobicContact CB-CG 4.43Å
620	E	96.9	Very high	95.6	Very high	7 Å²	7	21 Å²	21	3%	0.033	11%	0.108	C	C	.	.	H	α-helix	trans	-61.4	-42.9	172.9	-72.4	-71.3	-157.3	0	0	112.2	M577 H616 Y617 M618 I622 C623 L624 L906 A907 F908	M577-E620 HydrophobicContact CG-CB 3.84Å; M577-E620 HydrophobicContact SD-CB 3.39Å; M577-E620 WeakPolarHBondContact SD-CB 3.38Å; M577-E620 HydrophobicContact SD-CG 3.97Å; H616-E620 IonicContact CE1-OE1 3.25Å; H616-E620 IonicContact NE2-OE1 3.94Å; H616-E620 WeakPolarHBondContact O-CG 3.44Å; H616-E620 PolarHBondContact O-N 3.03Å; Y617-E620 PolarHBondContact O-N 3.48Å; M618-E620 VanDerWaalsContact C-N 3.34Å; E620-I622 VanDerWaalsContact C-N 3.32Å; E620-I622 PolarHBondContact O-N 3.35Å; E620-C623 PolarHBondContact O-N 3.2Å; E620-L624 WeakPolarHBondContact O-CB 3.43Å; E620-L624 PolarHBondContact O-N 3.24Å; E620-L906 HydrophobicContact CG-CD2 3.68Å; E620-L906 WeakPolarHBondContact OE1-CA 3.3Å; E620-A907 WeakPolarHBondContact OE1-CB 3.13Å; E620-A907 PolarHBondContact OE1-N 3.5Å; E620-A907 PolarHBondContact OE2-N 3.32Å; E620-F908 HydrophobicContact CB-CD2 3.96Å; E620-F908 HydrophobicContact CB-CE2 4.47Å; E620-F908 HydrophobicContact CG-CD2 4.41Å; E620-F908 WeakPolarHBondContact OE2-CB 3.19Å; E620-F908 WeakPolarHBondContact OE2-CD2 3.27Å; E620-F908 PolarHBondContact OE2-N 3.04Å
621	A	97.7	Very high	95.9	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62	-39.6	175.8	0	0	0	0	0	111.9	M573 I576 M577 F580 L598 Y617 M618 S625	M573-A621 HydrophobicContact SD-CB 4.48Å; I576-A621 HydrophobicContact CG2-CB 4.45Å; M577-A621 HydrophobicContact CB-CB 4.16Å; F580-A621 HydrophobicContact CD2-CB 4.15Å; F580-A621 HydrophobicContact CE2-CB 4.02Å; L598-A621 HydrophobicContact CD1-CB 4.4Å; Y617-A621 WeakPolarHBondContact O-CB 3.46Å; Y617-A621 PolarHBondContact O-N 3.41Å; M618-A621 PolarHBondContact O-N 3.49Å; A621-S625 WeakPolarHBondContact O-CB 3.49Å; A621-S625 PolarHBondContact O-N 3.09Å; A621-S625 PolarHBondContact O-OG 2.85Å
622	I	98.3	Very high	96	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.2	-51.5	174.1	-68.2	166.5	0	0	0	110.6	I595 L598 L602 M618 F619 E620 L624 S625 I626 L644 V666	I595-I622 HydrophobicContact CD1-CG1 4.34Å; I595-I622 HydrophobicContact CD1-CG2 4.46Å; L598-I622 HydrophobicContact CB-CG1 4.18Å; L598-I622 HydrophobicContact CD1-CG1 4.16Å; L602-I622 HydrophobicContact CD2-CD1 4.26Å; M618-I622 HydrophobicContact CG-CD1 4.43Å; M618-I622 WeakPolarHBondContact O-CG1 3.45Å; M618-I622 PolarHBondContact O-N 2.83Å; F619-I622 PolarHBondContact O-N 2.86Å; E620-I622 VanDerWaalsContact C-N 3.32Å; E620-I622 PolarHBondContact O-N 3.35Å; I622-L624 VanDerWaalsContact C-N 3.29Å; I622-L624 PolarHBondContact O-N 2.92Å; I622-S625 WeakPolarHBondContact O-CB 3.43Å; I622-S625 PolarHBondContact O-N 3.39Å; I622-I626 HydrophobicContact CG2-CD1 3.89Å; I622-I626 WeakPolarHBondContact O-CG1 3.39Å; I622-I626 PolarHBondContact O-N 3.5Å; I622-L644 HydrophobicContact CD1-CD2 4.36Å; I622-L644 HydrophobicContact CG2-CD1 3.84Å; I622-L644 HydrophobicContact CG2-CD2 4.27Å; I622-V666 HydrophobicContact CG2-CG1 4.34Å
623	C	97.3	Very high	96.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.1	-42.1	178.5	-80.9	0	0	0	0	112.5	F619 E620 I626 R627 L669 F908	F619-C623 PolarHBondContact O-N 2.95Å; E620-C623 PolarHBondContact O-N 3.2Å; C623-I626 WeakPolarHBondContact O-CB 3.27Å; C623-I626 PolarHBondContact O-N 3Å; C623-R627 PolarHBondContact O-N 3.32Å; C623-L669 HydrophobicContact CB-CD2 3.92Å; C623-F908 HydrophobicContact CB-CB 3.86Å
624	L	95.3	Very high	96.3	Very high	6 Å²	6	25.8 Å²	25.8	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-66.8	-40.1	178.1	-174.3	55.2	0	0	0	111.9	M577 F580 E620 I622 I626 R627 I628 F908	M577-L624 WeakPolarHBondContact O-CD2 3.37Å; F580-L624 HydrophobicContact CB-CD2 3.69Å; F580-L624 HydrophobicContact CB-CG 4.16Å; E620-L624 WeakPolarHBondContact O-CB 3.43Å; E620-L624 PolarHBondContact O-N 3.24Å; I622-L624 VanDerWaalsContact C-N 3.29Å; I622-L624 PolarHBondContact O-N 2.92Å; L624-I626 VanDerWaalsContact C-N 3.34Å; L624-I626 PolarHBondContact O-N 3.45Å; L624-R627 PolarHBondContact O-N 3.38Å; L624-I628 HydrophobicContact CD1-CD1 3.85Å; L624-I628 HydrophobicContact CD1-CG1 4.1Å; L624-I628 HydrophobicContact CG-CD1 3.77Å; L624-I628 HydrophobicContact CG-CG1 4.45Å; L624-I628 WeakPolarHBondContact O-CB 3.47Å; L624-I628 VanDerWaalsContact O-CG1 3.28Å; L624-I628 WeakPolarHBondContact O-CG1 3.45Å; L624-I628 PolarHBondContact O-N 3.32Å; L624-F908 HydrophobicContact CB-CB 4.22Å; L624-F908 HydrophobicContact CB-CD2 4.05Å; L624-F908 HydrophobicContact CB-CG 4.04Å; L624-F908 HydrophobicContact CD1-CD1 3.87Å; L624-F908 HydrophobicContact CD1-CE1 4.1Å; L624-F908 HydrophobicContact CD1-CG 4.15Å; L624-F908 HydrophobicContact CD2-CD2 4.21Å; L624-F908 HydrophobicContact CD2-CE1 4.43Å; L624-F908 HydrophobicContact CD2-CE2 4Å; L624-F908 HydrophobicContact CD2-CZ 4.11Å; L624-F908 HydrophobicContact CG-CG 4.48Å
625	S	97.6	Very high	96.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-44.3	173	-60.2	0	0	0	0	111.7	F580 A621 I622 T629 F640	F580-S625 WeakPolarHBondContact CE2-OG 3.35Å; A621-S625 WeakPolarHBondContact O-CB 3.49Å; A621-S625 PolarHBondContact O-N 3.09Å; A621-S625 PolarHBondContact O-OG 2.85Å; I622-S625 WeakPolarHBondContact O-CB 3.43Å; I622-S625 PolarHBondContact O-N 3.39Å; S625-T629 VanDerWaalsContact O-CB 3.3Å; S625-T629 WeakPolarHBondContact O-CB 3.47Å; S625-T629 PolarHBondContact O-N 2.88Å; S625-T629 VanDerWaalsContact O-N 3.09Å; S625-T629 PolarHBondContact O-OG1 2.99Å; S625-F640 WeakPolarHBondContact O-CZ 3.48Å
626	I	97.5	Very high	96.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-50.6	175.1	-67.2	161.5	0	0	0	109.9	I622 C623 L624 T629 C630 F640 L644 V666 L669 L670	I622-I626 HydrophobicContact CG2-CD1 3.89Å; I622-I626 WeakPolarHBondContact O-CG1 3.39Å; I622-I626 PolarHBondContact O-N 3.5Å; C623-I626 WeakPolarHBondContact O-CB 3.27Å; C623-I626 PolarHBondContact O-N 3Å; L624-I626 VanDerWaalsContact C-N 3.34Å; L624-I626 PolarHBondContact O-N 3.45Å; I626-T629 PolarHBondContact O-N 3.48Å; I626-C630 WeakPolarHBondContact O-CB 3.31Å; I626-C630 PolarHBondContact O-N 3.16Å; I626-C630 PolarHBondContact O-SG 3.03Å; I626-F640 HydrophobicContact CB-CE1 4.45Å; I626-F640 HydrophobicContact CD1-CD1 4.37Å; I626-F640 HydrophobicContact CG1-CB 4.21Å; I626-F640 HydrophobicContact CG1-CD1 3.41Å; I626-F640 VanDerWaalsContact CG1-CD1 3.41Å; I626-F640 HydrophobicContact CG1-CD2 4.24Å; I626-F640 HydrophobicContact CG1-CE1 3.69Å; I626-F640 HydrophobicContact CG1-CE2 4.5Å; I626-F640 HydrophobicContact CG1-CG 3.71Å; I626-F640 HydrophobicContact CG1-CZ 4.25Å; I626-L644 HydrophobicContact CD1-CD1 4.26Å; I626-V666 HydrophobicContact CD1-CG1 3.74Å; I626-L669 HydrophobicContact CB-CD2 4.07Å; I626-L669 HydrophobicContact CD1-CD2 4.3Å; I626-L669 HydrophobicContact CG2-CD2 3.91Å; I626-L669 HydrophobicContact CG2-CG 4.05Å; I626-L670 HydrophobicContact CD1-CD2 3.74Å; I626-L670 HydrophobicContact CD1-CG 4.11Å; I626-L670 HydrophobicContact CG1-CD2 4.07Å; I626-L670 HydrophobicContact CG2-CD2 3.96Å
627	R	94.9	Very high	96.1	Very high	75 Å²	75	28.2 Å²	28.2	28%	0.283	16%	0.159	S	C	.	.	H	α-helix	trans	-61.8	-48.7	-178.4	-77.9	-162.9	-175.8	-88.4	-6.7	113.2	C623 L624 T629 K631 L669 F908 A909 G910	C623-R627 PolarHBondContact O-N 3.32Å; L624-R627 PolarHBondContact O-N 3.38Å; R627-T629 VanDerWaalsContact C-N 3.34Å; R627-T629 PolarHBondContact O-N 3.38Å; R627-K631 WeakPolarHBondContact O-CB 3.47Å; R627-K631 PolarHBondContact O-N 3.07Å; R627-L669 HydrophobicContact CG-CD1 4.17Å; R627-L669 HydrophobicContact CG-CD2 4.33Å; R627-F908 PolarHBondContact NE-O 3.25Å; R627-F908 PolarHBondContact NH2-O 3.39Å; R627-A909 VanDerWaalsContact NH2-C 3.28Å; R627-A909 PolarHBondContact NH2-O 2.88Å; R627-A909 VanDerWaalsContact NH2-O 3.11Å; R627-G910 PolarHBondContact NH2-O 3.49Å
628	I	95.3	Very high	96	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.036	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-49.7	-178.5	-70.2	166.1	0	0	0	109.3	Q584 I587 I588 L624 A632	Q584-I628 WeakPolarHBondContact O-CG2 3.48Å; I587-I628 HydrophobicContact CD1-CD1 3.69Å; I587-I628 HydrophobicContact CG1-CD1 4.49Å; I587-I628 HydrophobicContact CG1-CG2 4.47Å; I588-I628 HydrophobicContact CD1-CG2 4.17Å; I588-I628 HydrophobicContact CG1-CG2 3.84Å; L624-I628 HydrophobicContact CD1-CD1 3.85Å; L624-I628 HydrophobicContact CD1-CG1 4.1Å; L624-I628 HydrophobicContact CG-CD1 3.77Å; L624-I628 HydrophobicContact CG-CG1 4.45Å; L624-I628 WeakPolarHBondContact O-CB 3.47Å; L624-I628 VanDerWaalsContact O-CG1 3.28Å; L624-I628 WeakPolarHBondContact O-CG1 3.45Å; L624-I628 PolarHBondContact O-N 3.32Å; I628-A632 PolarHBondContact O-N 3.43Å
629	T	97.5	Very high	95.9	Very high	17 Å²	17	34.5 Å²	34.5	10%	0.104	20%	0.197	C	C	.	.	H	α-helix	trans	-70	-45.7	-175.9	-49.9	0	0	0	0	111.9	S625 I626 R627 K631 A632 N633 A636 F640	S625-T629 VanDerWaalsContact O-CB 3.3Å; S625-T629 WeakPolarHBondContact O-CB 3.47Å; S625-T629 PolarHBondContact O-N 2.88Å; S625-T629 VanDerWaalsContact O-N 3.09Å; S625-T629 PolarHBondContact O-OG1 2.99Å; I626-T629 PolarHBondContact O-N 3.48Å; R627-T629 VanDerWaalsContact C-N 3.34Å; R627-T629 PolarHBondContact O-N 3.38Å; T629-K631 VanDerWaalsContact C-N 3.35Å; T629-K631 PolarHBondContact O-N 3.15Å; T629-A632 PolarHBondContact O-N 3.19Å; T629-N633 PolarHBondContact O-N 3.01Å; T629-A636 HydrophobicContact CG2-CB 3.79Å; T629-F640 HydrophobicContact CG2-CE2 3.91Å; T629-F640 HydrophobicContact CG2-CZ 4.27Å
630	C	95.8	Very high	95.9	Very high	9 Å²	9	34.8 Å²	34.8	6%	0.061	20%	0.198	C	C	.	.	H	α-helix	trans	-76.5	-21.1	-177.2	-61.2	0	0	0	0	113.3	I626 A632 N633 P634 T673	I626-C630 WeakPolarHBondContact O-CB 3.31Å; I626-C630 PolarHBondContact O-N 3.16Å; I626-C630 PolarHBondContact O-SG 3.03Å; C630-A632 VanDerWaalsContact C-N 3.35Å; C630-N633 WeakPolarHBondContact CA-O 3.33Å; C630-N633 CarbonylContact O-C 3.59Å; C630-P634 VanDerWaalsContact O-CA 3.32Å; C630-P634 WeakPolarHBondContact O-CA 3.32Å; C630-P634 WeakPolarHBondContact O-CD 3.46Å; C630-P634 WeakPolarHBondContact O-CG 3.35Å; C630-P634 VanDerWaalsContact O-N 3.13Å; C630-T673 HydrophobicContact CB-CG2 3.64Å
631	K	93.9	Very high	95.9	Very high	160 Å²	160	35.2 Å²	35.2	70%	0.696	20%	0.2	S	C	*	.	H	α-helix	trans	-64.5	-41.6	167.7	-179.2	-174.8	174.7	-164	0	110.9	R627 T629	R627-K631 WeakPolarHBondContact O-CB 3.47Å; R627-K631 PolarHBondContact O-N 3.07Å; T629-K631 VanDerWaalsContact C-N 3.35Å; T629-K631 PolarHBondContact O-N 3.15Å
632	A	94.4	Very high	95.8	Very high	63 Å²	63	42.1 Å²	42.1	52%	0.521	23%	0.232	S	C	.	.	H	α-helix	trans	-76.6	-41	177.3	0	0	0	0	0	112.3	I588 I628 T629 C630	I588-A632 HydrophobicContact CD1-CB 3.88Å; I628-A632 PolarHBondContact O-N 3.43Å; T629-A632 PolarHBondContact O-N 3.19Å; C630-A632 VanDerWaalsContact C-N 3.35Å
633	N	95.4	Very high	95.7	Very high	84 Å²	84	43.5 Å²	43.5	45%	0.449	24%	0.243	S	C	.	.			trans	-142.5	96.4	178.6	178.8	11.3	0	0	0	111.3	T629 C630 A635 A636	T629-N633 PolarHBondContact O-N 3.01Å; C630-N633 WeakPolarHBondContact CA-O 3.33Å; C630-N633 CarbonylContact O-C 3.59Å; N633-A635 PolarHBondContact O-N 3.16Å; N633-A635 VanDerWaalsContact O-N 3.12Å; N633-A635 WeakPolarHBondContact OD1-CB 3.4Å; N633-A635 PolarHBondContact OD1-N 3.22Å; N633-A636 HydrophobicContact CB-CB 4.39Å; N633-A636 WeakPolarHBondContact O-CB 3.42Å; N633-A636 PolarHBondContact O-N 3.27Å
634	P	93	Very high	95.7	Very high	51 Å²	51	43.5 Å²	43.5	33%	0.331	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-58.2	-27.4	-179.3	-26.6	34.3	0	0	0	114.7	C630 A636 V637	C630-P634 VanDerWaalsContact O-CA 3.32Å; C630-P634 WeakPolarHBondContact O-CA 3.32Å; C630-P634 WeakPolarHBondContact O-CD 3.46Å; C630-P634 WeakPolarHBondContact O-CG 3.35Å; C630-P634 VanDerWaalsContact O-N 3.13Å; P634-A636 PolarHBondContact O-N 3.49Å; P634-V637 WeakPolarHBondContact O-CG1 3.39Å; P634-V637 PolarHBondContact O-N 3.25Å
635	A	93.5	Very high	95.7	Very high	70 Å²	70	45.1 Å²	45.1	58%	0.579	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-69.9	-16.2	178.4	0	0	0	0	0	112.9	N633 V637	N633-A635 PolarHBondContact O-N 3.16Å; N633-A635 VanDerWaalsContact O-N 3.12Å; N633-A635 WeakPolarHBondContact OD1-CB 3.4Å; N633-A635 PolarHBondContact OD1-N 3.22Å; A635-V637 PolarHBondContact O-N 3.01Å
636	A	95.5	Very high	95.6	Very high	7 Å²	7	51.3 Å²	51.3	6%	0.058	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-67.6	-11.7	176.6	0	0	0	0	0	113.3	T629 N633 P634 V638 N639 F640	T629-A636 HydrophobicContact CG2-CB 3.79Å; N633-A636 HydrophobicContact CB-CB 4.39Å; N633-A636 WeakPolarHBondContact O-CB 3.42Å; N633-A636 PolarHBondContact O-N 3.27Å; P634-A636 PolarHBondContact O-N 3.49Å; A636-V638 PolarHBondContact O-N 2.89Å; A636-N639 WeakPolarHBondContact O-CB 3.34Å; A636-N639 PolarHBondContact O-N 3.4Å; A636-N639 VanDerWaalsContact O-N 3.07Å; A636-F640 WeakPolarHBondContact O-CD2 3.4Å
637	V	95.7	Very high	95.5	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-52.5	-37.7	176.6	68.3	0	0	0	0	112.2	P634 A635 N639 F640 E641 L670 T673	P634-V637 WeakPolarHBondContact O-CG1 3.39Å; P634-V637 PolarHBondContact O-N 3.25Å; A635-V637 PolarHBondContact O-N 3.01Å; V637-N639 VanDerWaalsContact C-N 3.28Å; V637-N639 PolarHBondContact O-N 3.05Å; V637-F640 WeakPolarHBondContact O-CB 3.33Å; V637-F640 PolarHBondContact O-N 3.2Å; V637-F640 VanDerWaalsContact O-N 3.07Å; V637-E641 WeakPolarHBondContact O-CG 3.42Å; V637-E641 PolarHBondContact O-N 2.83Å; V637-L670 HydrophobicContact CG2-CB 4.24Å; V637-L670 HydrophobicContact CG2-CD2 3.75Å; V637-T673 HydrophobicContact CB-CG2 3.98Å; V637-T673 HydrophobicContact CG2-CG2 4.11Å
638	V	95.2	Very high	95.6	Very high	62 Å²	62	48.1 Å²	48.1	38%	0.376	27%	0.272	S	S	.	.	H	α-helix	trans	-60.4	-38	-179.6	-179.9	0	0	0	0	111.5	A636 F640 E641 E642	A636-V638 PolarHBondContact O-N 2.89Å; V638-F640 VanDerWaalsContact C-N 3.3Å; V638-F640 PolarHBondContact O-N 3.36Å; V638-E641 WeakPolarHBondContact O-CB 3.27Å; V638-E641 PolarHBondContact O-N 3.27Å; V638-E642 HydrophobicContact CG1-CG 4.42Å; V638-E642 WeakPolarHBondContact O-CG 3.21Å; V638-E642 PolarHBondContact O-N 3.28Å
639	N	95.7	Very high	95.6	Very high	104 Å²	104	50.9 Å²	50.9	56%	0.556	29%	0.289	S	S	*	.	H	α-helix	trans	-66.2	-34	178.9	-59.6	-20.3	0	0	0	111.8	A636 V637 A643	A636-N639 WeakPolarHBondContact O-CB 3.34Å; A636-N639 PolarHBondContact O-N 3.4Å; A636-N639 VanDerWaalsContact O-N 3.07Å; V637-N639 VanDerWaalsContact C-N 3.28Å; V637-N639 PolarHBondContact O-N 3.05Å; N639-A643 WeakPolarHBondContact O-CB 3.31Å; N639-A643 PolarHBondContact O-N 3.24Å
640	F	97.5	Very high	95.5	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-72.3	-38.6	174.1	-70.5	-87.2	0	0	0	111.4	I591 I595 S625 I626 T629 A636 V637 V638 A643 L644 L670	I591-F640 HydrophobicContact CG2-CE1 4.24Å; I591-F640 HydrophobicContact CG2-CZ 3.82Å; I595-F640 HydrophobicContact CD1-CD1 4.01Å; I595-F640 HydrophobicContact CD1-CE1 3.88Å; I595-F640 HydrophobicContact CG1-CD1 3.84Å; I595-F640 HydrophobicContact CG1-CE1 3.47Å; I595-F640 VanDerWaalsContact CG1-CE1 3.47Å; I595-F640 HydrophobicContact CG1-CZ 4.49Å; S625-F640 WeakPolarHBondContact O-CZ 3.48Å; I626-F640 HydrophobicContact CB-CE1 4.45Å; I626-F640 HydrophobicContact CD1-CD1 4.37Å; I626-F640 HydrophobicContact CG1-CB 4.21Å; I626-F640 HydrophobicContact CG1-CD1 3.41Å; I626-F640 VanDerWaalsContact CG1-CD1 3.41Å; I626-F640 HydrophobicContact CG1-CD2 4.24Å; I626-F640 HydrophobicContact CG1-CE1 3.69Å; I626-F640 HydrophobicContact CG1-CE2 4.5Å; I626-F640 HydrophobicContact CG1-CG 3.71Å; I626-F640 HydrophobicContact CG1-CZ 4.25Å; T629-F640 HydrophobicContact CG2-CE2 3.91Å; T629-F640 HydrophobicContact CG2-CZ 4.27Å; A636-F640 WeakPolarHBondContact O-CD2 3.4Å; V637-F640 WeakPolarHBondContact O-CB 3.33Å; V637-F640 PolarHBondContact O-N 3.2Å; V637-F640 VanDerWaalsContact O-N 3.07Å; V638-F640 VanDerWaalsContact C-N 3.3Å; V638-F640 PolarHBondContact O-N 3.36Å; F640-A643 PolarHBondContact O-N 3.03Å; F640-L644 HydrophobicContact CB-CD1 4.37Å; F640-L644 VanDerWaalsContact O-CB 3.27Å; F640-L644 WeakPolarHBondContact O-CB 3.18Å; F640-L644 VanDerWaalsContact O-CG 3.29Å; F640-L644 WeakPolarHBondContact O-CG 3.47Å; F640-L644 PolarHBondContact O-N 3.43Å; F640-L670 HydrophobicContact CB-CD2 3.78Å
641	E	96.8	Very high	95.4	Very high	15 Å²	15	52.5 Å²	52.5	7%	0.07	29%	0.294	C	S	.	.	H	α-helix	trans	-62	-47.5	175.7	-67.1	175.4	155.9	0	0	111.1	V637 V638 A643 L644 F645 L670 H674 Y682	V637-E641 WeakPolarHBondContact O-CG 3.42Å; V637-E641 PolarHBondContact O-N 2.83Å; V638-E641 WeakPolarHBondContact O-CB 3.27Å; V638-E641 PolarHBondContact O-N 3.27Å; E641-A643 VanDerWaalsContact C-N 3.28Å; E641-A643 PolarHBondContact O-N 3.5Å; E641-L644 PolarHBondContact O-N 3.4Å; E641-F645 HydrophobicContact CB-CD1 4.15Å; E641-F645 HydrophobicContact CB-CE1 3.87Å; E641-F645 HydrophobicContact CB-CE2 4.25Å; E641-F645 HydrophobicContact CB-CG 4.47Å; E641-F645 HydrophobicContact CB-CZ 3.91Å; E641-F645 HydrophobicContact CG-CD1 4.5Å; E641-F645 HydrophobicContact CG-CE1 3.76Å; E641-F645 HydrophobicContact CG-CE2 4.46Å; E641-F645 HydrophobicContact CG-CZ 3.73Å; E641-F645 WeakPolarHBondContact O-CB 3.27Å; E641-F645 WeakPolarHBondContact O-CD1 3.48Å; E641-F645 VanDerWaalsContact O-CG 3.25Å; E641-F645 WeakPolarHBondContact O-CG 3.32Å; E641-F645 PolarHBondContact O-N 2.88Å; E641-L670 HydrophobicContact CG-CB 4.49Å; E641-L670 HydrophobicContact CG-CD1 4.22Å; E641-L670 HydrophobicContact CG-CD2 4.4Å; E641-H674 IonicContact OE1-CD2 2.84Å; E641-H674 IonicContact OE1-CE1 2.82Å; E641-H674 IonicContact OE1-NE2 3.29Å; E641-H674 PolarHBondContact OE1-NE2 3.49Å; E641-H674 IonicContact OE2-CE1 3.26Å; E641-H674 IonicContact OE2-NE2 3.89Å; E641-H674 PolarHBondContact OE2-NE2 3.29Å; E641-Y682 WeakPolarHBondContact OE1-CE2 3.37Å; E641-Y682 PolarHBondContact OE1-OH 3.15Å
642	E	95.7	Very high	95.4	Very high	145 Å²	145	47 Å²	47	68%	0.678	27%	0.272	S	S	*	.	H	α-helix	trans	-57.4	-40.1	175.2	-73.9	179.1	179.9	0	0	112.4	V638	V638-E642 HydrophobicContact CG1-CG 4.42Å; V638-E642 WeakPolarHBondContact O-CG 3.21Å; V638-E642 PolarHBondContact O-N 3.28Å
643	A	96.1	Very high	95.3	Very high	29 Å²	29	51.2 Å²	51.2	24%	0.24	28%	0.281	C	S	.	.	H	α-helix	trans	-73.8	-40	178.9	0	0	0	0	0	113.1	I595 T599 N639 F640 E641	I595-A643 HydrophobicContact CG2-CB 3.75Å; T599-A643 WeakPolarHBondContact CG2-O 3.37Å; N639-A643 WeakPolarHBondContact O-CB 3.31Å; N639-A643 PolarHBondContact O-N 3.24Å; F640-A643 PolarHBondContact O-N 3.03Å; E641-A643 VanDerWaalsContact C-N 3.28Å; E641-A643 PolarHBondContact O-N 3.5Å
644	L	97.6	Very high	95.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-95.2	-29.8	-167.7	-67.1	168.4	0	0	0	113.8	L602 I622 I626 F640 E641 L646 V647 F648 V666 L670	L602-L644 HydrophobicContact CD2-CD2 4.48Å; I622-L644 HydrophobicContact CD1-CD2 4.36Å; I622-L644 HydrophobicContact CG2-CD1 3.84Å; I622-L644 HydrophobicContact CG2-CD2 4.27Å; I626-L644 HydrophobicContact CD1-CD1 4.26Å; F640-L644 HydrophobicContact CB-CD1 4.37Å; F640-L644 VanDerWaalsContact O-CB 3.27Å; F640-L644 WeakPolarHBondContact O-CB 3.18Å; F640-L644 VanDerWaalsContact O-CG 3.29Å; F640-L644 WeakPolarHBondContact O-CG 3.47Å; F640-L644 PolarHBondContact O-N 3.43Å; E641-L644 PolarHBondContact O-N 3.4Å; L644-L646 VanDerWaalsContact C-N 3.32Å; L644-L646 PolarHBondContact O-N 3.07Å; L644-V647 PolarHBondContact O-N 3.22Å; L644-V647 VanDerWaalsContact O-N 3.1Å; L644-F648 HydrophobicContact CB-CD2 4.24Å; L644-F648 HydrophobicContact CB-CE1 4.12Å; L644-F648 HydrophobicContact CB-CE2 3.78Å; L644-F648 HydrophobicContact CB-CZ 3.72Å; L644-F648 HydrophobicContact CD1-CE2 4.44Å; L644-F648 HydrophobicContact CD1-CZ 4.04Å; L644-F648 HydrophobicContact CD2-CE1 4.32Å; L644-F648 HydrophobicContact CD2-CZ 4.28Å; L644-F648 HydrophobicContact CG-CZ 4.24Å; L644-F648 WeakPolarHBondContact O-CG 3.5Å; L644-F648 PolarHBondContact O-N 2.72Å; L644-V666 HydrophobicContact CD1-CG1 4.24Å; L644-L670 HydrophobicContact CD1-CD1 4.34Å
645	F	96	Very high	95	Very high	41 Å²	41	52.9 Å²	52.9	18%	0.18	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-33.5	-168.4	-83.5	20.8	0	0	0	113.8	E641 V647 F648 T649 M667 L670 Y682	E641-F645 HydrophobicContact CB-CD1 4.15Å; E641-F645 HydrophobicContact CB-CE1 3.87Å; E641-F645 HydrophobicContact CB-CE2 4.25Å; E641-F645 HydrophobicContact CB-CG 4.47Å; E641-F645 HydrophobicContact CB-CZ 3.91Å; E641-F645 HydrophobicContact CG-CD1 4.5Å; E641-F645 HydrophobicContact CG-CE1 3.76Å; E641-F645 HydrophobicContact CG-CE2 4.46Å; E641-F645 HydrophobicContact CG-CZ 3.73Å; E641-F645 WeakPolarHBondContact O-CB 3.27Å; E641-F645 WeakPolarHBondContact O-CD1 3.48Å; E641-F645 VanDerWaalsContact O-CG 3.25Å; E641-F645 WeakPolarHBondContact O-CG 3.32Å; E641-F645 PolarHBondContact O-N 2.88Å; F645-V647 VanDerWaalsContact C-N 3.34Å; F645-F648 HydrophobicContact CD1-CD2 4.08Å; F645-F648 HydrophobicContact CE1-CD2 4.49Å; F645-F648 PolarHBondContact O-N 2.97Å; F645-T649 WeakPolarHBondContact O-CB 3.36Å; F645-T649 PolarHBondContact O-N 3.48Å; F645-T649 PolarHBondContact O-OG1 3.24Å; F645-M667 HydrophobicContact CZ-CE 4.44Å; F645-L670 HydrophobicContact CE1-CD1 4.09Å; F645-Y682 HydrophobicContact CE2-CE2 4.16Å; F645-Y682 HydrophobicContact CZ-CD2 4.38Å; F645-Y682 HydrophobicContact CZ-CE1 4.14Å; F645-Y682 AromaticContact CZ-CE2 3.64Å; F645-Y682 HydrophobicContact CZ-CE2 3.64Å; F645-Y682 AromaticContact CZ-CZ 3.51Å; F645-Y682 WeakPolarHBondContact CZ-OH 3.3Å
646	L	94.6	Very high	94.9	Very high	130 Å²	130	50.3 Å²	50.3	68%	0.681	26%	0.264	S	S	*	.	H	α-helix	trans	-61.1	-46.7	174.9	-176.4	66.5	0	0	0	110.6	L644 T649 E650	L644-L646 VanDerWaalsContact C-N 3.32Å; L644-L646 PolarHBondContact O-N 3.07Å; L646-T649 PolarHBondContact O-N 3.08Å; L646-E650 PolarHBondContact O-N 2.91Å; L646-E650 VanDerWaalsContact O-N 3.08Å
647	V	96.5	Very high	94.7	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.03	28%	0.276	C	S	.	.	H	α-helix	trans	-68.5	-39.9	179.7	-176	0	0	0	0	111.3	T599 L602 L603 L644 F645 T649 E650 I651	T599-V647 HydrophobicContact CG2-CG2 3.5Å; T599-V647 VanDerWaalsContact CG2-CG2 3.5Å; L602-V647 HydrophobicContact CB-CG1 4.38Å; L602-V647 HydrophobicContact CD2-CG1 3.88Å; L602-V647 HydrophobicContact CG-CG1 3.76Å; L603-V647 HydrophobicContact CB-CG1 3.94Å; L603-V647 HydrophobicContact CB-CG2 4.02Å; L603-V647 HydrophobicContact CD1-CG1 4.27Å; L644-V647 PolarHBondContact O-N 3.22Å; L644-V647 VanDerWaalsContact O-N 3.1Å; F645-V647 VanDerWaalsContact C-N 3.34Å; V647-T649 VanDerWaalsContact C-N 3.32Å; V647-T649 PolarHBondContact O-N 3.48Å; V647-E650 PolarHBondContact O-N 3.35Å; V647-I651 HydrophobicContact CG1-CD1 3.92Å; V647-I651 HydrophobicContact CG1-CG1 4.49Å; V647-I651 WeakPolarHBondContact O-CB 3.33Å; V647-I651 WeakPolarHBondContact O-CG1 3.48Å; V647-I651 PolarHBondContact O-N 3.1Å
648	F	96.9	Very high	94.4	Very high	3 Å²	3	57.2 Å²	57.2	1%	0.013	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-40.8	174.4	-67	-9.3	0	0	0	112	L602 L644 F645 E650 I651 L652 V663 V666 M667 L670	L602-F648 HydrophobicContact CD2-CD1 4.48Å; L602-F648 HydrophobicContact CD2-CE1 4.01Å; L644-F648 HydrophobicContact CB-CD2 4.24Å; L644-F648 HydrophobicContact CB-CE1 4.12Å; L644-F648 HydrophobicContact CB-CE2 3.78Å; L644-F648 HydrophobicContact CB-CZ 3.72Å; L644-F648 HydrophobicContact CD1-CE2 4.44Å; L644-F648 HydrophobicContact CD1-CZ 4.04Å; L644-F648 HydrophobicContact CD2-CE1 4.32Å; L644-F648 HydrophobicContact CD2-CZ 4.28Å; L644-F648 HydrophobicContact CG-CZ 4.24Å; L644-F648 WeakPolarHBondContact O-CG 3.5Å; L644-F648 PolarHBondContact O-N 2.72Å; F645-F648 HydrophobicContact CD1-CD2 4.08Å; F645-F648 HydrophobicContact CE1-CD2 4.49Å; F645-F648 PolarHBondContact O-N 2.97Å; F648-E650 VanDerWaalsContact C-N 3.34Å; F648-E650 PolarHBondContact O-N 3.38Å; F648-I651 PolarHBondContact O-N 2.81Å; F648-L652 WeakPolarHBondContact O-CB 3.39Å; F648-L652 WeakPolarHBondContact O-CG 3.24Å; F648-L652 PolarHBondContact O-N 3.31Å; F648-V663 HydrophobicContact CB-CG1 3.8Å; F648-V663 HydrophobicContact CD1-CB 4.36Å; F648-V663 HydrophobicContact CD1-CG1 3.94Å; F648-V663 HydrophobicContact CD1-CG2 3.71Å; F648-V663 HydrophobicContact CD2-CG1 3.95Å; F648-V663 HydrophobicContact CE1-CG1 4.48Å; F648-V663 HydrophobicContact CE1-CG2 4.06Å; F648-V663 HydrophobicContact CE2-CG1 4.49Å; F648-V663 HydrophobicContact CG-CG1 3.64Å; F648-V663 HydrophobicContact CG-CG2 4.26Å; F648-V666 HydrophobicContact CE2-CB 4.32Å; F648-V666 HydrophobicContact CE2-CG1 4.11Å; F648-V666 HydrophobicContact CZ-CB 3.88Å; F648-V666 HydrophobicContact CZ-CG1 3.7Å; F648-V666 HydrophobicContact CZ-CG2 4.48Å; F648-M667 HydrophobicContact CD2-CG 3.82Å; F648-M667 HydrophobicContact CD2-SD 4.31Å; F648-M667 HydrophobicContact CE2-CG 3.9Å; F648-L670 HydrophobicContact CE2-CD1 4.38Å
649	T	94.3	Very high	94.4	Very high	65 Å²	65	54.3 Å²	54.3	40%	0.399	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-44.1	176.2	-58.4	0	0	0	0	110.8	F645 L646 V647 L652 Q653	F645-T649 WeakPolarHBondContact O-CB 3.36Å; F645-T649 PolarHBondContact O-N 3.48Å; F645-T649 PolarHBondContact O-OG1 3.24Å; L646-T649 PolarHBondContact O-N 3.08Å; V647-T649 VanDerWaalsContact C-N 3.32Å; V647-T649 PolarHBondContact O-N 3.48Å; T649-L652 PolarHBondContact O-N 3.24Å; T649-Q653 HydrophobicContact CG2-CG 4.27Å; T649-Q653 VanDerWaalsContact O-CB 3.31Å; T649-Q653 WeakPolarHBondContact O-CB 3.3Å; T649-Q653 VanDerWaalsContact O-CG 3.24Å; T649-Q653 WeakPolarHBondContact O-CG 3.19Å; T649-Q653 PolarHBondContact O-N 2.81Å
650	E	95.1	Very high	94.4	Very high	59 Å²	59	49.4 Å²	49.4	28%	0.276	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-43.3	177.1	-171.6	168.3	160.8	0	0	112.3	L603 L646 V647 F648 L652 Q653 N654	L603-E650 HydrophobicContact CD1-CG 4.3Å; L603-E650 WeakPolarHBondContact CD1-OE2 3.33Å; L646-E650 PolarHBondContact O-N 2.91Å; L646-E650 VanDerWaalsContact O-N 3.08Å; V647-E650 PolarHBondContact O-N 3.35Å; F648-E650 VanDerWaalsContact C-N 3.34Å; F648-E650 PolarHBondContact O-N 3.38Å; E650-L652 PolarHBondContact O-N 3.39Å; E650-Q653 PolarHBondContact O-N 3.17Å; E650-N654 VanDerWaalsContact CG-ND2 3.32Å; E650-N654 WeakPolarHBondContact CG-ND2 3.41Å; E650-N654 VanDerWaalsContact O-CB 3.25Å; E650-N654 WeakPolarHBondContact O-CB 3.46Å; E650-N654 PolarHBondContact O-N 3.5Å; E650-N654 PolarHBondContact O-ND2 3.48Å
651	I	95	Very high	94.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.5	-46.5	174.9	-75.5	165.6	0	0	0	111.4	L602 V647 F648 D655 V656 F659 I660 V663	L602-I651 HydrophobicContact CD1-CD1 4.07Å; L602-I651 HydrophobicContact CD2-CD1 4.37Å; L602-I651 HydrophobicContact CG-CD1 4.15Å; V647-I651 HydrophobicContact CG1-CD1 3.92Å; V647-I651 HydrophobicContact CG1-CG1 4.49Å; V647-I651 WeakPolarHBondContact O-CB 3.33Å; V647-I651 WeakPolarHBondContact O-CG1 3.48Å; V647-I651 PolarHBondContact O-N 3.1Å; F648-I651 PolarHBondContact O-N 2.81Å; I651-D655 PolarHBondContact O-N 3.46Å; I651-V656 HydrophobicContact CG2-CB 4.21Å; I651-V656 PolarHBondContact O-N 3.43Å; I651-V656 VanDerWaalsContact O-N 3.08Å; I651-F659 HydrophobicContact CD1-CB 4.42Å; I651-F659 HydrophobicContact CD1-CD2 3.95Å; I651-F659 HydrophobicContact CG1-CD2 4.36Å; I651-F659 HydrophobicContact CG2-CB 3.84Å; I651-I660 HydrophobicContact CG2-CG1 4.45Å; I651-V663 HydrophobicContact CB-CG2 4.39Å; I651-V663 HydrophobicContact CD1-CG2 4.02Å; I651-V663 HydrophobicContact CG2-CG2 3.8Å
652	L	93.1	Very high	94.2	Very high	45 Å²	45	49.6 Å²	49.6	24%	0.236	25%	0.252	C	S	.	.	H	α-helix	trans	-69.9	-40.6	-178.9	-69.6	168.6	0	0	0	111.9	F648 T649 E650 D655 I660 V663 F664 L685	F648-L652 WeakPolarHBondContact O-CB 3.39Å; F648-L652 WeakPolarHBondContact O-CG 3.24Å; F648-L652 PolarHBondContact O-N 3.31Å; T649-L652 PolarHBondContact O-N 3.24Å; E650-L652 PolarHBondContact O-N 3.39Å; L652-D655 PolarHBondContact O-N 2.97Å; L652-I660 HydrophobicContact CD2-CG1 4.17Å; L652-I660 HydrophobicContact CD2-CG2 4.29Å; L652-V663 HydrophobicContact CD1-CG1 4.41Å; L652-F664 HydrophobicContact CD2-CE1 3.64Å; L652-F664 HydrophobicContact CD2-CZ 3.76Å; L652-L685 HydrophobicContact CD1-CD1 4.48Å
653	Q	91.9	Very high	94.3	Very high	151 Å²	151	42.7 Å²	42.7	71%	0.706	22%	0.219	S	C	*	.	H	α-helix	trans	-70.6	-37.5	179.3	-75.4	178.4	-9.1	0	0	112.8	T649 E650 D655	T649-Q653 HydrophobicContact CG2-CG 4.27Å; T649-Q653 VanDerWaalsContact O-CB 3.31Å; T649-Q653 WeakPolarHBondContact O-CB 3.3Å; T649-Q653 VanDerWaalsContact O-CG 3.24Å; T649-Q653 WeakPolarHBondContact O-CG 3.19Å; T649-Q653 PolarHBondContact O-N 2.81Å; E650-Q653 PolarHBondContact O-N 3.17Å; Q653-D655 PolarHBondContact O-N 2.82Å
654	N	92.4	Very high	94.3	Very high	103 Å²	103	41.3 Å²	41.3	55%	0.551	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	0.8	176.1	-68.7	-30.3	0	0	0	113	E650 V656	E650-N654 VanDerWaalsContact CG-ND2 3.32Å; E650-N654 WeakPolarHBondContact CG-ND2 3.41Å; E650-N654 VanDerWaalsContact O-CB 3.25Å; E650-N654 WeakPolarHBondContact O-CB 3.46Å; E650-N654 PolarHBondContact O-N 3.5Å; E650-N654 PolarHBondContact O-ND2 3.48Å; N654-V656 VanDerWaalsContact C-N 3.33Å; N654-V656 HydrophobicContact CB-CG2 4.02Å; N654-V656 PolarHBondContact O-N 3.22Å
655	D	90	Very high	94.3	Very high	68 Å²	68	41.4 Å²	41.4	36%	0.364	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	44.1	178.3	-166.7	40.2	0	0	0	113.5	I651 L652 Q653 Q657 I660 R697	I651-D655 PolarHBondContact O-N 3.46Å; L652-D655 PolarHBondContact O-N 2.97Å; Q653-D655 PolarHBondContact O-N 2.82Å; D655-Q657 VanDerWaalsContact C-N 3.32Å; D655-Q657 VanDerWaalsContact O-CG 3.26Å; D655-Q657 WeakPolarHBondContact O-CG 3.39Å; D655-Q657 PolarHBondContact O-N 3.07Å; D655-Q657 PolarHBondContact OD2-NE2 2.94Å; D655-I660 WeakPolarHBondContact OD1-CD1 3.37Å; D655-R697 VanDerWaalsContact CG-NH2 3.26Å; D655-R697 IonicContact OD1-CZ 3.82Å; D655-R697 VanDerWaalsContact OD1-CZ 3.27Å; D655-R697 IonicContact OD1-NH1 3.88Å; D655-R697 PolarHBondContact OD1-NH1 2.97Å; D655-R697 IonicContact OD1-NH2 3.27Å; D655-R697 PolarHBondContact OD1-NH2 3.05Å; D655-R697 IonicContact OD2-CZ 2.97Å; D655-R697 IonicContact OD2-NH1 3.59Å; D655-R697 IonicContact OD2-NH2 2.78Å; D655-R697 PolarHBondContact OD2-NH2 3.42Å
656	V	92.1	Very high	94.4	Very high	15 Å²	15	39.4 Å²	39.4	9%	0.091	20%	0.2	C	C	.	.			trans	-74.5	84.7	-179.5	-171.7	0	0	0	0	109.7	S606 P609 I651 N654 E658 F659 I660	S606-V656 WeakPolarHBondContact O-CG1 3.48Å; S606-V656 WeakPolarHBondContact O-CG2 3.45Å; P609-V656 HydrophobicContact CB-CG1 4.47Å; P609-V656 HydrophobicContact CG-CG1 3.86Å; I651-V656 HydrophobicContact CG2-CB 4.21Å; I651-V656 PolarHBondContact O-N 3.43Å; I651-V656 VanDerWaalsContact O-N 3.08Å; N654-V656 VanDerWaalsContact C-N 3.33Å; N654-V656 HydrophobicContact CB-CG2 4.02Å; N654-V656 PolarHBondContact O-N 3.22Å; V656-E658 PolarHBondContact O-N 3.29Å; V656-E658 VanDerWaalsContact O-N 3.11Å; V656-F659 HydrophobicContact CG1-CB 4.3Å; V656-F659 HydrophobicContact CG1-CD2 4.36Å; V656-F659 HydrophobicContact CG1-CG 4.25Å; V656-F659 PolarHBondContact O-N 3.44Å; V656-I660 WeakPolarHBondContact O-CG1 3.27Å; V656-I660 PolarHBondContact O-N 3.34Å
657	Q	90.4	Very high	94.5	Very high	68 Å²	68	33.7 Å²	33.7	32%	0.318	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.4	-164.6	-50.5	-166.5	-1.3	0	0	113.9	D655 F659 P661 T901	D655-Q657 VanDerWaalsContact C-N 3.32Å; D655-Q657 VanDerWaalsContact O-CG 3.26Å; D655-Q657 WeakPolarHBondContact O-CG 3.39Å; D655-Q657 PolarHBondContact O-N 3.07Å; D655-Q657 PolarHBondContact OD2-NE2 2.94Å; Q657-F659 PolarHBondContact O-N 2.98Å; Q657-P661 VanDerWaalsContact O-CD 3.32Å; Q657-P661 WeakPolarHBondContact O-CD 3.05Å; Q657-T901 HydrophobicContact CB-CG2 4.26Å
658	E	89.9	Confident	94.5	Very high	87 Å²	87	33.4 Å²	33.4	41%	0.407	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.5	178.9	-61.7	76.4	-171.7	0	0	111.6	P609 V656 Y662 T901	P609-E658 HydrophobicContact CB-CB 4.11Å; P609-E658 HydrophobicContact CB-CG 4.28Å; P609-E658 HydrophobicContact CG-CB 4.13Å; P609-E658 HydrophobicContact CG-CG 3.96Å; P609-E658 WeakPolarHBondContact CG-OE2 3.46Å; V656-E658 PolarHBondContact O-N 3.29Å; V656-E658 VanDerWaalsContact O-N 3.11Å; E658-Y662 WeakPolarHBondContact O-CD2 3.41Å; E658-T901 HydrophobicContact CB-CG2 4.29Å; E658-T901 HydrophobicContact CG-CG2 3.86Å
659	F	95	Very high	94.5	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.009	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-22	-172.6	-73.4	9	0	0	0	113.6	L602 V605 S606 P609 N615 F619 I651 V656 Q657 Y662 V663	L602-F659 HydrophobicContact CD1-CD2 3.92Å; L602-F659 HydrophobicContact CD1-CE2 3.84Å; V605-F659 HydrophobicContact CB-CZ 4.48Å; V605-F659 HydrophobicContact CG2-CE2 3.84Å; V605-F659 HydrophobicContact CG2-CZ 3.81Å; S606-F659 VanDerWaalsContact CA-CE2 3.47Å; P609-F659 HydrophobicContact CB-CD1 4.22Å; P609-F659 HydrophobicContact CB-CE1 3.53Å; P609-F659 HydrophobicContact CB-CZ 3.69Å; N615-F659 HydrophobicContact CB-CE1 3.66Å; N615-F659 HydrophobicContact CB-CZ 4.01Å; N615-F659 VanDerWaalsContact ND2-CE1 3.33Å; N615-F659 WeakPolarHBondContact ND2-CE1 3.49Å; N615-F659 WeakPolarHBondContact OD1-CZ 3.27Å; F619-F659 HydrophobicContact CE2-CB 4.44Å; F619-F659 HydrophobicContact CE2-CD1 4.16Å; F619-F659 HydrophobicContact CE2-CD2 4.27Å; F619-F659 HydrophobicContact CE2-CG 4.04Å; F619-F659 HydrophobicContact CZ-CB 4.34Å; F619-F659 HydrophobicContact CZ-CD2 4.35Å; F619-F659 HydrophobicContact CZ-CG 4.28Å; I651-F659 HydrophobicContact CD1-CB 4.42Å; I651-F659 HydrophobicContact CD1-CD2 3.95Å; I651-F659 HydrophobicContact CG1-CD2 4.36Å; I651-F659 HydrophobicContact CG2-CB 3.84Å; V656-F659 HydrophobicContact CG1-CB 4.3Å; V656-F659 HydrophobicContact CG1-CD2 4.36Å; V656-F659 HydrophobicContact CG1-CG 4.25Å; V656-F659 PolarHBondContact O-N 3.44Å; Q657-F659 PolarHBondContact O-N 2.98Å; F659-Y662 WeakPolarHBondContact O-CA 3.44Å; F659-Y662 WeakPolarHBondContact O-CB 3.35Å; F659-Y662 PolarHBondContact O-N 2.91Å; F659-V663 WeakPolarHBondContact O-CG2 2.7Å; F659-V663 PolarHBondContact O-N 3.29Å
660	I	95.2	Very high	94.6	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-51.4	-48	-179.4	-70.4	174.7	0	0	0	112.3	I651 L652 D655 V656 Y662 V663 F664 N700	I651-I660 HydrophobicContact CG2-CG1 4.45Å; L652-I660 HydrophobicContact CD2-CG1 4.17Å; L652-I660 HydrophobicContact CD2-CG2 4.29Å; D655-I660 WeakPolarHBondContact OD1-CD1 3.37Å; V656-I660 WeakPolarHBondContact O-CG1 3.27Å; V656-I660 PolarHBondContact O-N 3.34Å; I660-Y662 VanDerWaalsContact C-N 3.32Å; I660-Y662 PolarHBondContact O-N 2.87Å; I660-V663 PolarHBondContact O-N 3.24Å; I660-F664 HydrophobicContact CG2-CD2 3.79Å; I660-F664 HydrophobicContact CG2-CE1 4.46Å; I660-F664 HydrophobicContact CG2-CE2 3.11Å; I660-F664 HydrophobicContact CG2-CZ 3.52Å; I660-F664 VanDerWaalsContact O-CD2 3.31Å; I660-F664 WeakPolarHBondContact O-CD2 3.34Å; I660-F664 WeakPolarHBondContact O-CG 3.28Å; I660-F664 PolarHBondContact O-N 3.11Å; I660-F664 VanDerWaalsContact O-N 3.09Å; I660-N700 WeakPolarHBondContact CG2-OD1 3.22Å
661	P	94.5	Very high	94.6	Very high	4 Å²	4	27.7 Å²	27.7	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-60	-38.6	176.1	-23	32.2	0	0	0	113.6	Q657 Q665 N700 A703 F903	Q657-P661 VanDerWaalsContact O-CD 3.32Å; Q657-P661 WeakPolarHBondContact O-CD 3.05Å; P661-Q665 WeakPolarHBondContact O-CG 3.16Å; P661-Q665 PolarHBondContact O-N 3.47Å; P661-Q665 VanDerWaalsContact O-N 3.15Å; P661-Q665 PolarHBondContact O-NE2 2.92Å; P661-N700 WeakPolarHBondContact CD-OD1 3.25Å; P661-N700 WeakPolarHBondContact CG-OD1 3.43Å; P661-A703 VanDerWaalsContact O-CB 3.31Å; P661-A703 WeakPolarHBondContact O-CB 3.47Å; P661-F903 HydrophobicContact CB-CD2 4.28Å
662	Y	96.6	Very high	94.5	Very high	20 Å²	20	29.1 Å²	29.1	8%	0.078	14%	0.144	C	C	.	.	H	α-helix	trans	-67.4	-45	177.9	-71.4	-72.9	0	0	0	111.7	H616 F619 E658 F659 I660 F664 Q665 V666 S904 L906	H616-Y662 HydrophobicContact CB-CE1 4.5Å; H616-Y662 WeakPolarHBondContact CB-OH 3.12Å; H616-Y662 AromaticContact ND1-CE1 3.52Å; H616-Y662 AromaticContact ND1-CZ 3.71Å; H616-Y662 PolarHBondContact ND1-OH 3.49Å; F619-Y662 HydrophobicContact CB-CD1 3.95Å; F619-Y662 HydrophobicContact CB-CG 4.45Å; F619-Y662 HydrophobicContact CD1-CG 4.49Å; F619-Y662 AromaticContact CD2-CD1 3.85Å; F619-Y662 HydrophobicContact CD2-CD1 3.85Å; F619-Y662 AromaticContact CD2-CD2 4Å; F619-Y662 HydrophobicContact CD2-CD2 4Å; F619-Y662 AromaticContact CD2-CG 3.53Å; F619-Y662 HydrophobicContact CD2-CG 3.53Å; F619-Y662 VanDerWaalsContact CE2-CB 3.48Å; F619-Y662 HydrophobicContact CE2-CD2 4.03Å; F619-Y662 AromaticContact CE2-CG 3.79Å; F619-Y662 HydrophobicContact CE2-CG 3.79Å; F619-Y662 AromaticContact CG-CD1 3.94Å; F619-Y662 HydrophobicContact CG-CD1 3.94Å; F619-Y662 AromaticContact CG-CG 3.93Å; F619-Y662 HydrophobicContact CG-CG 3.93Å; F619-Y662 HydrophobicContact CZ-CG 4.36Å; E658-Y662 WeakPolarHBondContact O-CD2 3.41Å; F659-Y662 WeakPolarHBondContact O-CA 3.44Å; F659-Y662 WeakPolarHBondContact O-CB 3.35Å; F659-Y662 PolarHBondContact O-N 2.91Å; I660-Y662 VanDerWaalsContact C-N 3.32Å; I660-Y662 PolarHBondContact O-N 2.87Å; Y662-F664 VanDerWaalsContact C-N 3.3Å; Y662-F664 PolarHBondContact O-N 3.11Å; Y662-Q665 WeakPolarHBondContact O-CB 3.37Å; Y662-Q665 PolarHBondContact O-N 2.96Å; Y662-Q665 VanDerWaalsContact O-N 3.12Å; Y662-V666 WeakPolarHBondContact O-CG2 3.37Å; Y662-V666 PolarHBondContact O-N 3.2Å; Y662-S904 WeakPolarHBondContact OH-CB 3.37Å; Y662-L906 HydrophobicContact CD1-CD1 3.88Å; Y662-L906 HydrophobicContact CD1-CD2 3.64Å; Y662-L906 HydrophobicContact CD1-CG 3.67Å; Y662-L906 HydrophobicContact CE1-CD2 3.59Å; Y662-L906 HydrophobicContact CE1-CG 3.95Å
663	V	97.1	Very high	94.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-55.1	-48.2	176.1	169.5	0	0	0	0	110.4	F619 F648 I651 L652 F659 I660 Q665 V666 M667	F619-V663 HydrophobicContact CZ-CG2 4.45Å; F648-V663 HydrophobicContact CB-CG1 3.8Å; F648-V663 HydrophobicContact CD1-CB 4.36Å; F648-V663 HydrophobicContact CD1-CG1 3.94Å; F648-V663 HydrophobicContact CD1-CG2 3.71Å; F648-V663 HydrophobicContact CD2-CG1 3.95Å; F648-V663 HydrophobicContact CE1-CG1 4.48Å; F648-V663 HydrophobicContact CE1-CG2 4.06Å; F648-V663 HydrophobicContact CE2-CG1 4.49Å; F648-V663 HydrophobicContact CG-CG1 3.64Å; F648-V663 HydrophobicContact CG-CG2 4.26Å; I651-V663 HydrophobicContact CB-CG2 4.39Å; I651-V663 HydrophobicContact CD1-CG2 4.02Å; I651-V663 HydrophobicContact CG2-CG2 3.8Å; L652-V663 HydrophobicContact CD1-CG1 4.41Å; F659-V663 WeakPolarHBondContact O-CG2 2.7Å; F659-V663 PolarHBondContact O-N 3.29Å; I660-V663 PolarHBondContact O-N 3.24Å; V663-Q665 VanDerWaalsContact C-N 3.33Å; V663-Q665 PolarHBondContact O-N 3.45Å; V663-V666 PolarHBondContact O-N 3.31Å; V663-M667 HydrophobicContact CG1-CG 4.26Å; V663-M667 HydrophobicContact CG1-SD 4.07Å; V663-M667 WeakPolarHBondContact O-CB 3.35Å; V663-M667 VanDerWaalsContact O-CG 3.3Å; V663-M667 WeakPolarHBondContact O-CG 3.26Å; V663-M667 PolarHBondContact O-N 2.69Å
664	F	96.9	Very high	94.5	Very high	1 Å²	1	22.8 Å²	22.8	0%	0.004	12%	0.115	C	C	.	.	H	α-helix	trans	-63.6	-36.2	178.8	-63.3	-32.2	0	0	0	113.2	L652 I660 Y662 S668 L689 L694 A703 L704 L707	L652-F664 HydrophobicContact CD2-CE1 3.64Å; L652-F664 HydrophobicContact CD2-CZ 3.76Å; I660-F664 HydrophobicContact CG2-CD2 3.79Å; I660-F664 HydrophobicContact CG2-CE1 4.46Å; I660-F664 HydrophobicContact CG2-CE2 3.11Å; I660-F664 HydrophobicContact CG2-CZ 3.52Å; I660-F664 VanDerWaalsContact O-CD2 3.31Å; I660-F664 WeakPolarHBondContact O-CD2 3.34Å; I660-F664 WeakPolarHBondContact O-CG 3.28Å; I660-F664 PolarHBondContact O-N 3.11Å; I660-F664 VanDerWaalsContact O-N 3.09Å; Y662-F664 VanDerWaalsContact C-N 3.3Å; Y662-F664 PolarHBondContact O-N 3.11Å; F664-S668 WeakPolarHBondContact O-CB 3.29Å; F664-S668 PolarHBondContact O-N 3.48Å; F664-S668 PolarHBondContact O-OG 3.44Å; F664-L689 HydrophobicContact CD1-CD2 4.41Å; F664-L689 HydrophobicContact CE1-CD2 3.78Å; F664-L689 HydrophobicContact CZ-CD2 4.22Å; F664-L694 HydrophobicContact CZ-CD1 4.4Å; F664-L694 HydrophobicContact CZ-CD2 4.45Å; F664-A703 HydrophobicContact CB-CB 3.72Å; F664-A703 HydrophobicContact CD2-CB 4.49Å; F664-L704 HydrophobicContact CD1-CD2 4.21Å; F664-L704 HydrophobicContact CD2-CD1 4.45Å; F664-L704 HydrophobicContact CD2-CD2 3.48Å; F664-L704 VanDerWaalsContact CD2-CD2 3.48Å; F664-L704 HydrophobicContact CD2-CG 3.55Å; F664-L704 HydrophobicContact CE1-CD2 4.09Å; F664-L704 HydrophobicContact CE2-CD1 4.03Å; F664-L704 HydrophobicContact CE2-CD2 3.3Å; F664-L704 HydrophobicContact CE2-CG 3.55Å; F664-L704 HydrophobicContact CG-CD2 3.94Å; F664-L704 HydrophobicContact CG-CG 4.35Å; F664-L704 HydrophobicContact CZ-CD2 3.65Å; F664-L704 HydrophobicContact CZ-CG 4.37Å; F664-L707 HydrophobicContact CB-CD2 4.22Å; F664-L707 HydrophobicContact CD1-CD2 3.79Å; F664-L707 HydrophobicContact CG-CD2 4.26Å
665	Q	97.1	Very high	94.1	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-65.2	-43	173.9	-71.9	-179.5	77.8	0	0	112.4	P661 Y662 V663 S668 L669 A703 F903 S904 L906 A909	P661-Q665 WeakPolarHBondContact O-CG 3.16Å; P661-Q665 PolarHBondContact O-N 3.47Å; P661-Q665 VanDerWaalsContact O-N 3.15Å; P661-Q665 PolarHBondContact O-NE2 2.92Å; Y662-Q665 WeakPolarHBondContact O-CB 3.37Å; Y662-Q665 PolarHBondContact O-N 2.96Å; Y662-Q665 VanDerWaalsContact O-N 3.12Å; V663-Q665 VanDerWaalsContact C-N 3.33Å; V663-Q665 PolarHBondContact O-N 3.45Å; Q665-S668 WeakPolarHBondContact O-CB 3.21Å; Q665-S668 PolarHBondContact O-N 3.48Å; Q665-L669 PolarHBondContact O-N 3.3Å; Q665-L669 VanDerWaalsContact O-N 3.1Å; Q665-A703 HydrophobicContact CG-CB 3.83Å; Q665-F903 HydrophobicContact CG-CE2 4.26Å; Q665-S904 PolarHBondContact NE2-O 3.35Å; Q665-L906 HydrophobicContact CB-CD1 4.03Å; Q665-A909 HydrophobicContact CB-CB 4.13Å
666	V	97.7	Very high	93.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67	-43.1	177.1	-177.5	0	0	0	0	110.8	F619 I622 I626 L644 F648 Y662 V663 S668 L669 L670 L906	F619-V666 HydrophobicContact CD1-CG2 3.77Å; F619-V666 HydrophobicContact CE1-CG2 4.27Å; I622-V666 HydrophobicContact CG2-CG1 4.34Å; I626-V666 HydrophobicContact CD1-CG1 3.74Å; L644-V666 HydrophobicContact CD1-CG1 4.24Å; F648-V666 HydrophobicContact CE2-CB 4.32Å; F648-V666 HydrophobicContact CE2-CG1 4.11Å; F648-V666 HydrophobicContact CZ-CB 3.88Å; F648-V666 HydrophobicContact CZ-CG1 3.7Å; F648-V666 HydrophobicContact CZ-CG2 4.48Å; Y662-V666 WeakPolarHBondContact O-CG2 3.37Å; Y662-V666 PolarHBondContact O-N 3.2Å; V663-V666 PolarHBondContact O-N 3.31Å; V666-S668 VanDerWaalsContact C-N 3.27Å; V666-S668 PolarHBondContact O-N 2.85Å; V666-L669 WeakPolarHBondContact O-CB 3.46Å; V666-L669 PolarHBondContact O-N 3.41Å; V666-L669 VanDerWaalsContact O-N 3.16Å; V666-L670 HydrophobicContact CG1-CD1 4.07Å; V666-L670 HydrophobicContact CG1-CG 4.38Å; V666-L670 WeakPolarHBondContact O-CG 3.43Å; V666-L670 PolarHBondContact O-N 3.29Å; V666-L906 HydrophobicContact CG2-CD1 4.21Å
667	M	97.2	Very high	92.8	Very high	9 Å²	9	33.7 Å²	33.7	4%	0.044	17%	0.165	C	C	.	.	H	α-helix	trans	-61	-37.1	174.9	-71.8	-168.3	73.2	0	0	112.1	F645 F648 V663 L670 L671 Y682 L685 L707	F645-M667 HydrophobicContact CZ-CE 4.44Å; F648-M667 HydrophobicContact CD2-CG 3.82Å; F648-M667 HydrophobicContact CD2-SD 4.31Å; F648-M667 HydrophobicContact CE2-CG 3.9Å; V663-M667 HydrophobicContact CG1-CG 4.26Å; V663-M667 HydrophobicContact CG1-SD 4.07Å; V663-M667 WeakPolarHBondContact O-CB 3.35Å; V663-M667 VanDerWaalsContact O-CG 3.3Å; V663-M667 WeakPolarHBondContact O-CG 3.26Å; V663-M667 PolarHBondContact O-N 2.69Å; M667-L670 PolarHBondContact O-N 2.92Å; M667-L671 WeakPolarHBondContact O-CB 3.3Å; M667-L671 PolarHBondContact O-N 2.92Å; M667-Y682 HydrophobicContact CB-CE1 4.41Å; M667-Y682 HydrophobicContact CE-CD1 3.79Å; M667-Y682 HydrophobicContact CE-CE1 3.63Å; M667-L685 HydrophobicContact CE-CD2 3.42Å; M667-L685 VanDerWaalsContact CE-CD2 3.42Å; M667-L685 HydrophobicContact SD-CD2 3.83Å; M667-L707 HydrophobicContact CB-CD1 3.98Å; M667-L707 HydrophobicContact CB-CD2 4.38Å
668	S	96.3	Very high	92.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-48.4	173.8	-56	0	0	0	0	110.5	F664 Q665 V666 L670 L671 E672 L707	F664-S668 WeakPolarHBondContact O-CB 3.29Å; F664-S668 PolarHBondContact O-N 3.48Å; F664-S668 PolarHBondContact O-OG 3.44Å; Q665-S668 WeakPolarHBondContact O-CB 3.21Å; Q665-S668 PolarHBondContact O-N 3.48Å; V666-S668 VanDerWaalsContact C-N 3.27Å; V666-S668 PolarHBondContact O-N 2.85Å; S668-L670 PolarHBondContact O-N 2.91Å; S668-L671 PolarHBondContact O-N 3.47Å; S668-E672 VanDerWaalsContact O-CB 3.26Å; S668-E672 WeakPolarHBondContact O-CB 3.45Å; S668-E672 WeakPolarHBondContact O-CG 3.19Å; S668-E672 PolarHBondContact O-N 2.97Å; S668-L707 VanDerWaalsContact OG-CA 3.23Å; S668-L707 WeakPolarHBondContact OG-CA 3.46Å; S668-L707 WeakPolarHBondContact OG-CB 3.47Å; S668-L707 PolarHBondContact OG-N 3.46Å
669	L	96.3	Very high	93.1	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.031	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-43.9	177.8	174.8	64.7	0	0	0	112.6	C623 I626 R627 Q665 V666 T673	C623-L669 HydrophobicContact CB-CD2 3.92Å; I626-L669 HydrophobicContact CB-CD2 4.07Å; I626-L669 HydrophobicContact CD1-CD2 4.3Å; I626-L669 HydrophobicContact CG2-CD2 3.91Å; I626-L669 HydrophobicContact CG2-CG 4.05Å; R627-L669 HydrophobicContact CG-CD1 4.17Å; R627-L669 HydrophobicContact CG-CD2 4.33Å; Q665-L669 PolarHBondContact O-N 3.3Å; Q665-L669 VanDerWaalsContact O-N 3.1Å; V666-L669 WeakPolarHBondContact O-CB 3.46Å; V666-L669 PolarHBondContact O-N 3.41Å; V666-L669 VanDerWaalsContact O-N 3.16Å; L669-T673 PolarHBondContact O-N 2.75Å; L669-T673 PolarHBondContact O-OG1 3.27Å
670	L	96.6	Very high	92.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-49.3	177.9	-69.4	168.3	0	0	0	110.8	I626 V637 F640 E641 L644 F645 F648 V666 M667 S668 E672 T673 H674 Y682	I626-L670 HydrophobicContact CD1-CD2 3.74Å; I626-L670 HydrophobicContact CD1-CG 4.11Å; I626-L670 HydrophobicContact CG1-CD2 4.07Å; I626-L670 HydrophobicContact CG2-CD2 3.96Å; V637-L670 HydrophobicContact CG2-CB 4.24Å; V637-L670 HydrophobicContact CG2-CD2 3.75Å; F640-L670 HydrophobicContact CB-CD2 3.78Å; E641-L670 HydrophobicContact CG-CB 4.49Å; E641-L670 HydrophobicContact CG-CD1 4.22Å; E641-L670 HydrophobicContact CG-CD2 4.4Å; L644-L670 HydrophobicContact CD1-CD1 4.34Å; F645-L670 HydrophobicContact CE1-CD1 4.09Å; F648-L670 HydrophobicContact CE2-CD1 4.38Å; V666-L670 HydrophobicContact CG1-CD1 4.07Å; V666-L670 HydrophobicContact CG1-CG 4.38Å; V666-L670 WeakPolarHBondContact O-CG 3.43Å; V666-L670 PolarHBondContact O-N 3.29Å; M667-L670 PolarHBondContact O-N 2.92Å; S668-L670 PolarHBondContact O-N 2.91Å; L670-E672 PolarHBondContact O-N 3.46Å; L670-T673 VanDerWaalsContact O-CB 3.3Å; L670-T673 WeakPolarHBondContact O-CB 3.43Å; L670-T673 PolarHBondContact O-N 3.36Å; L670-T673 VanDerWaalsContact O-N 3.11Å; L670-H674 PolarHBondContact O-CD2 3.18Å; L670-Y682 WeakPolarHBondContact CB-OH 3.32Å
671	L	95.5	Very high	92.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-41.9	179.3	-175.8	55.1	0	0	0	112.4	M667 S668 T673 H674 I678 Y682 A710 F711 R714	M667-L671 WeakPolarHBondContact O-CB 3.3Å; M667-L671 PolarHBondContact O-N 2.92Å; S668-L671 PolarHBondContact O-N 3.47Å; L671-T673 PolarHBondContact O-N 2.81Å; L671-H674 WeakPolarHBondContact O-CB 3.5Å; L671-H674 PolarHBondContact O-N 2.79Å; L671-I678 HydrophobicContact CD1-CD1 4.2Å; L671-I678 HydrophobicContact CD1-CG1 3.95Å; L671-I678 HydrophobicContact CD2-CD1 4.15Å; L671-Y682 HydrophobicContact CB-CD1 4.3Å; L671-Y682 HydrophobicContact CB-CE1 3.78Å; L671-Y682 HydrophobicContact CD1-CD1 4.33Å; L671-Y682 HydrophobicContact CD1-CD2 4.29Å; L671-Y682 HydrophobicContact CD1-CE1 4.43Å; L671-Y682 HydrophobicContact CD1-CE2 4.37Å; L671-Y682 HydrophobicContact CD1-CG 4.25Å; L671-Y682 HydrophobicContact CD2-CD1 4.05Å; L671-Y682 HydrophobicContact CD2-CE1 4.36Å; L671-Y682 HydrophobicContact CG-CD1 4.46Å; L671-Y682 HydrophobicContact CG-CE1 4.41Å; L671-Y682 PolarHBondContact N-OH 3.44Å; L671-A710 HydrophobicContact CB-CB 4.33Å; L671-A710 HydrophobicContact CD2-CB 3.92Å; L671-A710 HydrophobicContact CG-CB 4.15Å; L671-F711 HydrophobicContact CD2-CD2 3.74Å; L671-F711 HydrophobicContact CD2-CE2 4.03Å; L671-F711 HydrophobicContact CD2-CG 4.05Å; L671-R714 HydrophobicContact CD1-CB 4.2Å; L671-R714 HydrophobicContact CD1-CG 4.39Å; L671-R714 HydrophobicContact CG-CB 4.48Å; L671-R714 HydrophobicContact CG-CG 4.37Å
672	E	93.4	Very high	92.7	Very high	30 Å²	30	35.6 Å²	35.6	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-23.8	177.1	-74.6	166	-164.3	0	0	112.8	S668 L670 R706 A710 R714	S668-E672 VanDerWaalsContact O-CB 3.26Å; S668-E672 WeakPolarHBondContact O-CB 3.45Å; S668-E672 WeakPolarHBondContact O-CG 3.19Å; S668-E672 PolarHBondContact O-N 2.97Å; L670-E672 PolarHBondContact O-N 3.46Å; E672-R706 VanDerWaalsContact CD-NH2 3.29Å; E672-R706 IonicContact OE1-CZ 3.78Å; E672-R706 IonicContact OE1-NE 2.57Å; E672-R706 PolarHBondContact OE1-NE 3.5Å; E672-R706 IonicContact OE1-NH2 3.48Å; E672-R706 PolarHBondContact OE1-NH2 3.5Å; E672-R706 VanDerWaalsContact OE1-NH2 3.13Å; E672-R706 IonicContact OE2-CZ 3.56Å; E672-R706 IonicContact OE2-NE 2.72Å; E672-R706 IonicContact OE2-NH2 3.19Å; E672-R706 PolarHBondContact OE2-NH2 3.45Å; E672-A710 HydrophobicContact CG-CB 3.86Å; E672-R714 PolarHBondContact O-NH2 2.84Å
673	T	92.9	Very high	92.6	Very high	32 Å²	32	36.1 Å²	36.1	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-76.2	-27.6	178.5	-59.6	0	0	0	0	112.6	C630 V637 L669 L670 L671	C630-T673 HydrophobicContact CB-CG2 3.64Å; V637-T673 HydrophobicContact CB-CG2 3.98Å; V637-T673 HydrophobicContact CG2-CG2 4.11Å; L669-T673 PolarHBondContact O-N 2.75Å; L669-T673 PolarHBondContact O-OG1 3.27Å; L670-T673 VanDerWaalsContact O-CB 3.3Å; L670-T673 WeakPolarHBondContact O-CB 3.43Å; L670-T673 PolarHBondContact O-N 3.36Å; L670-T673 VanDerWaalsContact O-N 3.11Å; L671-T673 PolarHBondContact O-N 2.81Å
674	H	92.6	Very high	92.5	Very high	31 Å²	31	39.3 Å²	39.3	14%	0.144	22%	0.224	C	C	.	.			trans	-63.3	150.8	169.5	-71.4	-81.3	0	0	0	110.3	E641 L670 L671 R714	E641-H674 IonicContact OE1-CD2 2.84Å; E641-H674 IonicContact OE1-CE1 2.82Å; E641-H674 IonicContact OE1-NE2 3.29Å; E641-H674 PolarHBondContact OE1-NE2 3.49Å; E641-H674 IonicContact OE2-CE1 3.26Å; E641-H674 IonicContact OE2-NE2 3.89Å; E641-H674 PolarHBondContact OE2-NE2 3.29Å; L670-H674 PolarHBondContact O-CD2 3.18Å; L671-H674 WeakPolarHBondContact O-CB 3.5Å; L671-H674 PolarHBondContact O-N 2.79Å; H674-R714 WeakPolarHBondContact O-CD 3.46Å; H674-R714 PolarHBondContact O-NE 2.96Å
675	K	83.5	Confident	92.3	Very high	153 Å²	153	41 Å²	41	67%	0.665	23%	0.233	S	C	*	.			trans	-105.6	-42.3	-174.5	-69.1	-173.1	180	179.8	0	115
676	N	75	Confident	92.2	Very high	138 Å²	138	41 Å²	41	74%	0.738	23%	0.233	S	C	*	.	S	Bend	trans	-122	-38.8	-164.3	-63.5	-16.1	0	0	0	114
677	D	80.2	Confident	92.1	Very high	124 Å²	124	43.2 Å²	43.2	66%	0.663	25%	0.248	S	C	*	.			trans	-129.2	146.6	-174.1	-65.8	-51.1	0	0	0	111
678	I	91.6	Very high	91.9	Very high	15 Å²	15	47.4 Å²	47.4	8%	0.077	27%	0.267	C	S	.	.			trans	-82.8	125.5	170.1	-173.5	158	0	0	0	110.2	L671 M683 F711 T718	L671-I678 HydrophobicContact CD1-CD1 4.2Å; L671-I678 HydrophobicContact CD1-CG1 3.95Å; L671-I678 HydrophobicContact CD2-CD1 4.15Å; I678-M683 HydrophobicContact CD1-CG 4.31Å; I678-M683 HydrophobicContact CD1-SD 3.89Å; I678-M683 HydrophobicContact CG1-CG 4.2Å; I678-M683 HydrophobicContact CG1-SD 4.39Å; I678-M683 HydrophobicContact CG2-CG 3.79Å; I678-M683 HydrophobicContact CG2-SD 3.99Å; I678-F711 HydrophobicContact CD1-CD1 3.31Å; I678-F711 HydrophobicContact CD1-CE1 3.6Å; I678-F711 HydrophobicContact CD1-CG 4.03Å; I678-T718 HydrophobicContact CG2-CG2 4.27Å
679	P	93.3	Very high	91.9	Very high	30 Å²	30	47.5 Å²	47.5	20%	0.195	27%	0.267	C	S	.	.			trans	-64.6	149.7	177.6	-18.7	29.3	0	0	0	112.6	S681 Y682 M683	P679-S681 VanDerWaalsContact C-N 3.26Å; P679-S681 PolarHBondContact O-N 2.89Å; P679-Y682 HydrophobicContact CB-CD2 3.89Å; P679-Y682 HydrophobicContact CB-CE2 4.36Å; P679-Y682 HydrophobicContact CG-CD2 3.8Å; P679-Y682 HydrophobicContact CG-CE2 3.94Å; P679-Y682 PolarHBondContact O-N 3.46Å; P679-Y682 VanDerWaalsContact O-N 3.12Å; P679-M683 PolarHBondContact O-N 3.47Å
680	S	91.5	Very high	91.9	Very high	104 Å²	104	48.1 Å²	48.1	73%	0.727	27%	0.27	S	S	*	.	H	α-helix	trans	-61.6	-31.5	-176.7	55.5	0	0	0	0	113.6	Y682 M683 A684	S680-Y682 VanDerWaalsContact C-N 3.34Å; S680-Y682 PolarHBondContact O-N 3.47Å; S680-M683 PolarHBondContact O-N 3.28Å; S680-A684 PolarHBondContact O-N 2.98Å
681	S	91.9	Very high	91.7	Very high	53 Å²	53	52.6 Å²	52.6	37%	0.371	29%	0.291	S	S	.	.	H	α-helix	trans	-59.5	-40.8	174.7	48.3	0	0	0	0	112.6	P679 A684 L685	P679-S681 VanDerWaalsContact C-N 3.26Å; P679-S681 PolarHBondContact O-N 2.89Å; S681-A684 PolarHBondContact O-N 3.39Å; S681-L685 PolarHBondContact O-N 2.97Å
682	Y	94.9	Very high	91.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.4	-44.3	174.2	-72.2	-91.2	0	0	0	111.3	E641 F645 M667 L670 L671 P679 S680 A684 L685 F686 F711	E641-Y682 WeakPolarHBondContact OE1-CE2 3.37Å; E641-Y682 PolarHBondContact OE1-OH 3.15Å; F645-Y682 HydrophobicContact CE2-CE2 4.16Å; F645-Y682 HydrophobicContact CZ-CD2 4.38Å; F645-Y682 HydrophobicContact CZ-CE1 4.14Å; F645-Y682 AromaticContact CZ-CE2 3.64Å; F645-Y682 HydrophobicContact CZ-CE2 3.64Å; F645-Y682 AromaticContact CZ-CZ 3.51Å; F645-Y682 WeakPolarHBondContact CZ-OH 3.3Å; M667-Y682 HydrophobicContact CB-CE1 4.41Å; M667-Y682 HydrophobicContact CE-CD1 3.79Å; M667-Y682 HydrophobicContact CE-CE1 3.63Å; L670-Y682 WeakPolarHBondContact CB-OH 3.32Å; L671-Y682 HydrophobicContact CB-CD1 4.3Å; L671-Y682 HydrophobicContact CB-CE1 3.78Å; L671-Y682 HydrophobicContact CD1-CD1 4.33Å; L671-Y682 HydrophobicContact CD1-CD2 4.29Å; L671-Y682 HydrophobicContact CD1-CE1 4.43Å; L671-Y682 HydrophobicContact CD1-CE2 4.37Å; L671-Y682 HydrophobicContact CD1-CG 4.25Å; L671-Y682 HydrophobicContact CD2-CD1 4.05Å; L671-Y682 HydrophobicContact CD2-CE1 4.36Å; L671-Y682 HydrophobicContact CG-CD1 4.46Å; L671-Y682 HydrophobicContact CG-CE1 4.41Å; L671-Y682 PolarHBondContact N-OH 3.44Å; P679-Y682 HydrophobicContact CB-CD2 3.89Å; P679-Y682 HydrophobicContact CB-CE2 4.36Å; P679-Y682 HydrophobicContact CG-CD2 3.8Å; P679-Y682 HydrophobicContact CG-CE2 3.94Å; P679-Y682 PolarHBondContact O-N 3.46Å; P679-Y682 VanDerWaalsContact O-N 3.12Å; S680-Y682 VanDerWaalsContact C-N 3.34Å; S680-Y682 PolarHBondContact O-N 3.47Å; Y682-A684 PolarHBondContact O-N 3.03Å; Y682-L685 WeakPolarHBondContact O-CA 3.21Å; Y682-L685 WeakPolarHBondContact O-CB 3.11Å; Y682-L685 PolarHBondContact O-N 2.9Å; Y682-F686 PolarHBondContact O-N 3.42Å; Y682-F711 HydrophobicContact CD1-CE2 4.21Å; Y682-F711 HydrophobicContact CD1-CZ 4.02Å; Y682-F711 HydrophobicContact CG-CZ 4.34Å; Y682-F711 WeakPolarHBondContact O-CE1 3.46Å; Y682-F711 VanDerWaalsContact O-CZ 3.24Å; Y682-F711 WeakPolarHBondContact O-CZ 3.29Å
683	M	94.4	Very high	91.4	Very high	32 Å²	32	58.6 Å²	58.6	16%	0.158	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-30.6	178.4	-74.7	-56.6	-55.5	0	0	113	I678 P679 S680 L685 F686 P687 F711 T718 I719 A723	I678-M683 HydrophobicContact CD1-CG 4.31Å; I678-M683 HydrophobicContact CD1-SD 3.89Å; I678-M683 HydrophobicContact CG1-CG 4.2Å; I678-M683 HydrophobicContact CG1-SD 4.39Å; I678-M683 HydrophobicContact CG2-CG 3.79Å; I678-M683 HydrophobicContact CG2-SD 3.99Å; P679-M683 PolarHBondContact O-N 3.47Å; S680-M683 PolarHBondContact O-N 3.28Å; M683-L685 VanDerWaalsContact C-N 3.29Å; M683-L685 PolarHBondContact O-N 3.34Å; M683-F686 HydrophobicContact CE-CB 4.47Å; M683-F686 HydrophobicContact CE-CD1 4.36Å; M683-F686 PolarHBondContact O-N 2.94Å; M683-P687 WeakPolarHBondContact O-CD 3.1Å; M683-F711 HydrophobicContact SD-CD1 4.42Å; M683-F711 HydrophobicContact SD-CE1 4.46Å; M683-T718 HydrophobicContact CE-CG2 4.12Å; M683-T718 HydrophobicContact CG-CG2 4.02Å; M683-T718 HydrophobicContact SD-CG2 4.16Å; M683-I719 HydrophobicContact CE-CG1 4.13Å; M683-I719 HydrophobicContact SD-CG1 4.26Å; M683-A723 HydrophobicContact CE-CB 3.93Å
684	A	93.1	Very high	91.3	Very high	66 Å²	66	58.2 Å²	58.2	55%	0.545	33%	0.328	S	S	.	.	H	α-helix	trans	-65.5	-32.1	171.2	0	0	0	0	0	112.6	S680 S681 Y682 H688	S680-A684 PolarHBondContact O-N 2.98Å; S681-A684 PolarHBondContact O-N 3.39Å; Y682-A684 PolarHBondContact O-N 3.03Å; A684-H688 PolarHBondContact O-CE1 2.93Å; A684-H688 PolarHBondContact O-ND1 2.95Å
685	L	93.2	Very high	91.3	Very high	36 Å²	36	57 Å²	57	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-77.5	-29.5	176.4	-173.3	64.4	0	0	0	112.5	L652 M667 S681 Y682 M683 H688 L689	L652-L685 HydrophobicContact CD1-CD1 4.48Å; M667-L685 HydrophobicContact CE-CD2 3.42Å; M667-L685 VanDerWaalsContact CE-CD2 3.42Å; M667-L685 HydrophobicContact SD-CD2 3.83Å; S681-L685 PolarHBondContact O-N 2.97Å; Y682-L685 WeakPolarHBondContact O-CA 3.21Å; Y682-L685 WeakPolarHBondContact O-CB 3.11Å; Y682-L685 PolarHBondContact O-N 2.9Å; M683-L685 VanDerWaalsContact C-N 3.29Å; M683-L685 PolarHBondContact O-N 3.34Å; L685-H688 HydrophobicContact CD1-CB 4.31Å; L685-H688 WeakPolarHBondContact O-CB 3.35Å; L685-H688 PolarHBondContact O-N 2.98Å; L685-L689 HydrophobicContact CD1-CD2 4.44Å; L685-L689 HydrophobicContact CD2-CD1 4.34Å; L685-L689 HydrophobicContact CD2-CD2 4.08Å; L685-L689 HydrophobicContact CD2-CG 4.39Å; L685-L689 HydrophobicContact CG-CD1 4.26Å; L685-L689 HydrophobicContact CG-CD2 3.98Å; L685-L689 HydrophobicContact CG-CG 3.98Å; L685-L689 PolarHBondContact O-N 3.37Å
686	F	95.6	Very high	91.6	Very high	1 Å²	1	56 Å²	56	0%	0.004	32%	0.32	C	S	.	.	H	α-helix	trans	-47.6	-48.9	-172.1	-176.1	-114.3	0	0	0	115	Y682 M683 H688 L689 L690 L708 F711 I719 A723 K726	Y682-F686 PolarHBondContact O-N 3.42Å; M683-F686 HydrophobicContact CE-CB 4.47Å; M683-F686 HydrophobicContact CE-CD1 4.36Å; M683-F686 PolarHBondContact O-N 2.94Å; F686-H688 PolarHBondContact O-N 3.35Å; F686-L689 PolarHBondContact O-N 2.94Å; F686-L690 HydrophobicContact CE1-CD1 4.12Å; F686-L690 HydrophobicContact CZ-CD1 4.22Å; F686-L708 HydrophobicContact CD2-CD2 4.27Å; F686-L708 HydrophobicContact CE2-CD2 3.9Å; F686-F711 HydrophobicContact CB-CD1 4.17Å; F686-F711 HydrophobicContact CB-CE1 3.74Å; F686-F711 HydrophobicContact CB-CZ 4.45Å; F686-F711 HydrophobicContact CD2-CB 4.38Å; F686-F711 AromaticContact CD2-CD1 3.53Å; F686-F711 HydrophobicContact CD2-CD1 3.53Å; F686-F711 AromaticContact CD2-CE1 3.91Å; F686-F711 HydrophobicContact CD2-CE1 3.91Å; F686-F711 AromaticContact CD2-CG 3.99Å; F686-F711 HydrophobicContact CD2-CG 3.99Å; F686-F711 HydrophobicContact CE2-CB 4.36Å; F686-F711 HydrophobicContact CE2-CD1 4.27Å; F686-F711 HydrophobicContact CE2-CG 4.44Å; F686-F711 HydrophobicContact CG-CD1 4.17Å; F686-F711 HydrophobicContact CG-CE1 4.24Å; F686-I719 HydrophobicContact CE1-CD1 4.44Å; F686-I719 HydrophobicContact CE1-CG1 4.15Å; F686-I719 HydrophobicContact CE1-CG2 4.06Å; F686-I719 HydrophobicContact CE2-CD1 4.02Å; F686-I719 HydrophobicContact CZ-CD1 3.9Å; F686-I719 HydrophobicContact CZ-CG1 4.12Å; F686-I719 HydrophobicContact CZ-CG2 4.12Å; F686-A723 HydrophobicContact CD1-CB 4.39Å; F686-A723 HydrophobicContact CE1-CB 4.49Å; F686-K726 HydrophobicContact CD1-CB 4.31Å; F686-K726 HydrophobicContact CE1-CB 3.87Å
687	P	94.7	Very high	92.1	Very high	48 Å²	48	51.5 Å²	51.5	31%	0.312	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-30.4	179.5	-22.3	34.9	0	0	0	113.9	M683 L690 K726	M683-P687 WeakPolarHBondContact O-CD 3.1Å; P687-L690 PolarHBondContact O-N 2.76Å; P687-K726 HydrophobicContact CB-CD 4.39Å
688	H	93.4	Very high	92.3	Very high	97 Å²	97	48.9 Å²	48.9	45%	0.449	28%	0.281	S	S	.	.	H	α-helix	trans	-72.2	-35.6	-179.7	-56.7	90.7	0	0	0	111.2	A684 L685 F686 L690 Q691 L694	A684-H688 PolarHBondContact O-CE1 2.93Å; A684-H688 PolarHBondContact O-ND1 2.95Å; L685-H688 HydrophobicContact CD1-CB 4.31Å; L685-H688 WeakPolarHBondContact O-CB 3.35Å; L685-H688 PolarHBondContact O-N 2.98Å; F686-H688 PolarHBondContact O-N 3.35Å; H688-L690 PolarHBondContact O-N 2.57Å; H688-Q691 WeakPolarHBondContact O-CB 3.37Å; H688-Q691 WeakPolarHBondContact O-CG 3.44Å; H688-Q691 PolarHBondContact O-N 2.89Å; H688-Q691 VanDerWaalsContact O-N 3.14Å; H688-L694 WeakPolarHBondContact O-CD1 3.39Å
689	L	95.7	Very high	92.1	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-64.2	-20.6	177.3	-58.1	178.8	0	0	0	113.1	F664 L685 F686 W695 L704 L707 L708 F711	F664-L689 HydrophobicContact CD1-CD2 4.41Å; F664-L689 HydrophobicContact CE1-CD2 3.78Å; F664-L689 HydrophobicContact CZ-CD2 4.22Å; L685-L689 HydrophobicContact CD1-CD2 4.44Å; L685-L689 HydrophobicContact CD2-CD1 4.34Å; L685-L689 HydrophobicContact CD2-CD2 4.08Å; L685-L689 HydrophobicContact CD2-CG 4.39Å; L685-L689 HydrophobicContact CG-CD1 4.26Å; L685-L689 HydrophobicContact CG-CD2 3.98Å; L685-L689 HydrophobicContact CG-CG 3.98Å; L685-L689 PolarHBondContact O-N 3.37Å; F686-L689 PolarHBondContact O-N 2.94Å; L689-W695 PolarHBondContact O-NE1 3.5Å; L689-L704 HydrophobicContact CD2-CD2 3.97Å; L689-L707 HydrophobicContact CD1-CD2 3.73Å; L689-L707 HydrophobicContact CD1-CG 4.13Å; L689-L707 HydrophobicContact CD2-CD2 4.17Å; L689-L708 HydrophobicContact CB-CD2 4.29Å; L689-L708 HydrophobicContact CD1-CD2 4.48Å; L689-F711 HydrophobicContact CD1-CD2 4.19Å; L689-F711 HydrophobicContact CD1-CE2 3.53Å; L689-F711 HydrophobicContact CD1-CZ 3.9Å
690	L	96.2	Very high	92.1	Very high	18 Å²	18	46.8 Å²	46.8	9%	0.094	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-5	179.6	-54.2	-179.1	0	0	0	113.2	F686 P687 H688 L708 K726 L730 V733	F686-L690 HydrophobicContact CE1-CD1 4.12Å; F686-L690 HydrophobicContact CZ-CD1 4.22Å; P687-L690 PolarHBondContact O-N 2.76Å; H688-L690 PolarHBondContact O-N 2.57Å; L690-L708 HydrophobicContact CD2-CD1 4.27Å; L690-L708 HydrophobicContact CD2-CD2 4.06Å; L690-K726 HydrophobicContact CD1-CB 3.97Å; L690-K726 WeakPolarHBondContact CD1-O 3.27Å; L690-L730 HydrophobicContact CD2-CB 4.25Å; L690-L730 HydrophobicContact CD2-CD1 3.89Å; L690-V733 HydrophobicContact CD2-CG2 4.27Å
691	Q	94.1	Very high	92.2	Very high	94 Å²	94	42.1 Å²	42.1	44%	0.439	24%	0.236	S	C	.	.			trans	-69.1	131.4	-176.5	-69.1	-177.6	-9.3	0	0	111.5	H688 V693 L694	H688-Q691 WeakPolarHBondContact O-CB 3.37Å; H688-Q691 WeakPolarHBondContact O-CG 3.44Å; H688-Q691 PolarHBondContact O-N 2.89Å; H688-Q691 VanDerWaalsContact O-N 3.14Å; Q691-V693 HydrophobicContact CB-CG1 4.24Å; Q691-V693 PolarHBondContact O-N 2.85Å; Q691-L694 PolarHBondContact O-N 3.27Å; Q691-L694 VanDerWaalsContact O-N 3.16Å
692	P	91.3	Very high	92.2	Very high	87 Å²	87	41.1 Å²	41.1	57%	0.565	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-54.3	-31.6	-173.6	-29.9	35.4	0	0	0	115.7	L694 W695 E696 K736	P692-L694 VanDerWaalsContact C-N 3.3Å; P692-L694 PolarHBondContact O-N 3.3Å; P692-W695 CarbonylContact O-C 3.5Å; P692-W695 PolarHBondContact O-N 3.34Å; P692-E696 PolarHBondContact O-N 3.32Å; P692-K736 PolarHBondContact O-NZ 2.92Å; P692-K736 VanDerWaalsContact O-NZ 3.13Å
693	V	89.8	Confident	92.2	Very high	69 Å²	69	41.1 Å²	41.1	42%	0.418	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-58.5	-37.9	-178.3	68.9	0	0	0	0	112.6	Q691 W695 E696	Q691-V693 HydrophobicContact CB-CG1 4.24Å; Q691-V693 PolarHBondContact O-N 2.85Å; V693-W695 PolarHBondContact O-N 2.77Å; V693-E696 PolarHBondContact O-N 3.13Å
694	L	91.4	Very high	92.3	Very high	24 Å²	24	39.7 Å²	39.7	13%	0.126	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-67.5	-29.4	178.9	-70.4	178.7	0	0	0	112	F664 H688 Q691 P692 N700 L704	F664-L694 HydrophobicContact CZ-CD1 4.4Å; F664-L694 HydrophobicContact CZ-CD2 4.45Å; H688-L694 WeakPolarHBondContact O-CD1 3.39Å; Q691-L694 PolarHBondContact O-N 3.27Å; Q691-L694 VanDerWaalsContact O-N 3.16Å; P692-L694 VanDerWaalsContact C-N 3.3Å; P692-L694 PolarHBondContact O-N 3.3Å; L694-N700 WeakPolarHBondContact O-CB 3.45Å; L694-N700 PolarHBondContact O-ND2 2.75Å; L694-N700 VanDerWaalsContact O-ND2 3.1Å; L694-L704 HydrophobicContact CB-CD1 3.87Å
695	W	93	Very high	92.5	Very high	7 Å²	7	36.6 Å²	36.6	3%	0.027	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-91.5	-3	-177.6	-60.2	92.3	0	0	0	113.5	L689 P692 V693 R697 I701 L704 V705 L708 V733 K736 L737	L689-W695 PolarHBondContact O-NE1 3.5Å; P692-W695 CarbonylContact O-C 3.5Å; P692-W695 PolarHBondContact O-N 3.34Å; V693-W695 PolarHBondContact O-N 2.77Å; W695-R697 VanDerWaalsContact C-N 3.3Å; W695-I701 HydrophobicContact CE3-CG1 4.23Å; W695-I701 HydrophobicContact CZ3-CG2 4.33Å; W695-L704 HydrophobicContact CD2-CD1 4.19Å; W695-L704 HydrophobicContact CE3-CD1 4.44Å; W695-L704 HydrophobicContact CH2-CB 3.43Å; W695-L704 VanDerWaalsContact CH2-CB 3.43Å; W695-L704 HydrophobicContact CH2-CD1 4.35Å; W695-L704 HydrophobicContact CH2-CG 4.48Å; W695-L704 HydrophobicContact CZ2-CB 3.7Å; W695-L704 HydrophobicContact CZ2-CD1 4.05Å; W695-L704 HydrophobicContact CZ2-CG 4.36Å; W695-L704 HydrophobicContact CZ3-CB 3.93Å; W695-V705 HydrophobicContact CH2-CG2 3.85Å; W695-V705 HydrophobicContact CZ3-CG2 3.68Å; W695-L708 HydrophobicContact CH2-CD1 3.8Å; W695-L708 HydrophobicContact CZ2-CD1 3.5Å; W695-L708 VanDerWaalsContact CZ2-CD1 3.5Å; W695-L708 HydrophobicContact CZ2-CG 4.41Å; W695-V733 HydrophobicContact CD2-CG1 3.69Å; W695-V733 HydrophobicContact CD2-CG2 4.25Å; W695-V733 VanDerWaalsContact CE2-CG1 3.44Å; W695-V733 HydrophobicContact CE3-CG1 3.8Å; W695-V733 HydrophobicContact CG-CG2 4.42Å; W695-V733 HydrophobicContact CH2-CG1 3.46Å; W695-V733 VanDerWaalsContact CH2-CG1 3.46Å; W695-V733 HydrophobicContact CZ2-CB 4.35Å; W695-V733 HydrophobicContact CZ2-CG1 3.36Å; W695-V733 HydrophobicContact CZ2-CG2 4.06Å; W695-V733 HydrophobicContact CZ3-CG1 3.68Å; W695-K736 HydrophobicContact CB-CD 3.89Å; W695-K736 WeakPolarHBondContact O-CE 3.5Å; W695-K736 PolarHBondContact O-NZ 3.05Å; W695-L737 HydrophobicContact CE3-CD1 4.28Å; W695-L737 HydrophobicContact CE3-CD2 3.92Å; W695-L737 HydrophobicContact CE3-CG 4.32Å; W695-L737 HydrophobicContact CZ3-CD1 3.81Å; W695-L737 HydrophobicContact CZ3-CD2 4.09Å; W695-L737 HydrophobicContact CZ3-CG 4.33Å
696	E	88.6	Confident	92.6	Very high	130 Å²	130	35.6 Å²	35.6	61%	0.607	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-22.7	169.4	-69.2	172.8	-176	0	0	111.6	P692 V693	P692-E696 PolarHBondContact O-N 3.32Å; V693-E696 PolarHBondContact O-N 3.13Å
697	R	86.3	Confident	92.6	Very high	45 Å²	45	35.6 Å²	35.6	17%	0.17	19%	0.189	C	C	.	.			trans	-92.2	112.3	179.4	-59.3	-177.4	-171.9	160.9	3.2	110.3	D655 W695 G699 N700	D655-R697 VanDerWaalsContact CG-NH2 3.26Å; D655-R697 IonicContact OD1-CZ 3.82Å; D655-R697 VanDerWaalsContact OD1-CZ 3.27Å; D655-R697 IonicContact OD1-NH1 3.88Å; D655-R697 PolarHBondContact OD1-NH1 2.97Å; D655-R697 IonicContact OD1-NH2 3.27Å; D655-R697 PolarHBondContact OD1-NH2 3.05Å; D655-R697 IonicContact OD2-CZ 2.97Å; D655-R697 IonicContact OD2-NH1 3.59Å; D655-R697 IonicContact OD2-NH2 2.78Å; D655-R697 PolarHBondContact OD2-NH2 3.42Å; W695-R697 VanDerWaalsContact C-N 3.3Å; R697-G699 VanDerWaalsContact C-N 3.28Å; R697-G699 PolarHBondContact O-N 3.42Å; R697-N700 HydrophobicContact CB-CB 4.46Å; R697-N700 PolarHBondContact O-N 2.99Å; R697-N700 VanDerWaalsContact O-N 3.11Å
698	T	85	Confident	92.8	Very high	68 Å²	68	33.3 Å²	33.3	42%	0.417	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-56.9	-39.7	-178.7	49.7	0	0	0	0	112.6	N700 I701 Q900	T698-N700 PolarHBondContact O-N 3.25Å; T698-I701 PolarHBondContact O-N 3.33Å; T698-I701 VanDerWaalsContact O-N 3.17Å; T698-Q900 PolarHBondContact OG1-OE1 3.12Å
699	G	86.8	Confident	92.9	Very high	2 Å²	2	29.9 Å²	29.9	2%	0.021	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-59.9	-26.2	177.6	0	0	0	0	0	115	R697 T901 F903	R697-G699 VanDerWaalsContact C-N 3.28Å; R697-G699 PolarHBondContact O-N 3.42Å; G699-T901 WeakPolarHBondContact CA-O 3.29Å; G699-F903 VanDerWaalsContact O-CD2 3.32Å; G699-F903 WeakPolarHBondContact O-CD2 3.07Å
700	N	92.9	Very high	92.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-80.6	-26.1	179.5	-70.1	-15.1	0	0	0	113	I660 P661 L694 R697 T698 A703 L704	I660-N700 WeakPolarHBondContact CG2-OD1 3.22Å; P661-N700 WeakPolarHBondContact CD-OD1 3.25Å; P661-N700 WeakPolarHBondContact CG-OD1 3.43Å; L694-N700 WeakPolarHBondContact O-CB 3.45Å; L694-N700 PolarHBondContact O-ND2 2.75Å; L694-N700 VanDerWaalsContact O-ND2 3.1Å; R697-N700 HydrophobicContact CB-CB 4.46Å; R697-N700 PolarHBondContact O-N 2.99Å; R697-N700 VanDerWaalsContact O-N 3.11Å; T698-N700 PolarHBondContact O-N 3.25Å; N700-A703 PolarHBondContact O-N 3.43Å; N700-L704 HydrophobicContact CB-CD1 3.74Å; N700-L704 HydrophobicContact CB-CG 4.29Å; N700-L704 WeakPolarHBondContact O-CB 3.25Å; N700-L704 WeakPolarHBondContact O-CG 3.42Å; N700-L704 PolarHBondContact O-N 2.85Å
701	I	94.1	Very high	92.9	Very high	6 Å²	6	29 Å²	29	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-57.6	-52.4	-163.6	-66.9	174.9	0	0	0	112.2	W695 T698 A703 L704 V705 L737 N743 Q746	W695-I701 HydrophobicContact CE3-CG1 4.23Å; W695-I701 HydrophobicContact CZ3-CG2 4.33Å; T698-I701 PolarHBondContact O-N 3.33Å; T698-I701 VanDerWaalsContact O-N 3.17Å; I701-A703 VanDerWaalsContact C-N 3.33Å; I701-A703 PolarHBondContact O-N 3.44Å; I701-L704 PolarHBondContact O-N 3.03Å; I701-V705 HydrophobicContact CG2-CG2 4.33Å; I701-V705 WeakPolarHBondContact O-CG2 3.41Å; I701-V705 PolarHBondContact O-N 3.3Å; I701-L737 HydrophobicContact CD1-CD2 4.08Å; I701-L737 HydrophobicContact CG1-CD2 4.3Å; I701-L737 HydrophobicContact CG2-CD2 3.55Å; I701-N743 HydrophobicContact CD1-CB 4.29Å; I701-N743 WeakPolarHBondContact CD1-ND2 3.34Å; I701-N743 HydrophobicContact CG2-CB 4.45Å; I701-Q746 HydrophobicContact CG2-CB 3.94Å; I701-Q746 HydrophobicContact CG2-CG 3.88Å
702	P	93	Very high	92.9	Very high	31 Å²	31	24.5 Å²	24.5	20%	0.201	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-39.8	-176.4	-22.2	35.3	0	0	0	112.3	R706 F903	P702-R706 WeakPolarHBondContact O-CB 3.27Å; P702-R706 PolarHBondContact O-N 3.02Å; P702-R706 VanDerWaalsContact O-N 3.11Å; P702-F903 HydrophobicContact CB-CD1 3.97Å; P702-F903 HydrophobicContact CB-CD2 4.19Å; P702-F903 HydrophobicContact CB-CE1 3.71Å; P702-F903 HydrophobicContact CB-CE2 3.97Å; P702-F903 HydrophobicContact CB-CG 4.19Å; P702-F903 HydrophobicContact CB-CZ 3.71Å; P702-F903 HydrophobicContact CG-CB 4.37Å; P702-F903 HydrophobicContact CG-CD1 3.79Å; P702-F903 HydrophobicContact CG-CD2 4.18Å; P702-F903 HydrophobicContact CG-CE1 4.07Å; P702-F903 HydrophobicContact CG-CE2 4.46Å; P702-F903 HydrophobicContact CG-CG 3.84Å; P702-F903 HydrophobicContact CG-CZ 4.39Å
703	A	94.9	Very high	93	Very high	1 Å²	1	23 Å²	23	1%	0.008	12%	0.118	C	C	.	.	H	α-helix	trans	-66.2	-43.4	178	0	0	0	0	0	112.3	P661 F664 Q665 N700 I701 L707 F903	P661-A703 VanDerWaalsContact O-CB 3.31Å; P661-A703 WeakPolarHBondContact O-CB 3.47Å; F664-A703 HydrophobicContact CB-CB 3.72Å; F664-A703 HydrophobicContact CD2-CB 4.49Å; Q665-A703 HydrophobicContact CG-CB 3.83Å; N700-A703 PolarHBondContact O-N 3.43Å; I701-A703 VanDerWaalsContact C-N 3.33Å; I701-A703 PolarHBondContact O-N 3.44Å; A703-L707 WeakPolarHBondContact O-CB 3.29Å; A703-L707 PolarHBondContact O-N 3.32Å; A703-F903 HydrophobicContact CB-CE2 3.96Å
704	L	96.3	Very high	93.2	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-68.3	-42.5	178.6	-81.2	173.3	0	0	0	112.3	F664 L689 L694 W695 N700 I701 R706 L707 L708	F664-L704 HydrophobicContact CD1-CD2 4.21Å; F664-L704 HydrophobicContact CD2-CD1 4.45Å; F664-L704 HydrophobicContact CD2-CD2 3.48Å; F664-L704 VanDerWaalsContact CD2-CD2 3.48Å; F664-L704 HydrophobicContact CD2-CG 3.55Å; F664-L704 HydrophobicContact CE1-CD2 4.09Å; F664-L704 HydrophobicContact CE2-CD1 4.03Å; F664-L704 HydrophobicContact CE2-CD2 3.3Å; F664-L704 HydrophobicContact CE2-CG 3.55Å; F664-L704 HydrophobicContact CG-CD2 3.94Å; F664-L704 HydrophobicContact CG-CG 4.35Å; F664-L704 HydrophobicContact CZ-CD2 3.65Å; F664-L704 HydrophobicContact CZ-CG 4.37Å; L689-L704 HydrophobicContact CD2-CD2 3.97Å; L694-L704 HydrophobicContact CB-CD1 3.87Å; W695-L704 HydrophobicContact CD2-CD1 4.19Å; W695-L704 HydrophobicContact CE3-CD1 4.44Å; W695-L704 HydrophobicContact CH2-CB 3.43Å; W695-L704 VanDerWaalsContact CH2-CB 3.43Å; W695-L704 HydrophobicContact CH2-CD1 4.35Å; W695-L704 HydrophobicContact CH2-CG 4.48Å; W695-L704 HydrophobicContact CZ2-CB 3.7Å; W695-L704 HydrophobicContact CZ2-CD1 4.05Å; W695-L704 HydrophobicContact CZ2-CG 4.36Å; W695-L704 HydrophobicContact CZ3-CB 3.93Å; N700-L704 HydrophobicContact CB-CD1 3.74Å; N700-L704 HydrophobicContact CB-CG 4.29Å; N700-L704 WeakPolarHBondContact O-CB 3.25Å; N700-L704 WeakPolarHBondContact O-CG 3.42Å; N700-L704 PolarHBondContact O-N 2.85Å; I701-L704 PolarHBondContact O-N 3.03Å; L704-R706 VanDerWaalsContact C-N 3.33Å; L704-L707 PolarHBondContact O-N 3.46Å; L704-L708 WeakPolarHBondContact O-CG 3.34Å; L704-L708 PolarHBondContact O-N 2.93Å
705	V	96.6	Very high	93.3	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.006	10%	0.103	C	C	.	.	H	α-helix	trans	-58.6	-51	175.7	167.4	0	0	0	0	109.2	W695 I701 L707 L708 Q709 L737 Q746	W695-V705 HydrophobicContact CH2-CG2 3.85Å; W695-V705 HydrophobicContact CZ3-CG2 3.68Å; I701-V705 HydrophobicContact CG2-CG2 4.33Å; I701-V705 WeakPolarHBondContact O-CG2 3.41Å; I701-V705 PolarHBondContact O-N 3.3Å; V705-L707 VanDerWaalsContact C-N 3.3Å; V705-L707 PolarHBondContact O-N 3.14Å; V705-L708 PolarHBondContact O-N 3.38Å; V705-L708 VanDerWaalsContact O-N 3.14Å; V705-Q709 HydrophobicContact CG1-CG 4.32Å; V705-Q709 VanDerWaalsContact O-CG 3.31Å; V705-Q709 WeakPolarHBondContact O-CG 3.29Å; V705-Q709 PolarHBondContact O-N 3.04Å; V705-L737 HydrophobicContact CG2-CD1 3.67Å; V705-Q746 HydrophobicContact CG2-CB 3.9Å
706	R	94.9	Very high	93.3	Very high	16 Å²	16	21.7 Å²	21.7	6%	0.06	11%	0.107	C	C	.	.	H	α-helix	trans	-56.4	-45.2	177	-176.7	-174.3	166.6	-165.1	-1.1	112.3	E672 P702 L704 L708 Q709 A710 A909	E672-R706 VanDerWaalsContact CD-NH2 3.29Å; E672-R706 IonicContact OE1-CZ 3.78Å; E672-R706 IonicContact OE1-NE 2.57Å; E672-R706 PolarHBondContact OE1-NE 3.5Å; E672-R706 IonicContact OE1-NH2 3.48Å; E672-R706 PolarHBondContact OE1-NH2 3.5Å; E672-R706 VanDerWaalsContact OE1-NH2 3.13Å; E672-R706 IonicContact OE2-CZ 3.56Å; E672-R706 IonicContact OE2-NE 2.72Å; E672-R706 IonicContact OE2-NH2 3.19Å; E672-R706 PolarHBondContact OE2-NH2 3.45Å; P702-R706 WeakPolarHBondContact O-CB 3.27Å; P702-R706 PolarHBondContact O-N 3.02Å; P702-R706 VanDerWaalsContact O-N 3.11Å; L704-R706 VanDerWaalsContact C-N 3.33Å; R706-L708 VanDerWaalsContact C-N 3.35Å; R706-L708 PolarHBondContact O-N 3.03Å; R706-Q709 WeakPolarHBondContact O-CB 3.33Å; R706-Q709 PolarHBondContact O-N 3.35Å; R706-Q709 VanDerWaalsContact O-N 3.13Å; R706-A710 PolarHBondContact O-N 3.21Å; R706-A909 PolarHBondContact NH1-O 3.06Å; R706-A909 PolarHBondContact NH2-O 2.92Å
707	L	96.8	Very high	93.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.4	-47.7	177.9	-177.5	56.1	0	0	0	110.6	F664 M667 S668 L689 A703 L704 V705 Q709 A710 F711	F664-L707 HydrophobicContact CB-CD2 4.22Å; F664-L707 HydrophobicContact CD1-CD2 3.79Å; F664-L707 HydrophobicContact CG-CD2 4.26Å; M667-L707 HydrophobicContact CB-CD1 3.98Å; M667-L707 HydrophobicContact CB-CD2 4.38Å; S668-L707 VanDerWaalsContact OG-CA 3.23Å; S668-L707 WeakPolarHBondContact OG-CA 3.46Å; S668-L707 WeakPolarHBondContact OG-CB 3.47Å; S668-L707 PolarHBondContact OG-N 3.46Å; L689-L707 HydrophobicContact CD1-CD2 3.73Å; L689-L707 HydrophobicContact CD1-CG 4.13Å; L689-L707 HydrophobicContact CD2-CD2 4.17Å; A703-L707 WeakPolarHBondContact O-CB 3.29Å; A703-L707 PolarHBondContact O-N 3.32Å; L704-L707 PolarHBondContact O-N 3.46Å; V705-L707 VanDerWaalsContact C-N 3.3Å; V705-L707 PolarHBondContact O-N 3.14Å; L707-Q709 VanDerWaalsContact C-N 3.29Å; L707-Q709 PolarHBondContact O-N 2.86Å; L707-A710 WeakPolarHBondContact O-CA 3.37Å; L707-A710 WeakPolarHBondContact O-CB 3.32Å; L707-A710 PolarHBondContact O-N 3.43Å; L707-F711 HydrophobicContact CD1-CD2 3.99Å; L707-F711 HydrophobicContact CD1-CE2 3.77Å; L707-F711 HydrophobicContact CD2-CE2 4.35Å; L707-F711 HydrophobicContact CG-CD2 3.96Å; L707-F711 HydrophobicContact CG-CE2 3.81Å; L707-F711 VanDerWaalsContact O-CD2 3.32Å; L707-F711 WeakPolarHBondContact O-CD2 3.26Å; L707-F711 PolarHBondContact O-N 3.22Å
708	L	97.4	Very high	93.9	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-61.1	-35.6	175.5	-71.3	-178	0	0	0	112.7	F686 L689 L690 W695 L704 V705 R706 A710 F711 L712 L730 V733 L750	F686-L708 HydrophobicContact CD2-CD2 4.27Å; F686-L708 HydrophobicContact CE2-CD2 3.9Å; L689-L708 HydrophobicContact CB-CD2 4.29Å; L689-L708 HydrophobicContact CD1-CD2 4.48Å; L690-L708 HydrophobicContact CD2-CD1 4.27Å; L690-L708 HydrophobicContact CD2-CD2 4.06Å; W695-L708 HydrophobicContact CH2-CD1 3.8Å; W695-L708 HydrophobicContact CZ2-CD1 3.5Å; W695-L708 VanDerWaalsContact CZ2-CD1 3.5Å; W695-L708 HydrophobicContact CZ2-CG 4.41Å; L704-L708 WeakPolarHBondContact O-CG 3.34Å; L704-L708 PolarHBondContact O-N 2.93Å; V705-L708 PolarHBondContact O-N 3.38Å; V705-L708 VanDerWaalsContact O-N 3.14Å; R706-L708 VanDerWaalsContact C-N 3.35Å; R706-L708 PolarHBondContact O-N 3.03Å; L708-A710 VanDerWaalsContact C-N 3.33Å; L708-F711 WeakPolarHBondContact O-CB 3.27Å; L708-F711 PolarHBondContact O-N 3.4Å; L708-L712 WeakPolarHBondContact O-CB 3.46Å; L708-L712 VanDerWaalsContact O-CG 3.27Å; L708-L712 WeakPolarHBondContact O-CG 3.29Å; L708-L712 PolarHBondContact O-N 3.43Å; L708-L730 HydrophobicContact CD1-CD1 3.81Å; L708-L730 HydrophobicContact CD2-CD1 4.23Å; L708-L730 HydrophobicContact CG-CD1 4.46Å; L708-V733 HydrophobicContact CD1-CG1 4.34Å; L708-L750 HydrophobicContact CB-CD1 3.81Å; L708-L750 HydrophobicContact CD1-CD1 4.18Å; L708-L750 HydrophobicContact CD1-CD2 4.26Å
709	Q	96	Very high	94.4	Very high	25 Å²	25	18 Å²	18	12%	0.117	9%	0.094	C	C	.	.	H	α-helix	trans	-61.5	-42.3	171.9	-61.6	-175.2	-71.5	0	0	111.2	V705 R706 L707 L712 E713 Y749 S753	V705-Q709 HydrophobicContact CG1-CG 4.32Å; V705-Q709 VanDerWaalsContact O-CG 3.31Å; V705-Q709 WeakPolarHBondContact O-CG 3.29Å; V705-Q709 PolarHBondContact O-N 3.04Å; R706-Q709 WeakPolarHBondContact O-CB 3.33Å; R706-Q709 PolarHBondContact O-N 3.35Å; R706-Q709 VanDerWaalsContact O-N 3.13Å; L707-Q709 VanDerWaalsContact C-N 3.29Å; L707-Q709 PolarHBondContact O-N 2.86Å; Q709-L712 PolarHBondContact O-N 3.36Å; Q709-E713 WeakPolarHBondContact O-CB 3.46Å; Q709-E713 PolarHBondContact O-N 2.99Å; Q709-Y749 PolarHBondContact NE2-O 2.96Å; Q709-S753 WeakPolarHBondContact CG-OG 3.45Å; Q709-S753 PolarHBondContact NE2-OG 3.25Å
710	A	95.1	Very high	94.7	Very high	1 Å²	1	19 Å²	19	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-64.9	-38.7	175.8	0	0	0	0	0	112.2	L671 E672 R706 L707 L708 L712 E713 R714	L671-A710 HydrophobicContact CB-CB 4.33Å; L671-A710 HydrophobicContact CD2-CB 3.92Å; L671-A710 HydrophobicContact CG-CB 4.15Å; E672-A710 HydrophobicContact CG-CB 3.86Å; R706-A710 PolarHBondContact O-N 3.21Å; L707-A710 WeakPolarHBondContact O-CA 3.37Å; L707-A710 WeakPolarHBondContact O-CB 3.32Å; L707-A710 PolarHBondContact O-N 3.43Å; L708-A710 VanDerWaalsContact C-N 3.33Å; A710-L712 VanDerWaalsContact C-N 3.34Å; A710-L712 PolarHBondContact O-N 3.15Å; A710-E713 PolarHBondContact O-N 2.98Å; A710-R714 WeakPolarHBondContact O-CB 3.4Å; A710-R714 PolarHBondContact O-N 3.46Å
711	F	96.7	Very high	94.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-42.7	171.1	-91.2	-94.1	0	0	0	112.1	L671 I678 Y682 M683 F686 L689 L707 L708 G715 I719	L671-F711 HydrophobicContact CD2-CD2 3.74Å; L671-F711 HydrophobicContact CD2-CE2 4.03Å; L671-F711 HydrophobicContact CD2-CG 4.05Å; I678-F711 HydrophobicContact CD1-CD1 3.31Å; I678-F711 HydrophobicContact CD1-CE1 3.6Å; I678-F711 HydrophobicContact CD1-CG 4.03Å; Y682-F711 HydrophobicContact CD1-CE2 4.21Å; Y682-F711 HydrophobicContact CD1-CZ 4.02Å; Y682-F711 HydrophobicContact CG-CZ 4.34Å; Y682-F711 WeakPolarHBondContact O-CE1 3.46Å; Y682-F711 VanDerWaalsContact O-CZ 3.24Å; Y682-F711 WeakPolarHBondContact O-CZ 3.29Å; M683-F711 HydrophobicContact SD-CD1 4.42Å; M683-F711 HydrophobicContact SD-CE1 4.46Å; F686-F711 HydrophobicContact CB-CD1 4.17Å; F686-F711 HydrophobicContact CB-CE1 3.74Å; F686-F711 HydrophobicContact CB-CZ 4.45Å; F686-F711 HydrophobicContact CD2-CB 4.38Å; F686-F711 AromaticContact CD2-CD1 3.53Å; F686-F711 HydrophobicContact CD2-CD1 3.53Å; F686-F711 AromaticContact CD2-CE1 3.91Å; F686-F711 HydrophobicContact CD2-CE1 3.91Å; F686-F711 AromaticContact CD2-CG 3.99Å; F686-F711 HydrophobicContact CD2-CG 3.99Å; F686-F711 HydrophobicContact CE2-CB 4.36Å; F686-F711 HydrophobicContact CE2-CD1 4.27Å; F686-F711 HydrophobicContact CE2-CG 4.44Å; F686-F711 HydrophobicContact CG-CD1 4.17Å; F686-F711 HydrophobicContact CG-CE1 4.24Å; L689-F711 HydrophobicContact CD1-CD2 4.19Å; L689-F711 HydrophobicContact CD1-CE2 3.53Å; L689-F711 HydrophobicContact CD1-CZ 3.9Å; L707-F711 HydrophobicContact CD1-CD2 3.99Å; L707-F711 HydrophobicContact CD1-CE2 3.77Å; L707-F711 HydrophobicContact CD2-CE2 4.35Å; L707-F711 HydrophobicContact CG-CD2 3.96Å; L707-F711 HydrophobicContact CG-CE2 3.81Å; L707-F711 VanDerWaalsContact O-CD2 3.32Å; L707-F711 WeakPolarHBondContact O-CD2 3.26Å; L707-F711 PolarHBondContact O-N 3.22Å; L708-F711 WeakPolarHBondContact O-CB 3.27Å; L708-F711 PolarHBondContact O-N 3.4Å; F711-G715 CarbonylContact O-C 3.08Å; F711-G715 WeakPolarHBondContact O-CA 3.2Å; F711-G715 PolarHBondContact O-N 2.72Å; F711-I719 HydrophobicContact CB-CD1 4.37Å
712	L	95.4	Very high	94.6	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68.1	-43	177.3	-71.2	166.5	0	0	0	111.4	L708 Q709 A710 R714 S716 I719 L730 L750 I754 H757 M758	L708-L712 WeakPolarHBondContact O-CB 3.46Å; L708-L712 VanDerWaalsContact O-CG 3.27Å; L708-L712 WeakPolarHBondContact O-CG 3.29Å; L708-L712 PolarHBondContact O-N 3.43Å; Q709-L712 PolarHBondContact O-N 3.36Å; A710-L712 VanDerWaalsContact C-N 3.34Å; A710-L712 PolarHBondContact O-N 3.15Å; L712-R714 PolarHBondContact O-N 2.92Å; L712-S716 WeakPolarHBondContact O-CB 3.27Å; L712-S716 PolarHBondContact O-N 2.57Å; L712-I719 HydrophobicContact CD2-CD1 4.35Å; L712-L730 HydrophobicContact CD1-CD2 4.45Å; L712-L730 HydrophobicContact CD2-CD2 3.9Å; L712-L750 HydrophobicContact CD1-CD1 3.77Å; L712-I754 HydrophobicContact CD1-CG1 3.68Å; L712-I754 HydrophobicContact CD2-CG1 4.27Å; L712-H757 WeakPolarHBondContact O-CB 3.45Å; L712-M758 HydrophobicContact CD2-CG 3.72Å; L712-M758 HydrophobicContact CD2-SD 3.59Å; L712-M758 VanDerWaalsContact CD2-SD 3.59Å
713	E	93.3	Very high	94.5	Very high	55 Å²	55	26 Å²	26	26%	0.257	16%	0.157	S	C	.	.	H	α-helix	trans	-65.9	-38.5	-179.3	-169.1	-172.4	153.9	0	0	112.6	Q709 A710	Q709-E713 WeakPolarHBondContact O-CB 3.46Å; Q709-E713 PolarHBondContact O-N 2.99Å; A710-E713 PolarHBondContact O-N 2.98Å
714	R	93.2	Very high	94.4	Very high	57 Å²	57	28 Å²	28	22%	0.215	17%	0.174	C	C	.	.	H	α-helix	trans	-99.9	-23.5	-175.6	-63.1	-64.7	178.9	-105.2	-11	114.6	L671 E672 H674 A710 L712	L671-R714 HydrophobicContact CD1-CB 4.2Å; L671-R714 HydrophobicContact CD1-CG 4.39Å; L671-R714 HydrophobicContact CG-CB 4.48Å; L671-R714 HydrophobicContact CG-CG 4.37Å; E672-R714 PolarHBondContact O-NH2 2.84Å; H674-R714 WeakPolarHBondContact O-CD 3.46Å; H674-R714 PolarHBondContact O-NE 2.96Å; A710-R714 WeakPolarHBondContact O-CB 3.4Å; A710-R714 PolarHBondContact O-N 3.46Å; L712-R714 PolarHBondContact O-N 2.92Å
715	G	93.1	Very high	94.3	Very high	1 Å²	1	33 Å²	33	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-125.1	9.3	-167.9	0	0	0	0	0	114.9	F711 N717 T718 I719	F711-G715 CarbonylContact O-C 3.08Å; F711-G715 WeakPolarHBondContact O-CA 3.2Å; F711-G715 PolarHBondContact O-N 2.72Å; G715-N717 VanDerWaalsContact C-N 3.32Å; G715-N717 PolarHBondContact O-N 3.07Å; G715-T718 CarbonylContact O-C 3.58Å; G715-T718 PolarHBondContact O-N 3.18Å; G715-I719 WeakPolarHBondContact O-CG1 3.39Å; G715-I719 PolarHBondContact O-N 2.84Å
716	S	93.9	Very high	94.2	Very high	15 Å²	15	36.2 Å²	36.2	11%	0.105	22%	0.215	C	C	.	.	H	α-helix	trans	-53.5	-44.2	-175.2	57	0	0	0	0	114	L712 T718 I719 A720 H757	L712-S716 WeakPolarHBondContact O-CB 3.27Å; L712-S716 PolarHBondContact O-N 2.57Å; S716-T718 PolarHBondContact O-N 2.83Å; S716-I719 PolarHBondContact O-N 3.43Å; S716-A720 VanDerWaalsContact O-CB 3.27Å; S716-A720 WeakPolarHBondContact O-CB 3.2Å; S716-A720 PolarHBondContact O-N 2.82Å; S716-H757 WeakPolarHBondContact CB-O 3.36Å; S716-H757 PolarHBondContact OG-O 2.78Å
717	N	93.4	Very high	94.3	Very high	115 Å²	115	35.9 Å²	35.9	62%	0.615	21%	0.214	S	C	*	.	H	α-helix	trans	-63.8	-40.8	177.1	-69.9	-35.1	0	0	0	112.1	G715 A720 S721	G715-N717 VanDerWaalsContact C-N 3.32Å; G715-N717 PolarHBondContact O-N 3.07Å; N717-A720 PolarHBondContact O-N 2.69Å; N717-S721 WeakPolarHBondContact O-CB 3.42Å; N717-S721 PolarHBondContact O-N 2.89Å; N717-S721 PolarHBondContact O-OG 3.4Å
718	T	94.1	Very high	94.2	Very high	49 Å²	49	38.9 Å²	38.9	30%	0.301	23%	0.234	S	C	.	.	H	α-helix	trans	-70.1	-38.6	177.7	-53.1	0	0	0	0	111.2	I678 M683 G715 S716 S721 A722 A723	I678-T718 HydrophobicContact CG2-CG2 4.27Å; M683-T718 HydrophobicContact CE-CG2 4.12Å; M683-T718 HydrophobicContact CG-CG2 4.02Å; M683-T718 HydrophobicContact SD-CG2 4.16Å; G715-T718 CarbonylContact O-C 3.58Å; G715-T718 PolarHBondContact O-N 3.18Å; S716-T718 PolarHBondContact O-N 2.83Å; T718-S721 PolarHBondContact O-N 2.81Å; T718-A722 HydrophobicContact CG2-CB 4.31Å; T718-A722 WeakPolarHBondContact O-CA 3.47Å; T718-A722 WeakPolarHBondContact O-CB 3.19Å; T718-A722 PolarHBondContact O-N 3.42Å; T718-A723 PolarHBondContact O-N 3.31Å
719	I	94.7	Very high	94.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-47.1	173.9	-66.5	165.2	0	0	0	109.8	M683 F686 F711 L712 G715 S716 S721 A723 A724 I727 M758	M683-I719 HydrophobicContact CE-CG1 4.13Å; M683-I719 HydrophobicContact SD-CG1 4.26Å; F686-I719 HydrophobicContact CE1-CD1 4.44Å; F686-I719 HydrophobicContact CE1-CG1 4.15Å; F686-I719 HydrophobicContact CE1-CG2 4.06Å; F686-I719 HydrophobicContact CE2-CD1 4.02Å; F686-I719 HydrophobicContact CZ-CD1 3.9Å; F686-I719 HydrophobicContact CZ-CG1 4.12Å; F686-I719 HydrophobicContact CZ-CG2 4.12Å; F711-I719 HydrophobicContact CB-CD1 4.37Å; L712-I719 HydrophobicContact CD2-CD1 4.35Å; G715-I719 WeakPolarHBondContact O-CG1 3.39Å; G715-I719 PolarHBondContact O-N 2.84Å; S716-I719 PolarHBondContact O-N 3.43Å; I719-S721 VanDerWaalsContact C-N 3.32Å; I719-S721 PolarHBondContact O-N 3.02Å; I719-A723 CarbonylContact O-C 3.29Å; I719-A723 WeakPolarHBondContact O-CA 3.48Å; I719-A723 PolarHBondContact O-N 3.13Å; I719-A723 VanDerWaalsContact O-N 3.12Å; I719-A724 PolarHBondContact O-N 3.43Å; I719-I727 HydrophobicContact CG2-CG1 4.31Å; I719-M758 HydrophobicContact CB-CE 4.35Å; I719-M758 HydrophobicContact CB-SD 4.44Å; I719-M758 HydrophobicContact CG2-CE 3.86Å; I719-M758 HydrophobicContact CG2-SD 4.33Å
720	A	93.7	Very high	94.1	Very high	25 Å²	25	39.2 Å²	39.2	21%	0.207	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-31.5	-179.2	0	0	0	0	0	113.7	S716 N717 A724 M758 P759	S716-A720 VanDerWaalsContact O-CB 3.27Å; S716-A720 WeakPolarHBondContact O-CB 3.2Å; S716-A720 PolarHBondContact O-N 2.82Å; N717-A720 PolarHBondContact O-N 2.69Å; A720-A724 WeakPolarHBondContact O-CB 3.48Å; A720-M758 HydrophobicContact CB-CE 4.16Å; A720-P759 HydrophobicContact CB-CG 3.91Å
721	S	93.2	Very high	94.1	Very high	96 Å²	96	40.1 Å²	40.1	67%	0.671	25%	0.248	S	C	*	.	H	α-helix	trans	-96.5	-48.3	-177.1	55.9	0	0	0	0	113.8	N717 T718 I719	N717-S721 WeakPolarHBondContact O-CB 3.42Å; N717-S721 PolarHBondContact O-N 2.89Å; N717-S721 PolarHBondContact O-OG 3.4Å; T718-S721 PolarHBondContact O-N 2.81Å; I719-S721 VanDerWaalsContact C-N 3.32Å; I719-S721 PolarHBondContact O-N 3.02Å
722	A	91.1	Very high	94.1	Very high	77 Å²	77	41.7 Å²	41.7	64%	0.636	26%	0.264	S	S	*	.	H	α-helix	trans	-102.4	-13.9	-171.6	0	0	0	0	0	114.2	T718	T718-A722 HydrophobicContact CG2-CB 4.31Å; T718-A722 WeakPolarHBondContact O-CA 3.47Å; T718-A722 WeakPolarHBondContact O-CB 3.19Å; T718-A722 PolarHBondContact O-N 3.42Å
723	A	91.9	Very high	94.2	Very high	9 Å²	9	42 Å²	42	7%	0.074	27%	0.266	C	S	.	.	S	Bend	trans	-134.1	31.1	179.8	0	0	0	0	0	112.5	M683 F686 T718 I719 D725 K726	M683-A723 HydrophobicContact CE-CB 3.93Å; F686-A723 HydrophobicContact CD1-CB 4.39Å; F686-A723 HydrophobicContact CE1-CB 4.49Å; T718-A723 PolarHBondContact O-N 3.31Å; I719-A723 CarbonylContact O-C 3.29Å; I719-A723 WeakPolarHBondContact O-CA 3.48Å; I719-A723 PolarHBondContact O-N 3.13Å; I719-A723 VanDerWaalsContact O-N 3.12Å; A723-D725 PolarHBondContact O-N 3.21Å; A723-K726 HydrophobicContact CB-CB 4.38Å; A723-K726 HydrophobicContact CB-CG 4.04Å; A723-K726 WeakPolarHBondContact O-CA 3.23Å; A723-K726 VanDerWaalsContact O-CB 3.3Å; A723-K726 WeakPolarHBondContact O-CB 3.44Å; A723-K726 PolarHBondContact O-N 2.86Å
724	A	91.8	Very high	94.3	Very high	44 Å²	44	39.4 Å²	39.4	36%	0.364	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-58.6	-32.5	-178	0	0	0	0	0	112.2	I719 A720 K726 I727	I719-A724 PolarHBondContact O-N 3.43Å; A720-A724 WeakPolarHBondContact O-CB 3.48Å; A724-K726 PolarHBondContact O-N 2.83Å; A724-I727 HydrophobicContact CB-CD1 4.45Å; A724-I727 WeakPolarHBondContact O-CB 3.42Å; A724-I727 WeakPolarHBondContact O-CG1 3.49Å; A724-I727 PolarHBondContact O-N 3.27Å
725	D	94.2	Very high	94.5	Very high	106 Å²	106	41.3 Å²	41.3	57%	0.567	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-65.2	-14.1	175.1	70.6	-56.4	0	0	0	113.4	A723	A723-D725 PolarHBondContact O-N 3.21Å
726	K	95.2	Very high	94.5	Very high	68 Å²	68	44.9 Å²	44.9	30%	0.296	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-93.7	-12.5	177.5	-52	-51.3	-178.8	-151.2	0	113.7	F686 P687 L690 A723 A724 P728 G729 L730	F686-K726 HydrophobicContact CD1-CB 4.31Å; F686-K726 HydrophobicContact CE1-CB 3.87Å; P687-K726 HydrophobicContact CB-CD 4.39Å; L690-K726 HydrophobicContact CD1-CB 3.97Å; L690-K726 WeakPolarHBondContact CD1-O 3.27Å; A723-K726 HydrophobicContact CB-CB 4.38Å; A723-K726 HydrophobicContact CB-CG 4.04Å; A723-K726 WeakPolarHBondContact O-CA 3.23Å; A723-K726 VanDerWaalsContact O-CB 3.3Å; A723-K726 WeakPolarHBondContact O-CB 3.44Å; A723-K726 PolarHBondContact O-N 2.86Å; A724-K726 PolarHBondContact O-N 2.83Å; K726-P728 VanDerWaalsContact C-N 3.35Å; K726-G729 WeakPolarHBondContact O-CA 3.38Å; K726-G729 PolarHBondContact O-N 3.19Å; K726-L730 PolarHBondContact O-N 3.05Å; K726-L730 VanDerWaalsContact O-N 3.13Å
727	I	95.3	Very high	94.6	Very high	9 Å²	9	44.3 Å²	44.3	5%	0.046	28%	0.277	C	S	.	.	H	α-helix	trans	-55.4	-42.4	177.4	-64	170.9	0	0	0	112.2	I719 A724 G729 L730 L731 M758 Y766	I719-I727 HydrophobicContact CG2-CG1 4.31Å; A724-I727 HydrophobicContact CB-CD1 4.45Å; A724-I727 WeakPolarHBondContact O-CB 3.42Å; A724-I727 WeakPolarHBondContact O-CG1 3.49Å; A724-I727 PolarHBondContact O-N 3.27Å; I727-G729 VanDerWaalsContact C-N 3.27Å; I727-G729 PolarHBondContact O-N 2.94Å; I727-L730 WeakPolarHBondContact O-CB 3.46Å; I727-L730 PolarHBondContact O-N 2.93Å; I727-L730 VanDerWaalsContact O-N 3.15Å; I727-L731 HydrophobicContact CG2-CD1 4.14Å; I727-L731 HydrophobicContact CG2-CG 4.43Å; I727-L731 WeakPolarHBondContact O-CG 3.31Å; I727-L731 PolarHBondContact O-N 3.3Å; I727-M758 HydrophobicContact CD1-CE 4.02Å; I727-M758 HydrophobicContact CG1-CE 4.32Å; I727-Y766 HydrophobicContact CB-CE2 4.29Å; I727-Y766 HydrophobicContact CG2-CD2 3.89Å; I727-Y766 HydrophobicContact CG2-CE2 3.52Å
728	P	95.2	Very high	94.6	Very high	64 Å²	64	39.1 Å²	39.1	42%	0.416	25%	0.248	S	C	.	.	H	α-helix	trans	-58.6	-35.6	173.8	-27	36.3	0	0	0	114	K726 L731 G732 Y766	K726-P728 VanDerWaalsContact C-N 3.35Å; P728-L731 PolarHBondContact O-N 3.25Å; P728-G732 PolarHBondContact O-N 2.94Å; P728-Y766 HydrophobicContact CG-CE1 4.36Å
729	G	95.5	Very high	94.4	Very high	31 Å²	31	40.1 Å²	40.1	32%	0.32	26%	0.262	S	S	.	.	H	α-helix	trans	-66.1	-41.5	175.3	0	0	0	0	0	112.2	K726 I727 L731 G732 V733	K726-G729 WeakPolarHBondContact O-CA 3.38Å; K726-G729 PolarHBondContact O-N 3.19Å; I727-G729 VanDerWaalsContact C-N 3.27Å; I727-G729 PolarHBondContact O-N 2.94Å; G729-L731 VanDerWaalsContact C-N 3.33Å; G729-L731 PolarHBondContact O-N 2.9Å; G729-G732 PolarHBondContact O-N 3.32Å; G729-G732 VanDerWaalsContact O-N 3.17Å; G729-V733 PolarHBondContact O-N 3.27Å
730	L	95.9	Very high	94.1	Very high	2 Å²	2	42 Å²	42	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-42.2	174.1	-174.7	69.1	0	0	0	112	L690 L708 L712 K726 I727 G732 V733 F734 L750 I754	L690-L730 HydrophobicContact CD2-CB 4.25Å; L690-L730 HydrophobicContact CD2-CD1 3.89Å; L708-L730 HydrophobicContact CD1-CD1 3.81Å; L708-L730 HydrophobicContact CD2-CD1 4.23Å; L708-L730 HydrophobicContact CG-CD1 4.46Å; L712-L730 HydrophobicContact CD1-CD2 4.45Å; L712-L730 HydrophobicContact CD2-CD2 3.9Å; K726-L730 PolarHBondContact O-N 3.05Å; K726-L730 VanDerWaalsContact O-N 3.13Å; I727-L730 WeakPolarHBondContact O-CB 3.46Å; I727-L730 PolarHBondContact O-N 2.93Å; I727-L730 VanDerWaalsContact O-N 3.15Å; L730-G732 VanDerWaalsContact C-N 3.34Å; L730-V733 WeakPolarHBondContact O-CB 3.27Å; L730-V733 PolarHBondContact O-N 3.08Å; L730-F734 PolarHBondContact O-N 3.43Å; L730-L750 HydrophobicContact CD1-CD1 4.05Å; L730-L750 HydrophobicContact CD1-CD2 4.22Å; L730-I754 HydrophobicContact CD2-CD1 3.85Å; L730-I754 HydrophobicContact CD2-CG1 3.93Å; L730-I754 HydrophobicContact CG-CD1 4.05Å
731	L	96.3	Very high	93.7	Very high	20 Å²	20	43.7 Å²	43.7	11%	0.105	28%	0.278	C	S	.	.	H	α-helix	trans	-70.1	-31.7	175.3	-65.7	174.2	0	0	0	112.4	I727 P728 G729 V733 F734 Q735 I754 Y766 I770	I727-L731 HydrophobicContact CG2-CD1 4.14Å; I727-L731 HydrophobicContact CG2-CG 4.43Å; I727-L731 WeakPolarHBondContact O-CG 3.31Å; I727-L731 PolarHBondContact O-N 3.3Å; P728-L731 PolarHBondContact O-N 3.25Å; G729-L731 VanDerWaalsContact C-N 3.33Å; G729-L731 PolarHBondContact O-N 2.9Å; L731-V733 VanDerWaalsContact C-N 3.32Å; L731-F734 WeakPolarHBondContact O-CB 3.18Å; L731-F734 WeakPolarHBondContact O-CD1 3.47Å; L731-F734 PolarHBondContact O-N 3.46Å; L731-Q735 PolarHBondContact O-N 3.02Å; L731-I754 HydrophobicContact CD2-CD1 4.11Å; L731-Y766 VanDerWaalsContact CD1-CB 3.46Å; L731-Y766 HydrophobicContact CD1-CD1 3.71Å; L731-Y766 HydrophobicContact CD1-CD2 3.8Å; L731-Y766 HydrophobicContact CD1-CE1 4.39Å; L731-Y766 HydrophobicContact CD1-CE2 4.46Å; L731-Y766 HydrophobicContact CD1-CG 3.36Å; L731-I770 HydrophobicContact CD2-CD1 3.78Å; L731-I770 HydrophobicContact CD2-CG1 4.12Å
732	G	96.4	Very high	93.3	Very high	33 Å²	33	42 Å²	42	34%	0.34	27%	0.269	S	S	.	.	H	α-helix	trans	-62.2	-38.2	171.8	0	0	0	0	0	112.7	P728 G729 L730 Q735 K736	P728-G732 PolarHBondContact O-N 2.94Å; G729-G732 PolarHBondContact O-N 3.32Å; G729-G732 VanDerWaalsContact O-N 3.17Å; L730-G732 VanDerWaalsContact C-N 3.34Å; G732-Q735 PolarHBondContact O-N 3.27Å; G732-K736 PolarHBondContact O-N 2.99Å
733	V	96.9	Very high	93.2	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-50.8	171.6	169.4	0	0	0	0	110.7	L690 W695 L708 G729 L730 L731 Q735 K736 L737 L750	L690-V733 HydrophobicContact CD2-CG2 4.27Å; W695-V733 HydrophobicContact CD2-CG1 3.69Å; W695-V733 HydrophobicContact CD2-CG2 4.25Å; W695-V733 VanDerWaalsContact CE2-CG1 3.44Å; W695-V733 HydrophobicContact CE3-CG1 3.8Å; W695-V733 HydrophobicContact CG-CG2 4.42Å; W695-V733 HydrophobicContact CH2-CG1 3.46Å; W695-V733 VanDerWaalsContact CH2-CG1 3.46Å; W695-V733 HydrophobicContact CZ2-CB 4.35Å; W695-V733 HydrophobicContact CZ2-CG1 3.36Å; W695-V733 HydrophobicContact CZ2-CG2 4.06Å; W695-V733 HydrophobicContact CZ3-CG1 3.68Å; L708-V733 HydrophobicContact CD1-CG1 4.34Å; G729-V733 PolarHBondContact O-N 3.27Å; L730-V733 WeakPolarHBondContact O-CB 3.27Å; L730-V733 PolarHBondContact O-N 3.08Å; L731-V733 VanDerWaalsContact C-N 3.32Å; V733-Q735 VanDerWaalsContact C-N 3.31Å; V733-Q735 PolarHBondContact O-N 3.22Å; V733-K736 PolarHBondContact O-N 3.47Å; V733-L737 HydrophobicContact CG1-CD1 3.96Å; V733-L737 HydrophobicContact CG1-CG 4.41Å; V733-L737 WeakPolarHBondContact O-CG 3.26Å; V733-L737 PolarHBondContact O-N 2.89Å; V733-L750 HydrophobicContact CB-CD2 4.28Å; V733-L750 HydrophobicContact CG1-CD2 3.8Å
734	F	96.1	Very high	93.1	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-52.5	-50.3	174.9	146.2	-107.4	0	0	0	111.4	L730 L731 K736 L737 I738 L750 L751 I770 L773 L774	L730-F734 PolarHBondContact O-N 3.43Å; L731-F734 WeakPolarHBondContact O-CB 3.18Å; L731-F734 WeakPolarHBondContact O-CD1 3.47Å; L731-F734 PolarHBondContact O-N 3.46Å; F734-K736 VanDerWaalsContact C-N 3.29Å; F734-K736 PolarHBondContact O-N 3.48Å; F734-L737 PolarHBondContact O-N 2.99Å; F734-L737 VanDerWaalsContact O-N 3.11Å; F734-I738 HydrophobicContact CD2-CG1 4.42Å; F734-I738 HydrophobicContact CD2-CG2 3.74Å; F734-I738 HydrophobicContact CE1-CD1 4.21Å; F734-I738 HydrophobicContact CE2-CB 4.23Å; F734-I738 HydrophobicContact CE2-CD1 3.7Å; F734-I738 HydrophobicContact CE2-CG1 3.95Å; F734-I738 HydrophobicContact CE2-CG2 3.33Å; F734-I738 HydrophobicContact CZ-CD1 3.49Å; F734-I738 VanDerWaalsContact CZ-CD1 3.49Å; F734-I738 HydrophobicContact CZ-CG1 4.18Å; F734-I738 HydrophobicContact CZ-CG2 4.28Å; F734-I738 WeakPolarHBondContact O-CG1 3.4Å; F734-I738 PolarHBondContact O-N 2.83Å; F734-L750 HydrophobicContact CB-CD2 4.28Å; F734-L751 HydrophobicContact CB-CD2 4.44Å; F734-L751 HydrophobicContact CD1-CD2 4.04Å; F734-L751 HydrophobicContact CD2-CD1 3.57Å; F734-L751 HydrophobicContact CD2-CD2 3.79Å; F734-L751 HydrophobicContact CD2-CG 3.37Å; F734-L751 HydrophobicContact CE1-CD1 4.44Å; F734-L751 HydrophobicContact CE1-CD2 4.25Å; F734-L751 HydrophobicContact CE2-CD1 3.11Å; F734-L751 HydrophobicContact CE2-CD2 4Å; F734-L751 HydrophobicContact CE2-CG 3.52Å; F734-L751 HydrophobicContact CG-CD1 4.39Å; F734-L751 HydrophobicContact CG-CD2 3.79Å; F734-L751 HydrophobicContact CG-CG 3.9Å; F734-L751 HydrophobicContact CZ-CD1 3.62Å; F734-L751 HydrophobicContact CZ-CD2 4.23Å; F734-L751 HydrophobicContact CZ-CG 4.18Å; F734-I770 HydrophobicContact CE1-CG1 4.37Å; F734-I770 HydrophobicContact CE1-CG2 4.12Å; F734-I770 HydrophobicContact CZ-CG2 4.08Å; F734-L773 HydrophobicContact CE1-CD1 4.09Å; F734-L774 HydrophobicContact CE2-CD2 3.91Å; F734-L774 HydrophobicContact CZ-CD2 3.89Å; F734-L774 HydrophobicContact CZ-CG 4.1Å
735	Q	95.9	Very high	93	Very high	98 Å²	98	38.8 Å²	38.8	46%	0.458	23%	0.233	S	C	.	.	H	α-helix	trans	-59.4	-40.2	-178.6	-176.7	177.5	-2.4	0	0	111.9	L731 G732 V733 I738 A739 L773	L731-Q735 PolarHBondContact O-N 3.02Å; G732-Q735 PolarHBondContact O-N 3.27Å; V733-Q735 VanDerWaalsContact C-N 3.31Å; V733-Q735 PolarHBondContact O-N 3.22Å; Q735-I738 VanDerWaalsContact O-CG1 3.31Å; Q735-I738 WeakPolarHBondContact O-CG1 3.22Å; Q735-A739 PolarHBondContact O-N 3.29Å; Q735-L773 HydrophobicContact CB-CD1 4.22Å; Q735-L773 HydrophobicContact CG-CD1 3.94Å; Q735-L773 HydrophobicContact CG-CD2 4.22Å
736	K	94.5	Very high	93	Very high	75 Å²	75	34.7 Å²	34.7	33%	0.326	21%	0.21	S	C	.	.	H	α-helix	trans	-63.8	-44.2	175	-179.8	170.4	179.1	163.5	0	111.8	P692 W695 G732 V733 F734 A739	P692-K736 PolarHBondContact O-NZ 2.92Å; P692-K736 VanDerWaalsContact O-NZ 3.13Å; W695-K736 HydrophobicContact CB-CD 3.89Å; W695-K736 WeakPolarHBondContact O-CE 3.5Å; W695-K736 PolarHBondContact O-NZ 3.05Å; G732-K736 PolarHBondContact O-N 2.99Å; V733-K736 PolarHBondContact O-N 3.47Å; F734-K736 VanDerWaalsContact C-N 3.29Å; F734-K736 PolarHBondContact O-N 3.48Å; K736-A739 PolarHBondContact O-N 3.09Å
737	L	94.6	Very high	93.1	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	20%	0.196	C	C	.	.	H	α-helix	trans	-66.4	-45.5	-178.1	-67.3	174.4	0	0	0	112.2	W695 I701 V705 V733 F734 A739 S740 N743 D744 Q746	W695-L737 HydrophobicContact CE3-CD1 4.28Å; W695-L737 HydrophobicContact CE3-CD2 3.92Å; W695-L737 HydrophobicContact CE3-CG 4.32Å; W695-L737 HydrophobicContact CZ3-CD1 3.81Å; W695-L737 HydrophobicContact CZ3-CD2 4.09Å; W695-L737 HydrophobicContact CZ3-CG 4.33Å; I701-L737 HydrophobicContact CD1-CD2 4.08Å; I701-L737 HydrophobicContact CG1-CD2 4.3Å; I701-L737 HydrophobicContact CG2-CD2 3.55Å; V705-L737 HydrophobicContact CG2-CD1 3.67Å; V733-L737 HydrophobicContact CG1-CD1 3.96Å; V733-L737 HydrophobicContact CG1-CG 4.41Å; V733-L737 WeakPolarHBondContact O-CG 3.26Å; V733-L737 PolarHBondContact O-N 2.89Å; F734-L737 PolarHBondContact O-N 2.99Å; F734-L737 VanDerWaalsContact O-N 3.11Å; L737-A739 PolarHBondContact O-N 3.39Å; L737-S740 PolarHBondContact O-N 2.82Å; L737-S740 VanDerWaalsContact O-N 3.13Å; L737-N743 HydrophobicContact CD2-CB 4.04Å; L737-N743 CarbonylContact O-C 3.33Å; L737-D744 WeakPolarHBondContact O-CA 3.33Å; L737-D744 PolarHBondContact O-N 3.48Å; L737-Q746 HydrophobicContact CD1-CB 4.26Å
738	I	93.6	Very high	93.1	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-25.4	178	59.8	160.1	0	0	0	113.5	F734 Q735 S740 L773 L774 R777 F786	F734-I738 HydrophobicContact CD2-CG1 4.42Å; F734-I738 HydrophobicContact CD2-CG2 3.74Å; F734-I738 HydrophobicContact CE1-CD1 4.21Å; F734-I738 HydrophobicContact CE2-CB 4.23Å; F734-I738 HydrophobicContact CE2-CD1 3.7Å; F734-I738 HydrophobicContact CE2-CG1 3.95Å; F734-I738 HydrophobicContact CE2-CG2 3.33Å; F734-I738 HydrophobicContact CZ-CD1 3.49Å; F734-I738 VanDerWaalsContact CZ-CD1 3.49Å; F734-I738 HydrophobicContact CZ-CG1 4.18Å; F734-I738 HydrophobicContact CZ-CG2 4.28Å; F734-I738 WeakPolarHBondContact O-CG1 3.4Å; F734-I738 PolarHBondContact O-N 2.83Å; Q735-I738 VanDerWaalsContact O-CG1 3.31Å; Q735-I738 WeakPolarHBondContact O-CG1 3.22Å; I738-S740 PolarHBondContact O-N 3.36Å; I738-L773 HydrophobicContact CD1-CB 4.1Å; I738-L774 HydrophobicContact CD1-CD2 4.2Å; I738-L774 HydrophobicContact CG2-CD2 4.34Å; I738-R777 WeakPolarHBondContact O-CD 2.85Å; I738-R777 PolarHBondContact O-NE 2.69Å; I738-F786 HydrophobicContact CB-CE2 4.37Å
739	A	91.1	Very high	93.1	Very high	71 Å²	71	32.6 Å²	32.6	59%	0.587	19%	0.192	S	C	*	.	H	α-helix	trans	-66.1	-25.5	175.7	0	0	0	0	0	112.1	Q735 K736 L737	Q735-A739 PolarHBondContact O-N 3.29Å; K736-A739 PolarHBondContact O-N 3.09Å; L737-A739 PolarHBondContact O-N 3.39Å
740	S	87.9	Confident	93.2	Very high	38 Å²	38	31.1 Å²	31.1	27%	0.266	18%	0.177	S	C	.	.			trans	-90	122.9	178.9	177.3	0	0	0	0	111.6	L737 I738 A742 N743 D744	L737-S740 PolarHBondContact O-N 2.82Å; L737-S740 VanDerWaalsContact O-N 3.13Å; I738-S740 PolarHBondContact O-N 3.36Å; S740-A742 PolarHBondContact O-N 3.36Å; S740-A742 PolarHBondContact OG-N 3.46Å; S740-N743 PolarHBondContact O-N 2.9Å; S740-N743 PolarHBondContact OG-N 3.18Å; S740-N743 PolarHBondContact OG-ND2 2.88Å; S740-D744 WeakPolarHBondContact O-CB 3.43Å; S740-D744 PolarHBondContact O-N 3.11Å
741	K	84.9	Confident	93.3	Very high	62 Å²	62	31 Å²	31	27%	0.27	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.1	172.6	-66.2	-176.9	-167.2	138.9	0	112.7	D79 R777 T783 K785	D79-K741 IonicContact OD1-NZ 3.77Å; D79-K741 PolarHBondContact OD1-NZ 3.15Å; D79-K741 WeakPolarHBondContact OD2-CD 3.35Å; D79-K741 VanDerWaalsContact OD2-CE 3.27Å; D79-K741 WeakPolarHBondContact OD2-CE 3.3Å; D79-K741 IonicContact OD2-NZ 2.72Å; D79-K741 PolarHBondContact OD2-NZ 3.18Å; K741-R777 VanDerWaalsContact CG-NH2 3.33Å; K741-T783 HydrophobicContact CB-CG2 4.09Å; K741-T783 HydrophobicContact CD-CG2 4Å; K741-T783 HydrophobicContact CG-CG2 3.8Å; K741-K785 PolarHBondContact O-NZ 2.88Å
742	A	84.3	Confident	93.3	Very high	60 Å²	60	31.1 Å²	31.1	50%	0.496	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-40.7	177.2	0	0	0	0	0	111.5	S740 H745 K785	S740-A742 PolarHBondContact O-N 3.36Å; S740-A742 PolarHBondContact OG-N 3.46Å; A742-H745 PolarHBondContact O-CE1 3.35Å; A742-H745 PolarHBondContact O-ND1 2.72Å; A742-K785 PolarHBondContact O-NZ 3.26Å
743	N	89	Confident	93.3	Very high	25 Å²	25	29.8 Å²	29.8	13%	0.134	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	4.9	-166.9	-59.6	-63.1	0	0	0	115.5	I701 L737 S740 H745 Q746 G747	I701-N743 HydrophobicContact CD1-CB 4.29Å; I701-N743 WeakPolarHBondContact CD1-ND2 3.34Å; I701-N743 HydrophobicContact CG2-CB 4.45Å; L737-N743 HydrophobicContact CD2-CB 4.04Å; L737-N743 CarbonylContact O-C 3.33Å; S740-N743 PolarHBondContact O-N 2.9Å; S740-N743 PolarHBondContact OG-N 3.18Å; S740-N743 PolarHBondContact OG-ND2 2.88Å; N743-H745 VanDerWaalsContact C-N 3.33Å; N743-H745 PolarHBondContact O-N 3.47Å; N743-Q746 WeakPolarHBondContact O-CA 3.31Å; N743-Q746 VanDerWaalsContact O-CB 3.24Å; N743-Q746 WeakPolarHBondContact O-CB 3.19Å; N743-Q746 PolarHBondContact O-N 2.97Å; N743-G747 PolarHBondContact O-N 3.36Å
744	D	90.1	Very high	93.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-55.2	-42.5	-175.6	52	19.5	0	0	0	114.5	L737 S740 Q746 G747 F748 R777 T783 K785 F786	L737-D744 WeakPolarHBondContact O-CA 3.33Å; L737-D744 PolarHBondContact O-N 3.48Å; S740-D744 WeakPolarHBondContact O-CB 3.43Å; S740-D744 PolarHBondContact O-N 3.11Å; D744-Q746 VanDerWaalsContact C-N 3.26Å; D744-Q746 PolarHBondContact O-N 2.95Å; D744-G747 WeakPolarHBondContact O-CA 3.26Å; D744-G747 PolarHBondContact O-N 3.31Å; D744-F748 VanDerWaalsContact O-CD2 3.3Å; D744-F748 WeakPolarHBondContact O-CD2 3.28Å; D744-F748 PolarHBondContact O-N 3.44Å; D744-F748 VanDerWaalsContact O-N 3.11Å; D744-R777 IonicContact OD2-NH2 3.19Å; D744-T783 PolarHBondContact OD2-OG1 3.5Å; D744-T783 VanDerWaalsContact OD2-OG1 3.13Å; D744-K785 WeakPolarHBondContact OD1-CE 3.42Å; D744-F786 HydrophobicContact CB-CD2 3.89Å
745	H	90.7	Very high	93.2	Very high	37 Å²	37	29.9 Å²	29.9	17%	0.171	16%	0.163	C	C	.	.	H	α-helix	trans	-55	-36.9	173.2	65.7	-67.7	0	0	0	113.2	A742 N743 G747 F748 Y749 K785	A742-H745 PolarHBondContact O-CE1 3.35Å; A742-H745 PolarHBondContact O-ND1 2.72Å; N743-H745 VanDerWaalsContact C-N 3.33Å; N743-H745 PolarHBondContact O-N 3.47Å; H745-G747 VanDerWaalsContact C-N 3.32Å; H745-G747 PolarHBondContact O-N 3.15Å; H745-F748 WeakPolarHBondContact O-CB 2.96Å; H745-F748 PolarHBondContact O-N 2.64Å; H745-F748 VanDerWaalsContact O-N 3.14Å; H745-Y749 AromaticContact CD2-CE2 3.88Å; H745-Y749 PolarHBondContact O-N 3.42Å; H745-K785 HydrophobicContact CB-CD 4.01Å; H745-K785 HydrophobicContact CB-CG 4.02Å; H745-K785 PolarHBondContact ND1-NZ 3.16Å
746	Q	94.1	Very high	93.2	Very high	21 Å²	21	26.8 Å²	26.8	10%	0.098	15%	0.148	C	C	.	.	H	α-helix	trans	-65.8	-37.5	175.1	-61.5	-67.7	-19.7	0	0	111.1	I701 V705 L737 N743 D744 F748 Y749 L750	I701-Q746 HydrophobicContact CG2-CB 3.94Å; I701-Q746 HydrophobicContact CG2-CG 3.88Å; V705-Q746 HydrophobicContact CG2-CB 3.9Å; L737-Q746 HydrophobicContact CD1-CB 4.26Å; N743-Q746 WeakPolarHBondContact O-CA 3.31Å; N743-Q746 VanDerWaalsContact O-CB 3.24Å; N743-Q746 WeakPolarHBondContact O-CB 3.19Å; N743-Q746 PolarHBondContact O-N 2.97Å; D744-Q746 VanDerWaalsContact C-N 3.26Å; D744-Q746 PolarHBondContact O-N 2.95Å; Q746-F748 VanDerWaalsContact C-N 3.29Å; Q746-F748 PolarHBondContact O-N 3.06Å; Q746-Y749 PolarHBondContact O-N 3.02Å; Q746-L750 PolarHBondContact O-N 3.25Å; Q746-L750 VanDerWaalsContact O-N 3.15Å
747	G	95.9	Very high	93.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.7	-38.4	171.6	0	0	0	0	0	112.5	N743 D744 H745 L751	N743-G747 PolarHBondContact O-N 3.36Å; D744-G747 WeakPolarHBondContact O-CA 3.26Å; D744-G747 PolarHBondContact O-N 3.31Å; H745-G747 VanDerWaalsContact C-N 3.32Å; H745-G747 PolarHBondContact O-N 3.15Å; G747-L751 PolarHBondContact O-N 3.41Å
748	F	97.1	Very high	93.2	Very high	1 Å²	1	25.4 Å²	25.4	0%	0.004	14%	0.143	C	C	.	.	H	α-helix	trans	-71.8	-38.1	175.6	-76.8	-73.4	0	0	0	113.5	D744 H745 Q746 L750 L751 N752 L774 F786 S789 F790 F793	D744-F748 VanDerWaalsContact O-CD2 3.3Å; D744-F748 WeakPolarHBondContact O-CD2 3.28Å; D744-F748 PolarHBondContact O-N 3.44Å; D744-F748 VanDerWaalsContact O-N 3.11Å; H745-F748 WeakPolarHBondContact O-CB 2.96Å; H745-F748 PolarHBondContact O-N 2.64Å; H745-F748 VanDerWaalsContact O-N 3.14Å; Q746-F748 VanDerWaalsContact C-N 3.29Å; Q746-F748 PolarHBondContact O-N 3.06Å; F748-L750 VanDerWaalsContact C-N 3.25Å; F748-L750 PolarHBondContact O-N 3.14Å; F748-L751 HydrophobicContact CD1-CD1 4.32Å; F748-L751 PolarHBondContact O-N 3.41Å; F748-N752 WeakPolarHBondContact O-CB 3.39Å; F748-N752 PolarHBondContact O-N 2.96Å; F748-N752 PolarHBondContact O-ND2 2.67Å; F748-N752 PolarHBondContact O-OD1 2.83Å; F748-L774 HydrophobicContact CE1-CD1 4.28Å; F748-L774 HydrophobicContact CE1-CD2 3.61Å; F748-L774 HydrophobicContact CZ-CD2 3.59Å; F748-F786 AromaticContact CE2-CD2 3.67Å; F748-F786 HydrophobicContact CE2-CD2 3.67Å; F748-F786 AromaticContact CE2-CE2 3.63Å; F748-F786 HydrophobicContact CE2-CE2 3.63Å; F748-F786 HydrophobicContact CE2-CG 4.15Å; F748-F786 HydrophobicContact CE2-CZ 4.12Å; F748-F786 HydrophobicContact CZ-CD2 4.2Å; F748-F786 HydrophobicContact CZ-CE1 4.22Å; F748-F786 AromaticContact CZ-CE2 3.78Å; F748-F786 HydrophobicContact CZ-CE2 3.78Å; F748-F786 AromaticContact CZ-CZ 3.8Å; F748-F786 HydrophobicContact CZ-CZ 3.8Å; F748-S789 VanDerWaalsContact CG-CB 3.46Å; F748-F790 HydrophobicContact CE1-CB 4.05Å; F748-F790 HydrophobicContact CE1-CD2 4.16Å; F748-F790 HydrophobicContact CZ-CB 3.71Å; F748-F790 HydrophobicContact CZ-CD2 4.19Å; F748-F790 HydrophobicContact CZ-CG 4.47Å; F748-F793 HydrophobicContact CD1-CB 3.65Å; F748-F793 HydrophobicContact CD1-CG 4.06Å; F748-F793 HydrophobicContact CE1-CB 3.95Å; F748-F793 HydrophobicContact CE1-CD1 4.3Å; F748-F793 HydrophobicContact CE1-CG 4.23Å
749	Y	95.4	Very high	93.3	Very high	95 Å²	95	26.4 Å²	26.4	37%	0.373	15%	0.15	S	C	.	.	H	α-helix	trans	-58.6	-40.7	173	-64.9	-25.1	0	0	0	112	Q709 H745 Q746 S753	Q709-Y749 PolarHBondContact NE2-O 2.96Å; H745-Y749 AromaticContact CD2-CE2 3.88Å; H745-Y749 PolarHBondContact O-N 3.42Å; Q746-Y749 PolarHBondContact O-N 3.02Å; Y749-S753 PolarHBondContact O-N 3.39Å; Y749-S753 PolarHBondContact O-OG 2.58Å
750	L	96.7	Very high	93.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-49.7	174	-175.7	59.2	0	0	0	111.4	L708 L712 L730 V733 F734 Q746 F748 N752 S753 I754	L708-L750 HydrophobicContact CB-CD1 3.81Å; L708-L750 HydrophobicContact CD1-CD1 4.18Å; L708-L750 HydrophobicContact CD1-CD2 4.26Å; L712-L750 HydrophobicContact CD1-CD1 3.77Å; L730-L750 HydrophobicContact CD1-CD1 4.05Å; L730-L750 HydrophobicContact CD1-CD2 4.22Å; V733-L750 HydrophobicContact CB-CD2 4.28Å; V733-L750 HydrophobicContact CG1-CD2 3.8Å; F734-L750 HydrophobicContact CB-CD2 4.28Å; Q746-L750 PolarHBondContact O-N 3.25Å; Q746-L750 VanDerWaalsContact O-N 3.15Å; F748-L750 VanDerWaalsContact C-N 3.25Å; F748-L750 PolarHBondContact O-N 3.14Å; L750-N752 PolarHBondContact O-N 3.09Å; L750-S753 WeakPolarHBondContact O-CB 3.4Å; L750-S753 PolarHBondContact O-N 3.1Å; L750-S753 VanDerWaalsContact O-N 3.15Å; L750-I754 HydrophobicContact CG-CD1 4.13Å; L750-I754 WeakPolarHBondContact O-CG1 3.38Å; L750-I754 PolarHBondContact O-N 2.9Å
751	L	97.2	Very high	93.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.4	-44	177.1	-83.4	-172.4	0	0	0	113.3	F734 G747 F748 S753 I754 I755 I770 L774 F793	F734-L751 HydrophobicContact CB-CD2 4.44Å; F734-L751 HydrophobicContact CD1-CD2 4.04Å; F734-L751 HydrophobicContact CD2-CD1 3.57Å; F734-L751 HydrophobicContact CD2-CD2 3.79Å; F734-L751 HydrophobicContact CD2-CG 3.37Å; F734-L751 HydrophobicContact CE1-CD1 4.44Å; F734-L751 HydrophobicContact CE1-CD2 4.25Å; F734-L751 HydrophobicContact CE2-CD1 3.11Å; F734-L751 HydrophobicContact CE2-CD2 4Å; F734-L751 HydrophobicContact CE2-CG 3.52Å; F734-L751 HydrophobicContact CG-CD1 4.39Å; F734-L751 HydrophobicContact CG-CD2 3.79Å; F734-L751 HydrophobicContact CG-CG 3.9Å; F734-L751 HydrophobicContact CZ-CD1 3.62Å; F734-L751 HydrophobicContact CZ-CD2 4.23Å; F734-L751 HydrophobicContact CZ-CG 4.18Å; G747-L751 PolarHBondContact O-N 3.41Å; F748-L751 HydrophobicContact CD1-CD1 4.32Å; F748-L751 PolarHBondContact O-N 3.41Å; L751-S753 PolarHBondContact O-N 3.18Å; L751-I754 HydrophobicContact CD2-CD1 4.41Å; L751-I754 PolarHBondContact O-N 3.47Å; L751-I754 VanDerWaalsContact O-N 3.14Å; L751-I755 WeakPolarHBondContact O-CG1 3.41Å; L751-I755 PolarHBondContact O-N 3.4Å; L751-I770 HydrophobicContact CD1-CG2 3.96Å; L751-I770 HydrophobicContact CD2-CD1 4.24Å; L751-I770 HydrophobicContact CD2-CG2 3.87Å; L751-L774 HydrophobicContact CD1-CD1 4.11Å; L751-L774 HydrophobicContact CD1-CD2 4.29Å; L751-F793 HydrophobicContact CB-CD2 3.82Å; L751-F793 HydrophobicContact CB-CE2 3.64Å; L751-F793 HydrophobicContact CB-CZ 4.46Å; L751-F793 HydrophobicContact CD1-CD2 4.15Å; L751-F793 HydrophobicContact CD1-CE1 4.25Å; L751-F793 HydrophobicContact CD1-CE2 3.84Å; L751-F793 HydrophobicContact CD1-CG 4.49Å; L751-F793 HydrophobicContact CD1-CZ 3.9Å; L751-F793 HydrophobicContact CG-CE2 4.24Å
752	N	96.8	Very high	94.1	Very high	23 Å²	23	29.1 Å²	29.1	12%	0.123	15%	0.154	C	C	.	.	H	α-helix	trans	-55.6	-43.4	177.6	-73.8	-13.5	0	0	0	110	F748 L750 I755 E756 F793 L796	F748-N752 WeakPolarHBondContact O-CB 3.39Å; F748-N752 PolarHBondContact O-N 2.96Å; F748-N752 PolarHBondContact O-ND2 2.67Å; F748-N752 PolarHBondContact O-OD1 2.83Å; L750-N752 PolarHBondContact O-N 3.09Å; N752-I755 PolarHBondContact O-N 3.36Å; N752-E756 WeakPolarHBondContact O-CB 3.35Å; N752-E756 PolarHBondContact O-N 3.46Å; N752-F793 WeakPolarHBondContact OD1-CA 3.45Å; N752-F793 WeakPolarHBondContact OD1-CD2 3.5Å; N752-L796 HydrophobicContact CB-CD2 3.63Å
753	S	95.9	Very high	94.5	Very high	4 Å²	4	26.3 Å²	26.3	3%	0.028	13%	0.131	C	C	.	.	H	α-helix	trans	-70.8	-35.5	179.5	-47.8	0	0	0	0	112.5	Q709 Y749 L750 L751 E756 H757	Q709-S753 WeakPolarHBondContact CG-OG 3.45Å; Q709-S753 PolarHBondContact NE2-OG 3.25Å; Y749-S753 PolarHBondContact O-N 3.39Å; Y749-S753 PolarHBondContact O-OG 2.58Å; L750-S753 WeakPolarHBondContact O-CB 3.4Å; L750-S753 PolarHBondContact O-N 3.1Å; L750-S753 VanDerWaalsContact O-N 3.15Å; L751-S753 PolarHBondContact O-N 3.18Å; S753-E756 PolarHBondContact O-N 2.88Å; S753-H757 WeakPolarHBondContact O-CB 3.23Å; S753-H757 PolarHBondContact O-CD2 2.88Å; S753-H757 PolarHBondContact O-N 2.82Å
754	I	96.7	Very high	94.7	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-51	173.8	-69.1	169.3	0	0	0	109.9	L712 L730 L731 L750 L751 E756 M758 V763	L712-I754 HydrophobicContact CD1-CG1 3.68Å; L712-I754 HydrophobicContact CD2-CG1 4.27Å; L730-I754 HydrophobicContact CD2-CD1 3.85Å; L730-I754 HydrophobicContact CD2-CG1 3.93Å; L730-I754 HydrophobicContact CG-CD1 4.05Å; L731-I754 HydrophobicContact CD2-CD1 4.11Å; L750-I754 HydrophobicContact CG-CD1 4.13Å; L750-I754 WeakPolarHBondContact O-CG1 3.38Å; L750-I754 PolarHBondContact O-N 2.9Å; L751-I754 HydrophobicContact CD2-CD1 4.41Å; L751-I754 PolarHBondContact O-N 3.47Å; L751-I754 VanDerWaalsContact O-N 3.14Å; I754-E756 VanDerWaalsContact C-N 3.28Å; I754-E756 PolarHBondContact O-N 2.93Å; I754-M758 HydrophobicContact CG2-CG 4.27Å; I754-M758 VanDerWaalsContact O-CB 3.23Å; I754-M758 WeakPolarHBondContact O-CB 3.48Å; I754-M758 PolarHBondContact O-N 3.45Å; I754-M758 VanDerWaalsContact O-N 3.12Å; I754-V763 HydrophobicContact CG2-CG1 4.12Å; I754-V763 HydrophobicContact CG2-CG2 4.04Å
755	I	95.6	Very high	94.8	Very high	5 Å²	5	36.6 Å²	36.6	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-66.2	-33.4	-179.3	-66.9	-55.4	0	0	0	111.8	L751 N752 F793 Y797 K800 Y801	L751-I755 WeakPolarHBondContact O-CG1 3.41Å; L751-I755 PolarHBondContact O-N 3.4Å; N752-I755 PolarHBondContact O-N 3.36Å; I755-F793 HydrophobicContact CD1-CE2 4.45Å; I755-F793 HydrophobicContact CG1-CE2 3.56Å; I755-F793 HydrophobicContact CG1-CZ 4.13Å; I755-Y797 HydrophobicContact CD1-CD2 4.01Å; I755-Y797 HydrophobicContact CD1-CE2 4.34Å; I755-Y797 HydrophobicContact CG1-CD2 4.46Å; I755-Y797 HydrophobicContact CG2-CD2 4.48Å; I755-K800 HydrophobicContact CG2-CB 4.16Å; I755-K800 HydrophobicContact CG2-CG 4.24Å; I755-Y801 HydrophobicContact CD1-CE2 3.87Å; I755-Y801 HydrophobicContact CG2-CD2 4.26Å; I755-Y801 HydrophobicContact CG2-CE2 3.78Å
756	E	95	Very high	95.1	Very high	32 Å²	32	37.1 Å²	37.1	15%	0.15	18%	0.182	C	C	.	.	H	α-helix	trans	-76.4	-43	-177.8	175.4	162	-154.6	0	0	114.1	N752 S753 I754 K800 H914 P916	N752-E756 WeakPolarHBondContact O-CB 3.35Å; N752-E756 PolarHBondContact O-N 3.46Å; S753-E756 PolarHBondContact O-N 2.88Å; I754-E756 VanDerWaalsContact C-N 3.28Å; I754-E756 PolarHBondContact O-N 2.93Å; E756-K800 IonicContact OE1-NZ 3.34Å; E756-H914 IonicContact OE1-CD2 2.84Å; E756-H914 IonicContact OE1-CE1 2.57Å; E756-H914 IonicContact OE1-NE2 2.76Å; E756-H914 PolarHBondContact OE1-NE2 3.29Å; E756-H914 IonicContact OE2-CD2 3.74Å; E756-H914 PolarHBondContact OE2-CD2 3.48Å; E756-H914 IonicContact OE2-NE2 2.7Å; E756-H914 PolarHBondContact OE2-NE2 3.27Å; E756-P916 WeakPolarHBondContact OE1-CA 3.26Å; E756-P916 WeakPolarHBondContact OE1-CB 3.3Å
757	H	94.9	Very high	95.1	Very high	42 Å²	42	37.5 Å²	37.5	19%	0.194	18%	0.183	C	C	.	.	H	α-helix	trans	-109.2	-25.8	-167.3	-60.4	-63.5	0	0	0	114.9	L712 S716 S753	L712-H757 WeakPolarHBondContact O-CB 3.45Å; S716-H757 WeakPolarHBondContact CB-O 3.36Å; S716-H757 PolarHBondContact OG-O 2.78Å; S753-H757 WeakPolarHBondContact O-CB 3.23Å; S753-H757 PolarHBondContact O-CD2 2.88Å; S753-H757 PolarHBondContact O-N 2.82Å
758	M	95.5	Very high	95.1	Very high	9 Å²	9	42.6 Å²	42.6	4%	0.044	21%	0.205	C	C	.	.	S	Bend	trans	-75.3	141.1	-176.6	-68.2	-68.6	-71.1	0	0	111.9	L712 I719 A720 I727 I754 V763	L712-M758 HydrophobicContact CD2-CG 3.72Å; L712-M758 HydrophobicContact CD2-SD 3.59Å; L712-M758 VanDerWaalsContact CD2-SD 3.59Å; I719-M758 HydrophobicContact CB-CE 4.35Å; I719-M758 HydrophobicContact CB-SD 4.44Å; I719-M758 HydrophobicContact CG2-CE 3.86Å; I719-M758 HydrophobicContact CG2-SD 4.33Å; A720-M758 HydrophobicContact CB-CE 4.16Å; I727-M758 HydrophobicContact CD1-CE 4.02Å; I727-M758 HydrophobicContact CG1-CE 4.32Å; I754-M758 HydrophobicContact CG2-CG 4.27Å; I754-M758 VanDerWaalsContact O-CB 3.23Å; I754-M758 WeakPolarHBondContact O-CB 3.48Å; I754-M758 PolarHBondContact O-N 3.45Å; I754-M758 VanDerWaalsContact O-N 3.12Å; M758-V763 HydrophobicContact CB-CG2 3.55Å; M758-V763 HydrophobicContact CG-CG2 4.21Å
759	P	95	Very high	95	Very high	26 Å²	26	47.3 Å²	47.3	17%	0.169	23%	0.227	C	C	.	.			trans	-54.5	130.8	171.1	-26.1	34.8	0	0	0	111.1	A720 E761 S762	A720-P759 HydrophobicContact CB-CG 3.91Å; P759-E761 WeakPolarHBondContact CB-OE2 3.42Å; P759-E761 PolarHBondContact O-N 3.4Å; P759-E761 VanDerWaalsContact O-N 3.1Å; P759-S762 PolarHBondContact O-N 3.14Å; P759-S762 PolarHBondContact O-OG 3.48Å
760	P	93.3	Very high	95.1	Very high	60 Å²	60	43 Å²	43	39%	0.39	21%	0.211	S	C	.	.	H	α-helix	trans	-49.7	-39.8	-176.3	-32.8	38.2	0	0	0	114.4	S762 V763 D764 R767 Y801	P760-S762 VanDerWaalsContact C-N 3.26Å; P760-S762 PolarHBondContact O-N 3.26Å; P760-V763 PolarHBondContact O-N 3Å; P760-D764 PolarHBondContact O-N 3.43Å; P760-D764 VanDerWaalsContact O-N 3.13Å; P760-R767 PolarHBondContact O-NH2 3.36Å; P760-Y801 HydrophobicContact CB-CE1 3.93Å; P760-Y801 HydrophobicContact CG-CE1 4.03Å
761	E	93.5	Very high	95.2	Very high	149 Å²	149	43.1 Å²	43.1	70%	0.696	21%	0.211	S	C	*	.	H	α-helix	trans	-66	-30.2	-175.8	-50.6	79.8	-171.6	0	0	112	P759	P759-E761 WeakPolarHBondContact CB-OE2 3.42Å; P759-E761 PolarHBondContact O-N 3.4Å; P759-E761 VanDerWaalsContact O-N 3.1Å
762	S	93.3	Very high	95.2	Very high	18 Å²	18	45.2 Å²	45.2	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-76.3	-23.6	-178.4	69.3	0	0	0	0	113.4	P759 P760	P759-S762 PolarHBondContact O-N 3.14Å; P759-S762 PolarHBondContact O-OG 3.48Å; P760-S762 VanDerWaalsContact C-N 3.26Å; P760-S762 PolarHBondContact O-N 3.26Å
763	V	92.6	Very high	95.2	Very high	2 Å²	2	45 Å²	45	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-105	-18.6	-175.8	-174.1	0	0	0	0	112.2	I754 M758 P760 Q765 Y766 R767	I754-V763 HydrophobicContact CG2-CG1 4.12Å; I754-V763 HydrophobicContact CG2-CG2 4.04Å; M758-V763 HydrophobicContact CB-CG2 3.55Å; M758-V763 HydrophobicContact CG-CG2 4.21Å; P760-V763 PolarHBondContact O-N 3Å; V763-Q765 PolarHBondContact O-N 3.42Å; V763-Y766 PolarHBondContact O-N 2.89Å; V763-R767 HydrophobicContact CG1-CG 4.24Å; V763-R767 PolarHBondContact O-N 2.62Å
764	D	92.8	Very high	95.2	Very high	95 Å²	95	44.8 Å²	44.8	51%	0.508	22%	0.219	S	C	.	.	H	α-helix	trans	-51.5	-48.9	-168.1	-166.3	44.5	0	0	0	114	P760 Y766 R767	P760-D764 PolarHBondContact O-N 3.43Å; P760-D764 VanDerWaalsContact O-N 3.13Å; D764-Y766 PolarHBondContact O-N 3.09Å; D764-R767 PolarHBondContact O-N 3.34Å; D764-R767 IonicContact OD1-CZ 3.86Å; D764-R767 IonicContact OD1-NE 2.65Å; D764-R767 IonicContact OD1-NH1 3.42Å; D764-R767 PolarHBondContact OD1-NH1 3.47Å
765	Q	93.9	Very high	95.2	Very high	145 Å²	145	45.5 Å²	45.5	68%	0.678	22%	0.222	S	C	*	.	H	α-helix	trans	-60.2	-19.8	179.3	65.1	-179.9	-30	0	0	114.5	V763	V763-Q765 PolarHBondContact O-N 3.42Å
766	Y	95.4	Very high	95.2	Very high	49 Å²	49	49.9 Å²	49.9	19%	0.192	24%	0.243	C	C	.	.	H	α-helix	trans	-100.3	-16.5	-176.8	-53.9	-67.5	0	0	0	113.7	I727 P728 L731 V763 D764 K768 Q769 I770	I727-Y766 HydrophobicContact CB-CE2 4.29Å; I727-Y766 HydrophobicContact CG2-CD2 3.89Å; I727-Y766 HydrophobicContact CG2-CE2 3.52Å; P728-Y766 HydrophobicContact CG-CE1 4.36Å; L731-Y766 VanDerWaalsContact CD1-CB 3.46Å; L731-Y766 HydrophobicContact CD1-CD1 3.71Å; L731-Y766 HydrophobicContact CD1-CD2 3.8Å; L731-Y766 HydrophobicContact CD1-CE1 4.39Å; L731-Y766 HydrophobicContact CD1-CE2 4.46Å; L731-Y766 HydrophobicContact CD1-CG 3.36Å; V763-Y766 PolarHBondContact O-N 2.89Å; D764-Y766 PolarHBondContact O-N 3.09Å; Y766-K768 VanDerWaalsContact C-N 3.34Å; Y766-K768 PolarHBondContact O-N 3.34Å; Y766-Q769 PolarHBondContact O-N 3.29Å; Y766-I770 WeakPolarHBondContact O-CG1 3.5Å; Y766-I770 PolarHBondContact O-N 3.45Å
767	R	94.6	Very high	95	Very high	28 Å²	28	49.2 Å²	49.2	11%	0.106	24%	0.238	C	C	.	.	H	α-helix	trans	-56.7	-45.5	-171.6	-64.8	175.3	-178.8	160	-0.2	112.6	P760 V763 D764 Q769 I770 F771 Y801 I809	P760-R767 PolarHBondContact O-NH2 3.36Å; V763-R767 HydrophobicContact CG1-CG 4.24Å; V763-R767 PolarHBondContact O-N 2.62Å; D764-R767 PolarHBondContact O-N 3.34Å; D764-R767 IonicContact OD1-CZ 3.86Å; D764-R767 IonicContact OD1-NE 2.65Å; D764-R767 IonicContact OD1-NH1 3.42Å; D764-R767 PolarHBondContact OD1-NH1 3.47Å; R767-Q769 VanDerWaalsContact C-N 3.3Å; R767-Q769 PolarHBondContact O-N 3.12Å; R767-I770 PolarHBondContact O-N 3.22Å; R767-F771 WeakPolarHBondContact O-CD2 3.36Å; R767-F771 PolarHBondContact O-N 3.46Å; R767-Y801 PolarHBondContact NH2-OH 3.45Å; R767-I809 HydrophobicContact CB-CD1 3.51Å
768	K	95.7	Very high	94.9	Very high	107 Å²	107	48 Å²	48	47%	0.465	23%	0.233	S	C	.	.	H	α-helix	trans	-59.8	-42.7	179.1	-172.7	174.1	-175.1	168.2	0	111.3	Y766 F771 I772 G812 I813	Y766-K768 VanDerWaalsContact C-N 3.34Å; Y766-K768 PolarHBondContact O-N 3.34Å; K768-F771 PolarHBondContact O-N 2.99Å; K768-I772 HydrophobicContact CG-CD1 4.12Å; K768-I772 VanDerWaalsContact O-CG1 3.32Å; K768-I772 WeakPolarHBondContact O-CG1 3.28Å; K768-I772 PolarHBondContact O-N 3.21Å; K768-G812 WeakPolarHBondContact CE-O 3.06Å; K768-G812 PolarHBondContact NZ-O 3.45Å; K768-I813 HydrophobicContact CD-CG1 4.44Å; K768-I813 HydrophobicContact CG-CD1 4.34Å; K768-I813 HydrophobicContact CG-CG1 3.76Å
769	Q	96.4	Very high	94.7	Very high	100 Å²	100	55.3 Å²	55.3	47%	0.467	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-37.9	179.6	-173.1	59.6	27.7	0	0	112.3	Y766 R767 F771 I772 L773	Y766-Q769 PolarHBondContact O-N 3.29Å; R767-Q769 VanDerWaalsContact C-N 3.3Å; R767-Q769 PolarHBondContact O-N 3.12Å; Q769-F771 VanDerWaalsContact C-N 3.34Å; Q769-F771 PolarHBondContact O-N 2.76Å; Q769-I772 PolarHBondContact O-N 2.95Å; Q769-L773 HydrophobicContact CG-CD1 4.45Å; Q769-L773 WeakPolarHBondContact O-CG 3.28Å; Q769-L773 PolarHBondContact O-N 3.46Å
770	I	97.3	Very high	94.5	Very high	6 Å²	6	60 Å²	60	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-56.6	-49.8	174.6	-67.7	167.5	0	0	0	110	L731 F734 L751 Y766 R767 L773 L774 F793	L731-I770 HydrophobicContact CD2-CD1 3.78Å; L731-I770 HydrophobicContact CD2-CG1 4.12Å; F734-I770 HydrophobicContact CE1-CG1 4.37Å; F734-I770 HydrophobicContact CE1-CG2 4.12Å; F734-I770 HydrophobicContact CZ-CG2 4.08Å; L751-I770 HydrophobicContact CD1-CG2 3.96Å; L751-I770 HydrophobicContact CD2-CD1 4.24Å; L751-I770 HydrophobicContact CD2-CG2 3.87Å; Y766-I770 WeakPolarHBondContact O-CG1 3.5Å; Y766-I770 PolarHBondContact O-N 3.45Å; R767-I770 PolarHBondContact O-N 3.22Å; I770-L773 PolarHBondContact O-N 3.49Å; I770-L774 HydrophobicContact CG2-CD1 4.1Å; I770-L774 WeakPolarHBondContact O-CG 3.25Å; I770-L774 PolarHBondContact O-N 2.91Å; I770-F793 HydrophobicContact CG2-CZ 4.17Å
771	F	97.8	Very high	94.2	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-66.1	-39.4	179.2	-78.8	-65.1	0	0	0	113.2	R767 K768 Q769 L773 L774 F775 F793 I794 Y797 L806 I809 F810 I813	R767-F771 WeakPolarHBondContact O-CD2 3.36Å; R767-F771 PolarHBondContact O-N 3.46Å; K768-F771 PolarHBondContact O-N 2.99Å; Q769-F771 VanDerWaalsContact C-N 3.34Å; Q769-F771 PolarHBondContact O-N 2.76Å; F771-L773 VanDerWaalsContact C-N 3.29Å; F771-L773 PolarHBondContact O-N 2.99Å; F771-L774 HydrophobicContact CD1-CD1 4.28Å; F771-L774 PolarHBondContact O-N 3.31Å; F771-F775 HydrophobicContact CB-CD2 4.29Å; F771-F775 HydrophobicContact CB-CE2 3.95Å; F771-F775 HydrophobicContact CD1-CE2 4.41Å; F771-F775 HydrophobicContact CD1-CZ 4.46Å; F771-F775 WeakPolarHBondContact O-CD2 3.42Å; F771-F775 WeakPolarHBondContact O-CG 3.32Å; F771-F775 PolarHBondContact O-N 3.02Å; F771-F793 HydrophobicContact CD1-CE1 4.37Å; F771-F793 HydrophobicContact CE1-CD1 4.33Å; F771-F793 AromaticContact CE1-CE1 3.61Å; F771-F793 HydrophobicContact CE1-CE1 3.61Å; F771-F793 AromaticContact CZ-CE1 3.85Å; F771-F793 HydrophobicContact CZ-CE1 3.85Å; F771-F793 HydrophobicContact CZ-CZ 4.36Å; F771-I794 HydrophobicContact CE1-CG2 4.09Å; F771-Y797 AromaticContact CE2-CD2 3.96Å; F771-Y797 HydrophobicContact CE2-CD2 3.96Å; F771-Y797 HydrophobicContact CE2-CE1 4.37Å; F771-Y797 AromaticContact CE2-CE2 3.74Å; F771-Y797 HydrophobicContact CE2-CE2 3.74Å; F771-Y797 HydrophobicContact CE2-CG 4.38Å; F771-Y797 AromaticContact CE2-CZ 3.97Å; F771-Y797 HydrophobicContact CZ-CD1 4.26Å; F771-Y797 AromaticContact CZ-CD2 3.87Å; F771-Y797 HydrophobicContact CZ-CD2 3.87Å; F771-Y797 HydrophobicContact CZ-CE1 4.49Å; F771-Y797 HydrophobicContact CZ-CE2 4.14Å; F771-Y797 AromaticContact CZ-CG 3.95Å; F771-Y797 HydrophobicContact CZ-CG 3.95Å; F771-L806 HydrophobicContact CE1-CD1 4.42Å; F771-L806 HydrophobicContact CZ-CD1 4.03Å; F771-I809 HydrophobicContact CD2-CD1 3.57Å; F771-I809 HydrophobicContact CD2-CG1 3.95Å; F771-I809 HydrophobicContact CD2-CG2 4.03Å; F771-I809 HydrophobicContact CE2-CD1 3.81Å; F771-I809 HydrophobicContact CE2-CG1 4.39Å; F771-I809 HydrophobicContact CE2-CG2 3.84Å; F771-F810 HydrophobicContact CD1-CD1 4.32Å; F771-F810 AromaticContact CD1-CE1 3.45Å; F771-F810 HydrophobicContact CD1-CE1 3.45Å; F771-F810 VanDerWaalsContact CD1-CE1 3.45Å; F771-F810 HydrophobicContact CD1-CZ 4.18Å; F771-F810 HydrophobicContact CD2-CE1 4.44Å; F771-F810 AromaticContact CE1-CE1 3.41Å; F771-F810 HydrophobicContact CE1-CE1 3.41Å; F771-F810 VanDerWaalsContact CE1-CE1 3.41Å; F771-F810 AromaticContact CE1-CZ 3.93Å; F771-F810 HydrophobicContact CE1-CZ 3.93Å; F771-F810 HydrophobicContact CE2-CE1 4.39Å; F771-F810 HydrophobicContact CG-CD1 4.49Å; F771-F810 AromaticContact CG-CE1 4Å; F771-F810 HydrophobicContact CG-CE1 4Å; F771-F810 AromaticContact CZ-CE1 3.9Å; F771-F810 HydrophobicContact CZ-CE1 3.9Å; F771-I813 HydrophobicContact CB-CD1 3.5Å
772	I	97	Very high	93.7	Very high	43 Å²	43	58.2 Å²	58.2	22%	0.221	28%	0.281	C	S	.	.	H	α-helix	trans	-55.9	-46	174	-71.4	167.5	0	0	0	110.7	K768 Q769 F775 Q776 I813	K768-I772 HydrophobicContact CG-CD1 4.12Å; K768-I772 VanDerWaalsContact O-CG1 3.32Å; K768-I772 WeakPolarHBondContact O-CG1 3.28Å; K768-I772 PolarHBondContact O-N 3.21Å; Q769-I772 PolarHBondContact O-N 2.95Å; I772-F775 PolarHBondContact O-N 3.24Å; I772-Q776 HydrophobicContact CG2-CG 4.45Å; I772-Q776 WeakPolarHBondContact O-CB 3.46Å; I772-Q776 VanDerWaalsContact O-CG 3.27Å; I772-Q776 WeakPolarHBondContact O-CG 3.45Å; I772-Q776 PolarHBondContact O-N 3.16Å; I772-I813 HydrophobicContact CG1-CD1 4.03Å; I772-I813 HydrophobicContact CG1-CG1 4.05Å; I772-I813 HydrophobicContact CG1-CG2 3.91Å
773	L	96.3	Very high	93.4	Very high	19 Å²	19	58.9 Å²	58.9	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-42.8	178.6	-69.6	170.5	0	0	0	112.3	F734 Q735 I738 Q769 I770 F771 Q776 R777	F734-L773 HydrophobicContact CE1-CD1 4.09Å; Q735-L773 HydrophobicContact CB-CD1 4.22Å; Q735-L773 HydrophobicContact CG-CD1 3.94Å; Q735-L773 HydrophobicContact CG-CD2 4.22Å; I738-L773 HydrophobicContact CD1-CB 4.1Å; Q769-L773 HydrophobicContact CG-CD1 4.45Å; Q769-L773 WeakPolarHBondContact O-CG 3.28Å; Q769-L773 PolarHBondContact O-N 3.46Å; I770-L773 PolarHBondContact O-N 3.49Å; F771-L773 VanDerWaalsContact C-N 3.29Å; F771-L773 PolarHBondContact O-N 2.99Å; L773-Q776 PolarHBondContact O-N 3.47Å; L773-R777 WeakPolarHBondContact O-CB 3.41Å; L773-R777 PolarHBondContact O-N 3.31Å
774	L	97.2	Very high	93.2	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-43.3	176.7	-68.3	174.5	0	0	0	111.8	F734 I738 F748 L751 I770 F771 R777 L778 F786 F790 F793	F734-L774 HydrophobicContact CE2-CD2 3.91Å; F734-L774 HydrophobicContact CZ-CD2 3.89Å; F734-L774 HydrophobicContact CZ-CG 4.1Å; I738-L774 HydrophobicContact CD1-CD2 4.2Å; I738-L774 HydrophobicContact CG2-CD2 4.34Å; F748-L774 HydrophobicContact CE1-CD1 4.28Å; F748-L774 HydrophobicContact CE1-CD2 3.61Å; F748-L774 HydrophobicContact CZ-CD2 3.59Å; L751-L774 HydrophobicContact CD1-CD1 4.11Å; L751-L774 HydrophobicContact CD1-CD2 4.29Å; I770-L774 HydrophobicContact CG2-CD1 4.1Å; I770-L774 WeakPolarHBondContact O-CG 3.25Å; I770-L774 PolarHBondContact O-N 2.91Å; F771-L774 HydrophobicContact CD1-CD1 4.28Å; F771-L774 PolarHBondContact O-N 3.31Å; L774-R777 PolarHBondContact O-N 2.86Å; L774-L778 WeakPolarHBondContact O-CB 3.42Å; L774-L778 PolarHBondContact O-N 2.92Å; L774-F786 HydrophobicContact CD2-CE2 4.42Å; L774-F786 HydrophobicContact CD2-CZ 4.05Å; L774-F790 HydrophobicContact CB-CD2 4.21Å; L774-F790 HydrophobicContact CB-CE2 3.95Å; L774-F790 HydrophobicContact CD1-CD2 4.13Å; L774-F790 HydrophobicContact CD1-CE2 4.04Å; L774-F793 HydrophobicContact CD1-CD1 3.7Å; L774-F793 HydrophobicContact CD1-CE1 3.41Å; L774-F793 VanDerWaalsContact CD1-CE1 3.41Å; L774-F793 HydrophobicContact CD1-CZ 4.31Å
775	F	96.5	Very high	93	Very high	19 Å²	19	59.7 Å²	59.7	8%	0.083	29%	0.287	C	S	.	.	H	α-helix	trans	-68.1	-40.4	178	-68	-47.7	0	0	0	112.7	F771 I772 R777 L778 Q779 F790 F810 I813 M817 V821	F771-F775 HydrophobicContact CB-CD2 4.29Å; F771-F775 HydrophobicContact CB-CE2 3.95Å; F771-F775 HydrophobicContact CD1-CE2 4.41Å; F771-F775 HydrophobicContact CD1-CZ 4.46Å; F771-F775 WeakPolarHBondContact O-CD2 3.42Å; F771-F775 WeakPolarHBondContact O-CG 3.32Å; F771-F775 PolarHBondContact O-N 3.02Å; I772-F775 PolarHBondContact O-N 3.24Å; F775-R777 VanDerWaalsContact C-N 3.29Å; F775-R777 PolarHBondContact O-N 3.05Å; F775-L778 HydrophobicContact CD1-CD2 4.43Å; F775-L778 PolarHBondContact O-N 3.07Å; F775-Q779 WeakPolarHBondContact O-CB 3.43Å; F775-Q779 PolarHBondContact O-N 3.33Å; F775-F790 HydrophobicContact CD1-CZ 4.27Å; F775-F790 HydrophobicContact CE1-CE1 4.49Å; F775-F790 HydrophobicContact CE1-CE2 4.38Å; F775-F790 AromaticContact CE1-CZ 3.65Å; F775-F790 HydrophobicContact CE1-CZ 3.65Å; F775-F790 HydrophobicContact CZ-CZ 4.35Å; F775-F810 HydrophobicContact CE1-CZ 4.48Å; F775-F810 HydrophobicContact CE2-CD1 4.01Å; F775-F810 HydrophobicContact CE2-CE1 4.17Å; F775-F810 HydrophobicContact CE2-CG 4.43Å; F775-F810 AromaticContact CZ-CD1 3.74Å; F775-F810 HydrophobicContact CZ-CD1 3.74Å; F775-F810 HydrophobicContact CZ-CD2 4.06Å; F775-F810 AromaticContact CZ-CE1 3.65Å; F775-F810 HydrophobicContact CZ-CE1 3.65Å; F775-F810 AromaticContact CZ-CE2 3.96Å; F775-F810 HydrophobicContact CZ-CE2 3.96Å; F775-F810 AromaticContact CZ-CG 3.97Å; F775-F810 HydrophobicContact CZ-CG 3.97Å; F775-F810 AromaticContact CZ-CZ 3.75Å; F775-F810 HydrophobicContact CZ-CZ 3.75Å; F775-I813 HydrophobicContact CD2-CD1 4.28Å; F775-I813 HydrophobicContact CE2-CD1 4.03Å; F775-M817 HydrophobicContact CD2-CE 4.18Å; F775-M817 HydrophobicContact CD2-SD 3.58Å; F775-M817 VanDerWaalsContact CD2-SD 3.58Å; F775-M817 HydrophobicContact CE2-CG 4.3Å; F775-M817 HydrophobicContact CE2-SD 3.41Å; F775-M817 WeakPolarHBondContact CE2-SD 3.36Å; F775-M817 HydrophobicContact CG-CE 4.47Å; F775-M817 HydrophobicContact CG-SD 4.28Å; F775-M817 HydrophobicContact CZ-CG 4.3Å; F775-M817 HydrophobicContact CZ-SD 3.99Å; F775-V821 HydrophobicContact CD1-CG2 4.41Å; F775-V821 HydrophobicContact CE1-CG2 3.51Å; F775-V821 HydrophobicContact CZ-CG2 3.94Å
776	Q	94.9	Very high	92.9	Very high	97 Å²	97	52.8 Å²	52.8	45%	0.453	26%	0.255	S	S	.	.	H	α-helix	trans	-58.4	-43.7	172.8	-75.6	174	-7	0	0	111.1	I772 L773 Q779 N780	I772-Q776 HydrophobicContact CG2-CG 4.45Å; I772-Q776 WeakPolarHBondContact O-CB 3.46Å; I772-Q776 VanDerWaalsContact O-CG 3.27Å; I772-Q776 WeakPolarHBondContact O-CG 3.45Å; I772-Q776 PolarHBondContact O-N 3.16Å; L773-Q776 PolarHBondContact O-N 3.47Å; Q776-Q779 PolarHBondContact O-N 3.03Å; Q776-N780 WeakPolarHBondContact O-CB 3.28Å; Q776-N780 VanDerWaalsContact O-CG 3.24Å; Q776-N780 PolarHBondContact O-N 3.14Å; Q776-N780 PolarHBondContact O-ND2 3.37Å
777	R	92	Very high	92.8	Very high	17 Å²	17	50.8 Å²	50.8	6%	0.064	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-40.3	177.9	-173.4	61.1	176.6	75.2	9.2	112.4	I738 K741 D744 L773 L774 F775 Q779 S781 F786	I738-R777 WeakPolarHBondContact O-CD 2.85Å; I738-R777 PolarHBondContact O-NE 2.69Å; K741-R777 VanDerWaalsContact CG-NH2 3.33Å; D744-R777 IonicContact OD2-NH2 3.19Å; L773-R777 WeakPolarHBondContact O-CB 3.41Å; L773-R777 PolarHBondContact O-N 3.31Å; L774-R777 PolarHBondContact O-N 2.86Å; F775-R777 VanDerWaalsContact C-N 3.29Å; F775-R777 PolarHBondContact O-N 3.05Å; R777-Q779 VanDerWaalsContact C-N 3.35Å; R777-S781 PolarHBondContact NH1-O 2.75Å; R777-S781 PolarHBondContact NH1-OG 2.9Å; R777-S781 PolarHBondContact O-N 3.44Å; R777-S781 VanDerWaalsContact O-N 3.08Å; R777-F786 HydrophobicContact CB-CE2 3.91Å; R777-F786 HydrophobicContact CB-CZ 3.77Å; R777-F786 HydrophobicContact CG-CD2 3.9Å; R777-F786 HydrophobicContact CG-CE1 4.5Å; R777-F786 HydrophobicContact CG-CE2 3.33Å; R777-F786 HydrophobicContact CG-CZ 3.68Å
778	L	92.3	Very high	92.8	Very high	17 Å²	17	51.1 Å²	51.1	9%	0.089	25%	0.25	C	C	.	.	H	α-helix	trans	-63.9	-37.8	175.9	-171	67.1	0	0	0	112.4	L774 F775 K782 F786 I787 F790 I825	L774-L778 WeakPolarHBondContact O-CB 3.42Å; L774-L778 PolarHBondContact O-N 2.92Å; F775-L778 HydrophobicContact CD1-CD2 4.43Å; F775-L778 PolarHBondContact O-N 3.07Å; L778-K782 HydrophobicContact CD1-CB 4.04Å; L778-K782 WeakPolarHBondContact O-CB 3.38Å; L778-F786 HydrophobicContact CB-CE1 4.02Å; L778-F786 HydrophobicContact CD1-CD1 4.03Å; L778-F786 HydrophobicContact CD1-CE1 3.98Å; L778-I787 HydrophobicContact CD1-CG1 4.09Å; L778-F790 HydrophobicContact CD2-CE1 4.4Å; L778-I825 HydrophobicContact CD1-CD1 4.22Å; L778-I825 HydrophobicContact CD2-CD1 3.79Å; L778-I825 HydrophobicContact CD2-CG1 3.94Å; L778-I825 HydrophobicContact CG-CD1 4.24Å
779	Q	91.4	Very high	92.8	Very high	163 Å²	163	46.9 Å²	46.9	76%	0.762	23%	0.234	S	C	*	.	H	α-helix	trans	-74	-41.1	178.4	-175.7	174.9	0.6	0	0	112.4	F775 Q776 R777	F775-Q779 WeakPolarHBondContact O-CB 3.43Å; F775-Q779 PolarHBondContact O-N 3.33Å; Q776-Q779 PolarHBondContact O-N 3.03Å; R777-Q779 VanDerWaalsContact C-N 3.35Å
780	N	89.8	Confident	92.8	Very high	125 Å²	125	42.1 Å²	42.1	67%	0.668	21%	0.212	S	C	*	.	H	α-helix	trans	-86.7	-32.4	-170	-67.3	-22.4	0	0	0	113.9	Q776	Q776-N780 WeakPolarHBondContact O-CB 3.28Å; Q776-N780 VanDerWaalsContact O-CG 3.24Å; Q776-N780 PolarHBondContact O-N 3.14Å; Q776-N780 PolarHBondContact O-ND2 3.37Å
781	S	87.4	Confident	92.8	Very high	44 Å²	44	41.9 Å²	41.9	31%	0.308	21%	0.21	S	C	.	.	H	α-helix	trans	-158.5	32.9	-168	43.6	0	0	0	0	115.9	R777 T783	R777-S781 PolarHBondContact NH1-O 2.75Å; R777-S781 PolarHBondContact NH1-OG 2.9Å; R777-S781 PolarHBondContact O-N 3.44Å; R777-S781 VanDerWaalsContact O-N 3.08Å; S781-T783 PolarHBondContact O-N 3.04Å
782	K	84.1	Confident	92.8	Very high	127 Å²	127	42.2 Å²	42.2	55%	0.552	21%	0.213	S	C	*	.			trans	-48.7	137.4	-175.3	65.5	-173.7	-173.7	171.7	0	114.5	L778 I787	L778-K782 HydrophobicContact CD1-CB 4.04Å; L778-K782 WeakPolarHBondContact O-CB 3.38Å; K782-I787 HydrophobicContact CB-CD1 4.39Å; K782-I787 HydrophobicContact CB-CG1 4.45Å; K782-I787 HydrophobicContact CD-CD1 4.2Å
783	T	86.7	Confident	92.8	Very high	32 Å²	32	40.2 Å²	40.2	20%	0.196	20%	0.203	C	C	.	.			trans	-116	159.3	168.7	68	0	0	0	0	109.1	K741 D744 S781 K785 F786 I787	K741-T783 HydrophobicContact CB-CG2 4.09Å; K741-T783 HydrophobicContact CD-CG2 4Å; K741-T783 HydrophobicContact CG-CG2 3.8Å; D744-T783 PolarHBondContact OD2-OG1 3.5Å; D744-T783 VanDerWaalsContact OD2-OG1 3.13Å; S781-T783 PolarHBondContact O-N 3.04Å; T783-K785 VanDerWaalsContact C-N 3.29Å; T783-K785 PolarHBondContact O-N 2.93Å; T783-F786 WeakPolarHBondContact O-CB 3.47Å; T783-F786 PolarHBondContact O-N 3.21Å; T783-F786 WeakPolarHBondContact OG1-CB 3.47Å; T783-F786 PolarHBondContact OG1-N 3.15Å; T783-I787 WeakPolarHBondContact O-CG1 3.48Å; T783-I787 PolarHBondContact O-N 3.29Å
784	T	87.3	Confident	92.9	Very high	56 Å²	56	39.3 Å²	39.3	34%	0.344	20%	0.198	S	C	.	.	H	α-helix	trans	-59.9	-42.2	176.3	-51.8	0	0	0	0	111.5	F786 I787 K788 K832 I884	T784-F786 PolarHBondContact O-N 3.05Å; T784-I787 PolarHBondContact O-N 3.1Å; T784-K788 WeakPolarHBondContact O-CG 3.41Å; T784-K788 PolarHBondContact O-N 3.1Å; T784-K832 HydrophobicContact CG2-CD 4.12Å; T784-I884 HydrophobicContact CG2-CD1 3.6Å
785	K	88.5	Confident	93	Very high	57 Å²	57	39.3 Å²	39.3	25%	0.248	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-43.3	175.1	-175.6	171.2	65.3	-177.3	0	112.8	K741 A742 D744 H745 T783 I787 K788 S789	K741-K785 PolarHBondContact O-NZ 2.88Å; A742-K785 PolarHBondContact O-NZ 3.26Å; D744-K785 WeakPolarHBondContact OD1-CE 3.42Å; H745-K785 HydrophobicContact CB-CD 4.01Å; H745-K785 HydrophobicContact CB-CG 4.02Å; H745-K785 PolarHBondContact ND1-NZ 3.16Å; T783-K785 VanDerWaalsContact C-N 3.29Å; T783-K785 PolarHBondContact O-N 2.93Å; K785-I787 VanDerWaalsContact C-N 3.34Å; K785-I787 PolarHBondContact O-N 3.39Å; K785-K788 PolarHBondContact O-N 3.32Å; K785-S789 WeakPolarHBondContact O-CB 3.26Å; K785-S789 PolarHBondContact O-N 3.08Å; K785-S789 PolarHBondContact O-OG 2.81Å
786	F	92.9	Very high	93	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-45.8	174	-175.1	-84.9	0	0	0	111.1	I738 D744 F748 L774 R777 L778 T783 T784 S789 F790	I738-F786 HydrophobicContact CB-CE2 4.37Å; D744-F786 HydrophobicContact CB-CD2 3.89Å; F748-F786 AromaticContact CE2-CD2 3.67Å; F748-F786 HydrophobicContact CE2-CD2 3.67Å; F748-F786 AromaticContact CE2-CE2 3.63Å; F748-F786 HydrophobicContact CE2-CE2 3.63Å; F748-F786 HydrophobicContact CE2-CG 4.15Å; F748-F786 HydrophobicContact CE2-CZ 4.12Å; F748-F786 HydrophobicContact CZ-CD2 4.2Å; F748-F786 HydrophobicContact CZ-CE1 4.22Å; F748-F786 AromaticContact CZ-CE2 3.78Å; F748-F786 HydrophobicContact CZ-CE2 3.78Å; F748-F786 AromaticContact CZ-CZ 3.8Å; F748-F786 HydrophobicContact CZ-CZ 3.8Å; L774-F786 HydrophobicContact CD2-CE2 4.42Å; L774-F786 HydrophobicContact CD2-CZ 4.05Å; R777-F786 HydrophobicContact CB-CE2 3.91Å; R777-F786 HydrophobicContact CB-CZ 3.77Å; R777-F786 HydrophobicContact CG-CD2 3.9Å; R777-F786 HydrophobicContact CG-CE1 4.5Å; R777-F786 HydrophobicContact CG-CE2 3.33Å; R777-F786 HydrophobicContact CG-CZ 3.68Å; L778-F786 HydrophobicContact CB-CE1 4.02Å; L778-F786 HydrophobicContact CD1-CD1 4.03Å; L778-F786 HydrophobicContact CD1-CE1 3.98Å; T783-F786 WeakPolarHBondContact O-CB 3.47Å; T783-F786 PolarHBondContact O-N 3.21Å; T783-F786 WeakPolarHBondContact OG1-CB 3.47Å; T783-F786 PolarHBondContact OG1-N 3.15Å; T784-F786 PolarHBondContact O-N 3.05Å; F786-S789 PolarHBondContact O-N 3.41Å; F786-F790 HydrophobicContact CD1-CB 4.45Å; F786-F790 HydrophobicContact CE1-CB 4.28Å; F786-F790 WeakPolarHBondContact O-CB 3.43Å; F786-F790 PolarHBondContact O-N 2.91Å
787	I	93.8	Very high	93.1	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.041	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-49.5	-179.8	-66.8	168.1	0	0	0	110.6	L778 K782 T783 T784 K785 S789 F790 L791 I825 E829	L778-I787 HydrophobicContact CD1-CG1 4.09Å; K782-I787 HydrophobicContact CB-CD1 4.39Å; K782-I787 HydrophobicContact CB-CG1 4.45Å; K782-I787 HydrophobicContact CD-CD1 4.2Å; T783-I787 WeakPolarHBondContact O-CG1 3.48Å; T783-I787 PolarHBondContact O-N 3.29Å; T784-I787 PolarHBondContact O-N 3.1Å; K785-I787 VanDerWaalsContact C-N 3.34Å; K785-I787 PolarHBondContact O-N 3.39Å; I787-S789 VanDerWaalsContact C-N 3.32Å; I787-S789 PolarHBondContact O-N 3.43Å; I787-F790 PolarHBondContact O-N 3.03Å; I787-L791 HydrophobicContact CG2-CD1 3.89Å; I787-L791 HydrophobicContact CG2-CG 4.37Å; I787-L791 VanDerWaalsContact O-CG 3.22Å; I787-L791 WeakPolarHBondContact O-CG 3.44Å; I787-L791 PolarHBondContact O-N 3.42Å; I787-I825 HydrophobicContact CG2-CG2 4.48Å; I787-E829 HydrophobicContact CG2-CB 3.53Å; I787-E829 HydrophobicContact CG2-CG 3.81Å
788	K	93.2	Very high	93.4	Very high	34 Å²	34	33.4 Å²	33.4	15%	0.148	17%	0.171	C	C	.	.	H	α-helix	trans	-54.8	-49.3	176.7	-67.1	-175.3	-169.7	-157	0	111.1	T784 K785 F790 L791 V792 K832	T784-K788 WeakPolarHBondContact O-CG 3.41Å; T784-K788 PolarHBondContact O-N 3.1Å; K785-K788 PolarHBondContact O-N 3.32Å; K788-F790 PolarHBondContact O-N 3.48Å; K788-L791 WeakPolarHBondContact O-CB 3.2Å; K788-L791 PolarHBondContact O-N 2.97Å; K788-V792 WeakPolarHBondContact O-CG2 3.39Å; K788-V792 PolarHBondContact O-N 3.26Å; K788-V792 VanDerWaalsContact O-N 3.09Å; K788-K832 WeakPolarHBondContact CD-O 3.48Å; K788-K832 WeakPolarHBondContact CE-O 3.43Å; K788-K832 HydrophobicContact CG-CB 4.29Å; K788-K832 PolarHBondContact NZ-O 2.93Å
789	S	95.1	Very high	93.6	Very high	19 Å²	19	33.8 Å²	33.8	13%	0.133	17%	0.173	C	C	.	.	H	α-helix	trans	-66.1	-38.5	-179.1	-54.7	0	0	0	0	112.7	F748 K785 F786 I787 V792 F793	F748-S789 VanDerWaalsContact CG-CB 3.46Å; K785-S789 WeakPolarHBondContact O-CB 3.26Å; K785-S789 PolarHBondContact O-N 3.08Å; K785-S789 PolarHBondContact O-OG 2.81Å; F786-S789 PolarHBondContact O-N 3.41Å; I787-S789 VanDerWaalsContact C-N 3.32Å; I787-S789 PolarHBondContact O-N 3.43Å; S789-V792 PolarHBondContact O-N 2.82Å; S789-F793 WeakPolarHBondContact O-CB 3.4Å; S789-F793 PolarHBondContact O-N 3.3Å
790	F	97.3	Very high	93.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.2	-44.3	174	179.7	-107.2	0	0	0	111.5	F748 L774 F775 L778 F786 I787 K788 V792 F793 I794 V821 I825	F748-F790 HydrophobicContact CE1-CB 4.05Å; F748-F790 HydrophobicContact CE1-CD2 4.16Å; F748-F790 HydrophobicContact CZ-CB 3.71Å; F748-F790 HydrophobicContact CZ-CD2 4.19Å; F748-F790 HydrophobicContact CZ-CG 4.47Å; L774-F790 HydrophobicContact CB-CD2 4.21Å; L774-F790 HydrophobicContact CB-CE2 3.95Å; L774-F790 HydrophobicContact CD1-CD2 4.13Å; L774-F790 HydrophobicContact CD1-CE2 4.04Å; F775-F790 HydrophobicContact CD1-CZ 4.27Å; F775-F790 HydrophobicContact CE1-CE1 4.49Å; F775-F790 HydrophobicContact CE1-CE2 4.38Å; F775-F790 AromaticContact CE1-CZ 3.65Å; F775-F790 HydrophobicContact CE1-CZ 3.65Å; F775-F790 HydrophobicContact CZ-CZ 4.35Å; L778-F790 HydrophobicContact CD2-CE1 4.4Å; F786-F790 HydrophobicContact CD1-CB 4.45Å; F786-F790 HydrophobicContact CE1-CB 4.28Å; F786-F790 WeakPolarHBondContact O-CB 3.43Å; F786-F790 PolarHBondContact O-N 2.91Å; I787-F790 PolarHBondContact O-N 3.03Å; K788-F790 PolarHBondContact O-N 3.48Å; F790-V792 PolarHBondContact O-N 3.49Å; F790-F793 PolarHBondContact O-N 3.05Å; F790-I794 HydrophobicContact CD1-CD1 4.27Å; F790-I794 HydrophobicContact CD1-CG2 4.31Å; F790-I794 HydrophobicContact CD2-CG2 4.03Å; F790-I794 HydrophobicContact CE1-CD1 3.94Å; F790-I794 HydrophobicContact CE1-CG2 3.9Å; F790-I794 HydrophobicContact CE2-CG2 3.58Å; F790-I794 HydrophobicContact CG-CG2 4.37Å; F790-I794 HydrophobicContact CZ-CD1 4.49Å; F790-I794 HydrophobicContact CZ-CG2 3.51Å; F790-I794 WeakPolarHBondContact O-CG1 3.44Å; F790-I794 WeakPolarHBondContact O-CG2 3.17Å; F790-I794 PolarHBondContact O-N 2.88Å; F790-V821 HydrophobicContact CE1-CG1 4.17Å; F790-I825 HydrophobicContact CD1-CG2 4.2Å; F790-I825 HydrophobicContact CE1-CG2 4.33Å
791	L	97.6	Very high	94	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.3	-42.9	177.1	-68.5	166.7	0	0	0	111.8	I787 K788 I794 N795 I825 I826 E829 I830 V833	I787-L791 HydrophobicContact CG2-CD1 3.89Å; I787-L791 HydrophobicContact CG2-CG 4.37Å; I787-L791 VanDerWaalsContact O-CG 3.22Å; I787-L791 WeakPolarHBondContact O-CG 3.44Å; I787-L791 PolarHBondContact O-N 3.42Å; K788-L791 WeakPolarHBondContact O-CB 3.2Å; K788-L791 PolarHBondContact O-N 2.97Å; L791-I794 HydrophobicContact CD2-CD1 4.24Å; L791-I794 WeakPolarHBondContact O-CG1 3.46Å; L791-N795 WeakPolarHBondContact O-CB 3.34Å; L791-N795 PolarHBondContact O-N 3.44Å; L791-N795 PolarHBondContact O-ND2 2.83Å; L791-I825 HydrophobicContact CD2-CG2 4.2Å; L791-I826 HydrophobicContact CD2-CB 4.25Å; L791-I826 HydrophobicContact CD2-CG1 3.83Å; L791-E829 HydrophobicContact CD1-CB 4.01Å; L791-I830 HydrophobicContact CB-CD1 4.24Å; L791-I830 HydrophobicContact CD1-CD1 4.3Å; L791-I830 HydrophobicContact CD2-CD1 4.41Å; L791-V833 HydrophobicContact CB-CG2 4.04Å; L791-V833 HydrophobicContact CD1-CG2 3.9Å
792	V	97.3	Very high	94.5	Very high	10 Å²	10	25.1 Å²	25.1	6%	0.061	13%	0.125	C	C	.	.	H	α-helix	trans	-62.1	-47.4	174.5	175.4	0	0	0	0	110.4	K788 S789 F790 N795 L796 V833 E838 I841	K788-V792 WeakPolarHBondContact O-CG2 3.39Å; K788-V792 PolarHBondContact O-N 3.26Å; K788-V792 VanDerWaalsContact O-N 3.09Å; S789-V792 PolarHBondContact O-N 2.82Å; F790-V792 PolarHBondContact O-N 3.49Å; V792-N795 PolarHBondContact O-N 3.36Å; V792-L796 WeakPolarHBondContact O-CB 3.18Å; V792-L796 PolarHBondContact O-N 3Å; V792-V833 HydrophobicContact CG2-CG1 4.09Å; V792-E838 HydrophobicContact CG1-CG 4.45Å; V792-E838 HydrophobicContact CG2-CB 3.71Å; V792-E838 HydrophobicContact CG2-CG 3.86Å; V792-I841 HydrophobicContact CG1-CB 4.47Å; V792-I841 HydrophobicContact CG1-CD1 3.95Å; V792-I841 HydrophobicContact CG1-CG2 4.1Å; V792-I841 WeakPolarHBondContact O-CG2 3.4Å
793	F	98.1	Very high	95.1	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-61	-48.5	-178.6	170.4	-104.7	0	0	0	113.5	F748 L751 N752 I755 I770 F771 L774 S789 F790 N795 L796 Y797	F748-F793 HydrophobicContact CD1-CB 3.65Å; F748-F793 HydrophobicContact CD1-CG 4.06Å; F748-F793 HydrophobicContact CE1-CB 3.95Å; F748-F793 HydrophobicContact CE1-CD1 4.3Å; F748-F793 HydrophobicContact CE1-CG 4.23Å; L751-F793 HydrophobicContact CB-CD2 3.82Å; L751-F793 HydrophobicContact CB-CE2 3.64Å; L751-F793 HydrophobicContact CB-CZ 4.46Å; L751-F793 HydrophobicContact CD1-CD2 4.15Å; L751-F793 HydrophobicContact CD1-CE1 4.25Å; L751-F793 HydrophobicContact CD1-CE2 3.84Å; L751-F793 HydrophobicContact CD1-CG 4.49Å; L751-F793 HydrophobicContact CD1-CZ 3.9Å; L751-F793 HydrophobicContact CG-CE2 4.24Å; N752-F793 WeakPolarHBondContact OD1-CA 3.45Å; N752-F793 WeakPolarHBondContact OD1-CD2 3.5Å; I755-F793 HydrophobicContact CD1-CE2 4.45Å; I755-F793 HydrophobicContact CG1-CE2 3.56Å; I755-F793 HydrophobicContact CG1-CZ 4.13Å; I770-F793 HydrophobicContact CG2-CZ 4.17Å; F771-F793 HydrophobicContact CD1-CE1 4.37Å; F771-F793 HydrophobicContact CE1-CD1 4.33Å; F771-F793 AromaticContact CE1-CE1 3.61Å; F771-F793 HydrophobicContact CE1-CE1 3.61Å; F771-F793 AromaticContact CZ-CE1 3.85Å; F771-F793 HydrophobicContact CZ-CE1 3.85Å; F771-F793 HydrophobicContact CZ-CZ 4.36Å; L774-F793 HydrophobicContact CD1-CD1 3.7Å; L774-F793 HydrophobicContact CD1-CE1 3.41Å; L774-F793 VanDerWaalsContact CD1-CE1 3.41Å; L774-F793 HydrophobicContact CD1-CZ 4.31Å; S789-F793 WeakPolarHBondContact O-CB 3.4Å; S789-F793 PolarHBondContact O-N 3.3Å; F790-F793 PolarHBondContact O-N 3.05Å; F793-N795 VanDerWaalsContact C-N 3.3Å; F793-N795 PolarHBondContact O-N 3Å; F793-L796 PolarHBondContact O-N 3.42Å; F793-Y797 WeakPolarHBondContact O-CB 3.44Å; F793-Y797 PolarHBondContact O-N 2.62Å
794	I	97.8	Very high	95.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.6	-34	-178.7	67	-174	0	0	0	111.9	F771 F790 L791 Y797 C798 L806 F810 I826	F771-I794 HydrophobicContact CE1-CG2 4.09Å; F790-I794 HydrophobicContact CD1-CD1 4.27Å; F790-I794 HydrophobicContact CD1-CG2 4.31Å; F790-I794 HydrophobicContact CD2-CG2 4.03Å; F790-I794 HydrophobicContact CE1-CD1 3.94Å; F790-I794 HydrophobicContact CE1-CG2 3.9Å; F790-I794 HydrophobicContact CE2-CG2 3.58Å; F790-I794 HydrophobicContact CG-CG2 4.37Å; F790-I794 HydrophobicContact CZ-CD1 4.49Å; F790-I794 HydrophobicContact CZ-CG2 3.51Å; F790-I794 WeakPolarHBondContact O-CG1 3.44Å; F790-I794 WeakPolarHBondContact O-CG2 3.17Å; F790-I794 PolarHBondContact O-N 2.88Å; L791-I794 HydrophobicContact CD2-CD1 4.24Å; L791-I794 WeakPolarHBondContact O-CG1 3.46Å; I794-Y797 WeakPolarHBondContact O-CB 3.48Å; I794-Y797 PolarHBondContact O-N 3.14Å; I794-C798 WeakPolarHBondContact O-CB 3.28Å; I794-C798 PolarHBondContact O-N 2.9Å; I794-L806 HydrophobicContact CB-CD1 4.38Å; I794-F810 HydrophobicContact CG2-CZ 4.08Å; I794-I826 HydrophobicContact CD1-CD1 3.68Å; I794-I826 HydrophobicContact CD1-CG1 3.76Å
795	N	98.3	Very high	96	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-73.3	-37.2	176.3	-78.5	-65.8	0	0	0	111.4	L791 V792 F793 C798 I799 I841 C842 G845 I846	L791-N795 WeakPolarHBondContact O-CB 3.34Å; L791-N795 PolarHBondContact O-N 3.44Å; L791-N795 PolarHBondContact O-ND2 2.83Å; V792-N795 PolarHBondContact O-N 3.36Å; F793-N795 VanDerWaalsContact C-N 3.3Å; F793-N795 PolarHBondContact O-N 3Å; N795-C798 WeakPolarHBondContact O-CB 3.45Å; N795-C798 PolarHBondContact O-N 3.25Å; N795-I799 WeakPolarHBondContact O-CD1 3.21Å; N795-I799 VanDerWaalsContact O-CG1 3.24Å; N795-I799 WeakPolarHBondContact O-CG1 3.42Å; N795-I799 PolarHBondContact O-N 3.38Å; N795-I841 HydrophobicContact CB-CG2 4.11Å; N795-C842 PolarHBondContact OD1-O 3.31Å; N795-G845 VanDerWaalsContact OD1-C 3.26Å; N795-G845 WeakPolarHBondContact OD1-CA 3.28Å; N795-I846 WeakPolarHBondContact OD1-CG1 2.73Å; N795-I846 PolarHBondContact OD1-N 3.05Å; N795-I846 VanDerWaalsContact OD1-N 3.14Å
796	L	97.4	Very high	96.4	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-62.3	-42.6	170.2	-176.9	60	0	0	0	111.6	N752 V792 F793 C798 I799 K800 I841 P916	N752-L796 HydrophobicContact CB-CD2 3.63Å; V792-L796 WeakPolarHBondContact O-CB 3.18Å; V792-L796 PolarHBondContact O-N 3Å; F793-L796 PolarHBondContact O-N 3.42Å; L796-C798 PolarHBondContact O-N 3.13Å; L796-I799 WeakPolarHBondContact O-CB 3.34Å; L796-I799 PolarHBondContact O-N 3.27Å; L796-K800 HydrophobicContact CD1-CG 4.31Å; L796-K800 PolarHBondContact O-N 2.89Å; L796-I841 HydrophobicContact CB-CG2 3.86Å; L796-P916 HydrophobicContact CD1-CB 3.79Å; L796-P916 HydrophobicContact CD1-CG 3.76Å
797	Y	97.8	Very high	96.6	Very high	6 Å²	6	17.6 Å²	17.6	2%	0.024	9%	0.093	C	C	.	.	H	α-helix	trans	-58.8	-46.3	173.3	-176.4	-79.6	0	0	0	111.3	I755 F771 F793 I794 I799 K800 Y801 A805 L806 I809	I755-Y797 HydrophobicContact CD1-CD2 4.01Å; I755-Y797 HydrophobicContact CD1-CE2 4.34Å; I755-Y797 HydrophobicContact CG1-CD2 4.46Å; I755-Y797 HydrophobicContact CG2-CD2 4.48Å; F771-Y797 AromaticContact CE2-CD2 3.96Å; F771-Y797 HydrophobicContact CE2-CD2 3.96Å; F771-Y797 HydrophobicContact CE2-CE1 4.37Å; F771-Y797 AromaticContact CE2-CE2 3.74Å; F771-Y797 HydrophobicContact CE2-CE2 3.74Å; F771-Y797 HydrophobicContact CE2-CG 4.38Å; F771-Y797 AromaticContact CE2-CZ 3.97Å; F771-Y797 HydrophobicContact CZ-CD1 4.26Å; F771-Y797 AromaticContact CZ-CD2 3.87Å; F771-Y797 HydrophobicContact CZ-CD2 3.87Å; F771-Y797 HydrophobicContact CZ-CE1 4.49Å; F771-Y797 HydrophobicContact CZ-CE2 4.14Å; F771-Y797 AromaticContact CZ-CG 3.95Å; F771-Y797 HydrophobicContact CZ-CG 3.95Å; F793-Y797 WeakPolarHBondContact O-CB 3.44Å; F793-Y797 PolarHBondContact O-N 2.62Å; I794-Y797 WeakPolarHBondContact O-CB 3.48Å; I794-Y797 PolarHBondContact O-N 3.14Å; Y797-I799 VanDerWaalsContact C-N 3.28Å; Y797-I799 PolarHBondContact O-N 3.49Å; Y797-K800 PolarHBondContact O-N 3.24Å; Y797-Y801 HydrophobicContact CD1-CD2 4.33Å; Y797-Y801 AromaticContact CD2-CD2 3.6Å; Y797-Y801 HydrophobicContact CD2-CD2 3.6Å; Y797-Y801 HydrophobicContact CD2-CE2 4.04Å; Y797-Y801 HydrophobicContact CE1-CD2 4.21Å; Y797-Y801 AromaticContact CE2-CD2 3.43Å; Y797-Y801 HydrophobicContact CE2-CD2 3.43Å; Y797-Y801 VanDerWaalsContact CE2-CD2 3.43Å; Y797-Y801 AromaticContact CE2-CE2 3.87Å; Y797-Y801 HydrophobicContact CE2-CE2 3.87Å; Y797-Y801 HydrophobicContact CE2-CG 4.34Å; Y797-Y801 HydrophobicContact CG-CD2 4.05Å; Y797-Y801 AromaticContact CZ-CD2 3.76Å; Y797-Y801 PolarHBondContact O-N 2.83Å; Y797-A805 HydrophobicContact CE1-CB 4.49Å; Y797-L806 HydrophobicContact CD1-CB 4.04Å; Y797-L806 HydrophobicContact CD1-CD1 3.61Å; Y797-L806 HydrophobicContact CD1-CG 4.41Å; Y797-L806 HydrophobicContact CE1-CB 4.21Å; Y797-L806 HydrophobicContact CE1-CD1 4.14Å; Y797-L806 HydrophobicContact CG-CD1 4.34Å; Y797-I809 HydrophobicContact CE1-CG2 4.29Å
798	C	97.5	Very high	96.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.8	-39.1	174.9	-176.7	0	0	0	0	112.3	I794 N795 L796 G802 A803 L806 G845	I794-C798 WeakPolarHBondContact O-CB 3.28Å; I794-C798 PolarHBondContact O-N 2.9Å; N795-C798 WeakPolarHBondContact O-CB 3.45Å; N795-C798 PolarHBondContact O-N 3.25Å; L796-C798 PolarHBondContact O-N 3.13Å; C798-G802 CarbonylContact O-C 3.55Å; C798-G802 VanDerWaalsContact O-C 3.31Å; C798-G802 WeakPolarHBondContact O-CA 3.37Å; C798-G802 PolarHBondContact O-N 3.31Å; C798-A803 WeakPolarHBondContact SG-CA 3.39Å; C798-A803 VanDerWaalsContact SG-CB 3.6Å; C798-L806 HydrophobicContact CB-CD2 3.99Å; C798-G845 PolarHBondContact SG-O 2.85Å
799	I	96.2	Very high	96.9	Very high	26 Å²	26	22.2 Å²	22.2	13%	0.133	12%	0.115	C	C	.	.	H	α-helix	trans	-65	-50.2	177.4	-70.7	160.8	0	0	0	110.4	N795 L796 Y797 I841 V844 K848 V917	N795-I799 WeakPolarHBondContact O-CD1 3.21Å; N795-I799 VanDerWaalsContact O-CG1 3.24Å; N795-I799 WeakPolarHBondContact O-CG1 3.42Å; N795-I799 PolarHBondContact O-N 3.38Å; L796-I799 WeakPolarHBondContact O-CB 3.34Å; L796-I799 PolarHBondContact O-N 3.27Å; Y797-I799 VanDerWaalsContact C-N 3.28Å; Y797-I799 PolarHBondContact O-N 3.49Å; I799-I841 HydrophobicContact CD1-CG2 4.13Å; I799-I841 WeakPolarHBondContact CD1-O 3.41Å; I799-V844 HydrophobicContact CD1-CB 3.93Å; I799-V844 HydrophobicContact CD1-CG1 4.02Å; I799-V844 HydrophobicContact CG1-CB 4.29Å; I799-V844 HydrophobicContact CG1-CG1 3.9Å; I799-K848 HydrophobicContact CG1-CD 4.42Å; I799-K848 PolarHBondContact O-NZ 3.15Å; I799-V917 HydrophobicContact CD1-CG2 4Å
800	K	95.2	Very high	97.1	Very high	85 Å²	85	21.4 Å²	21.4	37%	0.37	11%	0.109	S	C	.	.	H	α-helix	trans	-74.5	-43.8	-173.5	-69.9	-72.6	177.2	172.9	0	113.7	I755 E756 L796 Y797	I755-K800 HydrophobicContact CG2-CB 4.16Å; I755-K800 HydrophobicContact CG2-CG 4.24Å; E756-K800 IonicContact OE1-NZ 3.34Å; L796-K800 HydrophobicContact CD1-CG 4.31Å; L796-K800 PolarHBondContact O-N 2.89Å; Y797-K800 PolarHBondContact O-N 3.24Å
801	Y	95.4	Very high	97	Very high	48 Å²	48	22.9 Å²	22.9	19%	0.188	12%	0.117	C	C	.	.	H	α-helix	trans	-104	-12.2	-175.3	-66.1	-62.6	0	0	0	114.6	I755 P760 R767 Y797 A805	I755-Y801 HydrophobicContact CD1-CE2 3.87Å; I755-Y801 HydrophobicContact CG2-CD2 4.26Å; I755-Y801 HydrophobicContact CG2-CE2 3.78Å; P760-Y801 HydrophobicContact CB-CE1 3.93Å; P760-Y801 HydrophobicContact CG-CE1 4.03Å; R767-Y801 PolarHBondContact NH2-OH 3.45Å; Y797-Y801 HydrophobicContact CD1-CD2 4.33Å; Y797-Y801 AromaticContact CD2-CD2 3.6Å; Y797-Y801 HydrophobicContact CD2-CD2 3.6Å; Y797-Y801 HydrophobicContact CD2-CE2 4.04Å; Y797-Y801 HydrophobicContact CE1-CD2 4.21Å; Y797-Y801 AromaticContact CE2-CD2 3.43Å; Y797-Y801 HydrophobicContact CE2-CD2 3.43Å; Y797-Y801 VanDerWaalsContact CE2-CD2 3.43Å; Y797-Y801 AromaticContact CE2-CE2 3.87Å; Y797-Y801 HydrophobicContact CE2-CE2 3.87Å; Y797-Y801 HydrophobicContact CE2-CG 4.34Å; Y797-Y801 HydrophobicContact CG-CD2 4.05Å; Y797-Y801 AromaticContact CZ-CD2 3.76Å; Y797-Y801 PolarHBondContact O-N 2.83Å; Y801-A805 WeakPolarHBondContact O-CB 3.12Å
802	G	96.1	Very high	96.9	Very high	16 Å²	16	25 Å²	25	17%	0.165	14%	0.139	C	C	.	.			trans	98.3	155.4	-178.7	0	0	0	0	0	113.2	C798 A805 L806	C798-G802 CarbonylContact O-C 3.55Å; C798-G802 VanDerWaalsContact O-C 3.31Å; C798-G802 WeakPolarHBondContact O-CA 3.37Å; C798-G802 PolarHBondContact O-N 3.31Å; G802-A805 PolarHBondContact O-N 2.8Å; G802-L806 PolarHBondContact O-N 3.36Å
803	A	97	Very high	96.9	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-69.4	-36.3	-175.4	0	0	0	0	0	113.2	C798 L806 Q807 K848 L849 E852 C853	C798-A803 WeakPolarHBondContact SG-CA 3.39Å; C798-A803 VanDerWaalsContact SG-CB 3.6Å; A803-L806 PolarHBondContact O-N 3.25Å; A803-Q807 PolarHBondContact O-N 2.61Å; A803-Q807 VanDerWaalsContact O-N 3.11Å; A803-K848 HydrophobicContact CB-CB 4.25Å; A803-K848 VanDerWaalsContact CB-O 3.29Å; A803-K848 WeakPolarHBondContact CB-O 3.44Å; A803-L849 HydrophobicContact CB-CD2 3.87Å; A803-E852 HydrophobicContact CB-CB 4.39Å; A803-C853 HydrophobicContact CB-CB 3.84Å
804	L	96.9	Very high	96.7	Very high	66 Å²	66	31.3 Å²	31.3	35%	0.346	17%	0.168	S	C	.	.	H	α-helix	trans	-62.6	-43.4	175.1	-175.4	62	0	0	0	111.5	L806 Q807 E808 P855	L804-L806 VanDerWaalsContact C-N 3.29Å; L804-L806 PolarHBondContact O-N 3.46Å; L804-Q807 PolarHBondContact O-N 3.41Å; L804-Q807 VanDerWaalsContact O-N 3.11Å; L804-E808 HydrophobicContact CD1-CG 4.22Å; L804-E808 HydrophobicContact CG-CG 4.24Å; L804-E808 WeakPolarHBondContact O-CB 3.43Å; L804-E808 WeakPolarHBondContact O-CG 3.39Å; L804-E808 PolarHBondContact O-N 3.42Å; L804-P855 HydrophobicContact CD1-CG 4.01Å
805	A	96.1	Very high	96.6	Very high	27 Å²	27	36.3 Å²	36.3	22%	0.223	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-37.6	177.3	0	0	0	0	0	112.4	Y797 Y801 G802 I809	Y797-A805 HydrophobicContact CE1-CB 4.49Å; Y801-A805 WeakPolarHBondContact O-CB 3.12Å; G802-A805 PolarHBondContact O-N 2.8Å; A805-I809 WeakPolarHBondContact O-CB 3.27Å; A805-I809 VanDerWaalsContact O-CG2 3.28Å; A805-I809 WeakPolarHBondContact O-CG2 3.29Å; A805-I809 PolarHBondContact O-N 2.91Å
806	L	97.6	Very high	96.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.2	-40.3	174.8	-176.2	68.8	0	0	0	112.1	F771 I794 Y797 C798 G802 A803 L804 I809 F810 L849	F771-L806 HydrophobicContact CE1-CD1 4.42Å; F771-L806 HydrophobicContact CZ-CD1 4.03Å; I794-L806 HydrophobicContact CB-CD1 4.38Å; Y797-L806 HydrophobicContact CD1-CB 4.04Å; Y797-L806 HydrophobicContact CD1-CD1 3.61Å; Y797-L806 HydrophobicContact CD1-CG 4.41Å; Y797-L806 HydrophobicContact CE1-CB 4.21Å; Y797-L806 HydrophobicContact CE1-CD1 4.14Å; Y797-L806 HydrophobicContact CG-CD1 4.34Å; C798-L806 HydrophobicContact CB-CD2 3.99Å; G802-L806 PolarHBondContact O-N 3.36Å; A803-L806 PolarHBondContact O-N 3.25Å; L804-L806 VanDerWaalsContact C-N 3.29Å; L804-L806 PolarHBondContact O-N 3.46Å; L806-I809 WeakPolarHBondContact O-CG2 3.23Å; L806-F810 HydrophobicContact CD1-CD1 4.31Å; L806-F810 HydrophobicContact CD1-CE1 3.54Å; L806-F810 HydrophobicContact CD1-CE2 4.23Å; L806-F810 HydrophobicContact CD1-CZ 3.5Å; L806-F810 HydrophobicContact CG-CE1 4.37Å; L806-F810 HydrophobicContact CG-CE2 4.4Å; L806-F810 HydrophobicContact CG-CZ 4.16Å; L806-F810 WeakPolarHBondContact O-CG 3.37Å; L806-F810 PolarHBondContact O-N 3.09Å; L806-L849 HydrophobicContact CD2-CD1 4.38Å; L806-L849 HydrophobicContact CD2-CD2 3.96Å
807	Q	97.5	Very high	96.3	Very high	21 Å²	21	42.3 Å²	42.3	10%	0.098	23%	0.227	C	C	.	.	H	α-helix	trans	-67.5	-47.5	176.7	177.4	-81.8	-40.6	0	0	111.3	A803 L804 I809 F810 D811 F818 P855 Y861	A803-Q807 PolarHBondContact O-N 2.61Å; A803-Q807 VanDerWaalsContact O-N 3.11Å; L804-Q807 PolarHBondContact O-N 3.41Å; L804-Q807 VanDerWaalsContact O-N 3.11Å; Q807-I809 VanDerWaalsContact C-N 3.32Å; Q807-I809 PolarHBondContact O-N 3.14Å; Q807-F810 PolarHBondContact O-N 2.9Å; Q807-D811 PolarHBondContact NE2-OD2 2.88Å; Q807-D811 PolarHBondContact O-N 3.28Å; Q807-F818 HydrophobicContact CB-CD1 4.09Å; Q807-F818 HydrophobicContact CB-CD2 3.89Å; Q807-F818 HydrophobicContact CB-CE1 4.12Å; Q807-F818 HydrophobicContact CB-CE2 3.96Å; Q807-F818 HydrophobicContact CB-CG 3.95Å; Q807-F818 HydrophobicContact CB-CZ 4.07Å; Q807-F818 HydrophobicContact CG-CB 4.07Å; Q807-F818 HydrophobicContact CG-CD1 3.54Å; Q807-F818 HydrophobicContact CG-CD2 4.13Å; Q807-F818 HydrophobicContact CG-CE1 3.9Å; Q807-F818 HydrophobicContact CG-CE2 4.47Å; Q807-F818 HydrophobicContact CG-CG 3.64Å; Q807-F818 HydrophobicContact CG-CZ 4.36Å; Q807-P855 HydrophobicContact CG-CB 4.11Å; Q807-P855 HydrophobicContact CG-CG 4.16Å; Q807-Y861 HydrophobicContact CG-CE2 4.44Å
808	E	96.8	Very high	96.3	Very high	114 Å²	114	42 Å²	42	53%	0.533	23%	0.226	S	C	.	.	H	α-helix	trans	-61	-39.8	-179.1	-73.6	178.3	164.6	0	0	111.9	L804 G812	L804-E808 HydrophobicContact CD1-CG 4.22Å; L804-E808 HydrophobicContact CG-CG 4.24Å; L804-E808 WeakPolarHBondContact O-CB 3.43Å; L804-E808 WeakPolarHBondContact O-CG 3.39Å; L804-E808 PolarHBondContact O-N 3.42Å; E808-G812 WeakPolarHBondContact O-CA 3.48Å; E808-G812 PolarHBondContact O-N 3.13Å
809	I	96.9	Very high	96.3	Very high	25 Å²	25	42.3 Å²	42.3	13%	0.128	23%	0.229	C	C	.	.	H	α-helix	trans	-70.3	-35.5	179.4	-163.5	161.2	0	0	0	112.5	R767 F771 Y797 A805 L806 Q807 I813	R767-I809 HydrophobicContact CB-CD1 3.51Å; F771-I809 HydrophobicContact CD2-CD1 3.57Å; F771-I809 HydrophobicContact CD2-CG1 3.95Å; F771-I809 HydrophobicContact CD2-CG2 4.03Å; F771-I809 HydrophobicContact CE2-CD1 3.81Å; F771-I809 HydrophobicContact CE2-CG1 4.39Å; F771-I809 HydrophobicContact CE2-CG2 3.84Å; Y797-I809 HydrophobicContact CE1-CG2 4.29Å; A805-I809 WeakPolarHBondContact O-CB 3.27Å; A805-I809 VanDerWaalsContact O-CG2 3.28Å; A805-I809 WeakPolarHBondContact O-CG2 3.29Å; A805-I809 PolarHBondContact O-N 2.91Å; L806-I809 WeakPolarHBondContact O-CG2 3.23Å; Q807-I809 VanDerWaalsContact C-N 3.32Å; Q807-I809 PolarHBondContact O-N 3.14Å; I809-I813 WeakPolarHBondContact O-CG1 3.36Å; I809-I813 PolarHBondContact O-N 2.82Å
810	F	97.7	Very high	96.3	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-69	-51.1	176.4	-74.7	11.3	0	0	0	110.6	F771 F775 I794 L806 Q807 G812 I813 Q814 M817 F818 V821	F771-F810 HydrophobicContact CD1-CD1 4.32Å; F771-F810 AromaticContact CD1-CE1 3.45Å; F771-F810 HydrophobicContact CD1-CE1 3.45Å; F771-F810 VanDerWaalsContact CD1-CE1 3.45Å; F771-F810 HydrophobicContact CD1-CZ 4.18Å; F771-F810 HydrophobicContact CD2-CE1 4.44Å; F771-F810 AromaticContact CE1-CE1 3.41Å; F771-F810 HydrophobicContact CE1-CE1 3.41Å; F771-F810 VanDerWaalsContact CE1-CE1 3.41Å; F771-F810 AromaticContact CE1-CZ 3.93Å; F771-F810 HydrophobicContact CE1-CZ 3.93Å; F771-F810 HydrophobicContact CE2-CE1 4.39Å; F771-F810 HydrophobicContact CG-CD1 4.49Å; F771-F810 AromaticContact CG-CE1 4Å; F771-F810 HydrophobicContact CG-CE1 4Å; F771-F810 AromaticContact CZ-CE1 3.9Å; F771-F810 HydrophobicContact CZ-CE1 3.9Å; F775-F810 HydrophobicContact CE1-CZ 4.48Å; F775-F810 HydrophobicContact CE2-CD1 4.01Å; F775-F810 HydrophobicContact CE2-CE1 4.17Å; F775-F810 HydrophobicContact CE2-CG 4.43Å; F775-F810 AromaticContact CZ-CD1 3.74Å; F775-F810 HydrophobicContact CZ-CD1 3.74Å; F775-F810 HydrophobicContact CZ-CD2 4.06Å; F775-F810 AromaticContact CZ-CE1 3.65Å; F775-F810 HydrophobicContact CZ-CE1 3.65Å; F775-F810 AromaticContact CZ-CE2 3.96Å; F775-F810 HydrophobicContact CZ-CE2 3.96Å; F775-F810 AromaticContact CZ-CG 3.97Å; F775-F810 HydrophobicContact CZ-CG 3.97Å; F775-F810 AromaticContact CZ-CZ 3.75Å; F775-F810 HydrophobicContact CZ-CZ 3.75Å; I794-F810 HydrophobicContact CG2-CZ 4.08Å; L806-F810 HydrophobicContact CD1-CD1 4.31Å; L806-F810 HydrophobicContact CD1-CE1 3.54Å; L806-F810 HydrophobicContact CD1-CE2 4.23Å; L806-F810 HydrophobicContact CD1-CZ 3.5Å; L806-F810 HydrophobicContact CG-CE1 4.37Å; L806-F810 HydrophobicContact CG-CE2 4.4Å; L806-F810 HydrophobicContact CG-CZ 4.16Å; L806-F810 WeakPolarHBondContact O-CG 3.37Å; L806-F810 PolarHBondContact O-N 3.09Å; Q807-F810 PolarHBondContact O-N 2.9Å; F810-G812 VanDerWaalsContact C-N 3.25Å; F810-G812 PolarHBondContact O-N 2.82Å; F810-I813 WeakPolarHBondContact O-CB 3.31Å; F810-I813 PolarHBondContact O-N 3.37Å; F810-Q814 PolarHBondContact O-N 3.38Å; F810-M817 HydrophobicContact CB-CB 4.41Å; F810-M817 HydrophobicContact CB-CG 4.32Å; F810-F818 HydrophobicContact CB-CB 4.02Å; F810-F818 HydrophobicContact CD2-CB 4.47Å; F810-F818 AromaticContact CD2-CD2 3.94Å; F810-F818 HydrophobicContact CD2-CD2 3.94Å; F810-V821 HydrophobicContact CD2-CB 4.2Å; F810-V821 HydrophobicContact CD2-CG1 4.47Å; F810-V821 HydrophobicContact CD2-CG2 4.12Å; F810-V821 HydrophobicContact CE2-CB 4.05Å; F810-V821 HydrophobicContact CE2-CG1 3.82Å; F810-V821 HydrophobicContact CE2-CG2 4.14Å
811	D	96.7	Very high	96.3	Very high	32 Å²	32	41.4 Å²	41.4	17%	0.171	23%	0.227	C	C	.	.	H	α-helix	trans	-70.4	-24.5	-179.1	-74.2	-13.6	0	0	0	112.7	Q807 I813 Q814 K816 M817 F818 Y861	Q807-D811 PolarHBondContact NE2-OD2 2.88Å; Q807-D811 PolarHBondContact O-N 3.28Å; D811-I813 VanDerWaalsContact C-N 3.3Å; D811-Q814 WeakPolarHBondContact CA-O 3.28Å; D811-Q814 CarbonylContact O-C 3.53Å; D811-Q814 VanDerWaalsContact O-C 3.29Å; D811-K816 WeakPolarHBondContact OD1-CA 3.41Å; D811-K816 PolarHBondContact OD1-N 3.23Å; D811-M817 PolarHBondContact OD1-N 3.17Å; D811-M817 VanDerWaalsContact OD1-N 3.11Å; D811-F818 WeakPolarHBondContact OD1-CB 3.45Å; D811-F818 PolarHBondContact OD1-N 2.91Å; D811-Y861 PolarHBondContact OD1-OH 3.2Å; D811-Y861 VanDerWaalsContact OD1-OH 3.06Å; D811-Y861 WeakPolarHBondContact OD2-CE2 3.12Å; D811-Y861 PolarHBondContact OD2-OH 3.45Å
812	G	95.5	Very high	96.4	Very high	43 Å²	43	39.1 Å²	39.1	44%	0.443	22%	0.218	S	C	.	.	H	α-helix	trans	-71.7	-18	170.5	0	0	0	0	0	114.5	K768 E808 F810	K768-G812 WeakPolarHBondContact CE-O 3.06Å; K768-G812 PolarHBondContact NZ-O 3.45Å; E808-G812 WeakPolarHBondContact O-CA 3.48Å; E808-G812 PolarHBondContact O-N 3.13Å; F810-G812 VanDerWaalsContact C-N 3.25Å; F810-G812 PolarHBondContact O-N 2.82Å
813	I	95.9	Very high	96.5	Very high	42 Å²	42	42.1 Å²	42.1	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-83.3	-51.1	170	-69.8	163.9	0	0	0	109.8	K768 F771 I772 F775 I809 F810 D811 M817	K768-I813 HydrophobicContact CD-CG1 4.44Å; K768-I813 HydrophobicContact CG-CD1 4.34Å; K768-I813 HydrophobicContact CG-CG1 3.76Å; F771-I813 HydrophobicContact CB-CD1 3.5Å; I772-I813 HydrophobicContact CG1-CD1 4.03Å; I772-I813 HydrophobicContact CG1-CG1 4.05Å; I772-I813 HydrophobicContact CG1-CG2 3.91Å; F775-I813 HydrophobicContact CD2-CD1 4.28Å; F775-I813 HydrophobicContact CE2-CD1 4.03Å; I809-I813 WeakPolarHBondContact O-CG1 3.36Å; I809-I813 PolarHBondContact O-N 2.82Å; F810-I813 WeakPolarHBondContact O-CB 3.31Å; F810-I813 PolarHBondContact O-N 3.37Å; D811-I813 VanDerWaalsContact C-N 3.3Å; I813-M817 HydrophobicContact CB-SD 4.01Å; I813-M817 HydrophobicContact CG2-CE 4.12Å; I813-M817 HydrophobicContact CG2-SD 3.82Å
814	Q	94.6	Very high	96.4	Very high	102 Å²	102	48 Å²	48	48%	0.477	25%	0.253	S	S	.	.	S	Bend	trans	-148.5	130.7	176.5	175.1	-176.9	-17.6	0	0	109	F810 D811 K816 M817	F810-Q814 PolarHBondContact O-N 3.38Å; D811-Q814 WeakPolarHBondContact CA-O 3.28Å; D811-Q814 CarbonylContact O-C 3.53Å; D811-Q814 VanDerWaalsContact O-C 3.29Å; Q814-K816 PolarHBondContact O-N 3.49Å; Q814-M817 HydrophobicContact CB-CB 4.15Å; Q814-M817 HydrophobicContact CB-CE 3.78Å; Q814-M817 HydrophobicContact CB-SD 4.29Å; Q814-M817 WeakPolarHBondContact O-CB 3.31Å; Q814-M817 PolarHBondContact O-N 2.89Å; Q814-M817 VanDerWaalsContact O-N 3.07Å
815	P	95.3	Very high	96.3	Very high	106 Å²	106	45.7 Å²	45.7	69%	0.688	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	134.9	176.4	-25.9	33.8	0	0	0	111.7	M817	P815-M817 PolarHBondContact O-N 3.48Å
816	K	94.4	Very high	96.3	Very high	115 Å²	115	44.5 Å²	44.5	50%	0.5	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	6.5	-179.7	-46.5	-172.1	-175.8	-150.7	0	116.2	D811 Q814 F818 G819 M820 E860 Y861	D811-K816 WeakPolarHBondContact OD1-CA 3.41Å; D811-K816 PolarHBondContact OD1-N 3.23Å; Q814-K816 PolarHBondContact O-N 3.49Å; K816-F818 VanDerWaalsContact C-N 3.25Å; K816-F818 PolarHBondContact O-N 3.15Å; K816-G819 PolarHBondContact O-N 3.33Å; K816-M820 PolarHBondContact O-N 3.18Å; K816-M820 VanDerWaalsContact O-N 3.11Å; K816-E860 WeakPolarHBondContact CD-OE1 3.35Å; K816-E860 WeakPolarHBondContact CE-OE1 3.5Å; K816-E860 WeakPolarHBondContact CG-OE1 3.49Å; K816-E860 IonicContact NZ-OE1 3.08Å; K816-E860 PolarHBondContact NZ-OE1 3.05Å; K816-E860 IonicContact NZ-OE2 3.76Å; K816-E860 PolarHBondContact NZ-OE2 3.29Å; K816-Y861 VanDerWaalsContact CA-OH 3.27Å; K816-Y861 WeakPolarHBondContact CA-OH 3.49Å
817	M	95.5	Very high	96.3	Very high	12 Å²	12	46 Å²	46	6%	0.059	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-33.3	177.1	-178.7	169.7	-90.7	0	0	111.7	F775 F810 D811 I813 Q814 P815 M820 V821	F775-M817 HydrophobicContact CD2-CE 4.18Å; F775-M817 HydrophobicContact CD2-SD 3.58Å; F775-M817 VanDerWaalsContact CD2-SD 3.58Å; F775-M817 HydrophobicContact CE2-CG 4.3Å; F775-M817 HydrophobicContact CE2-SD 3.41Å; F775-M817 WeakPolarHBondContact CE2-SD 3.36Å; F775-M817 HydrophobicContact CG-CE 4.47Å; F775-M817 HydrophobicContact CG-SD 4.28Å; F775-M817 HydrophobicContact CZ-CG 4.3Å; F775-M817 HydrophobicContact CZ-SD 3.99Å; F810-M817 HydrophobicContact CB-CB 4.41Å; F810-M817 HydrophobicContact CB-CG 4.32Å; D811-M817 PolarHBondContact OD1-N 3.17Å; D811-M817 VanDerWaalsContact OD1-N 3.11Å; I813-M817 HydrophobicContact CB-SD 4.01Å; I813-M817 HydrophobicContact CG2-CE 4.12Å; I813-M817 HydrophobicContact CG2-SD 3.82Å; Q814-M817 HydrophobicContact CB-CB 4.15Å; Q814-M817 HydrophobicContact CB-CE 3.78Å; Q814-M817 HydrophobicContact CB-SD 4.29Å; Q814-M817 WeakPolarHBondContact O-CB 3.31Å; Q814-M817 PolarHBondContact O-N 2.89Å; Q814-M817 VanDerWaalsContact O-N 3.07Å; P815-M817 PolarHBondContact O-N 3.48Å; M817-M820 HydrophobicContact CE-CE 4.4Å; M817-M820 HydrophobicContact CG-CE 4.26Å; M817-M820 PolarHBondContact O-N 2.91Å; M817-V821 HydrophobicContact CG-CG2 4.21Å; M817-V821 VanDerWaalsContact O-CG2 3.31Å; M817-V821 WeakPolarHBondContact O-CG2 3.32Å; M817-V821 PolarHBondContact O-N 3.39Å
818	F	97.5	Very high	96.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-51.8	176.3	-179.5	-109.8	0	0	0	112.7	Q807 F810 D811 K816 M820 V821 L822 L849 M856 Y861	Q807-F818 HydrophobicContact CB-CD1 4.09Å; Q807-F818 HydrophobicContact CB-CD2 3.89Å; Q807-F818 HydrophobicContact CB-CE1 4.12Å; Q807-F818 HydrophobicContact CB-CE2 3.96Å; Q807-F818 HydrophobicContact CB-CG 3.95Å; Q807-F818 HydrophobicContact CB-CZ 4.07Å; Q807-F818 HydrophobicContact CG-CB 4.07Å; Q807-F818 HydrophobicContact CG-CD1 3.54Å; Q807-F818 HydrophobicContact CG-CD2 4.13Å; Q807-F818 HydrophobicContact CG-CE1 3.9Å; Q807-F818 HydrophobicContact CG-CE2 4.47Å; Q807-F818 HydrophobicContact CG-CG 3.64Å; Q807-F818 HydrophobicContact CG-CZ 4.36Å; F810-F818 HydrophobicContact CB-CB 4.02Å; F810-F818 HydrophobicContact CD2-CB 4.47Å; F810-F818 AromaticContact CD2-CD2 3.94Å; F810-F818 HydrophobicContact CD2-CD2 3.94Å; D811-F818 WeakPolarHBondContact OD1-CB 3.45Å; D811-F818 PolarHBondContact OD1-N 2.91Å; K816-F818 VanDerWaalsContact C-N 3.25Å; K816-F818 PolarHBondContact O-N 3.15Å; F818-M820 VanDerWaalsContact C-N 3.31Å; F818-M820 PolarHBondContact O-N 3.1Å; F818-V821 PolarHBondContact O-N 3.07Å; F818-L822 HydrophobicContact CD1-CD1 3.91Å; F818-L822 HydrophobicContact CE1-CD1 3.43Å; F818-L822 VanDerWaalsContact CE1-CD1 3.43Å; F818-L822 HydrophobicContact CE1-CG 4.45Å; F818-L822 HydrophobicContact CE2-CD1 4.19Å; F818-L822 HydrophobicContact CE2-CG 4.44Å; F818-L822 HydrophobicContact CG-CD1 4.5Å; F818-L822 HydrophobicContact CZ-CD1 3.58Å; F818-L822 HydrophobicContact CZ-CG 4.27Å; F818-L822 PolarHBondContact O-N 2.92Å; F818-L849 HydrophobicContact CE2-CD2 3.92Å; F818-L849 HydrophobicContact CZ-CD2 3.83Å; F818-M856 HydrophobicContact CE1-CG 3.98Å; F818-M856 HydrophobicContact CE1-SD 3.59Å; F818-M856 VanDerWaalsContact CE1-SD 3.59Å; F818-M856 HydrophobicContact CZ-CG 4.32Å; F818-M856 HydrophobicContact CZ-SD 4.13Å; F818-Y861 HydrophobicContact CB-CE2 4.3Å; F818-Y861 AromaticContact CD1-CD2 3.7Å; F818-Y861 HydrophobicContact CD1-CD2 3.7Å; F818-Y861 AromaticContact CD1-CE2 3.73Å; F818-Y861 HydrophobicContact CD1-CE2 3.73Å; F818-Y861 HydrophobicContact CD1-CG 4.26Å; F818-Y861 HydrophobicContact CE1-CD2 4.23Å; F818-Y861 HydrophobicContact CG-CE2 4.5Å
819	G	96.9	Very high	96	Very high	6 Å²	6	44.1 Å²	44.1	6%	0.062	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-39	175.7	0	0	0	0	0	112.7	K816 L822 E823 L864	K816-G819 PolarHBondContact O-N 3.33Å; G819-L822 PolarHBondContact O-N 3.01Å; G819-E823 WeakPolarHBondContact O-CB 3.13Å; G819-E823 PolarHBondContact O-N 2.86Å; G819-L864 WeakPolarHBondContact O-CD1 3.49Å
820	M	96	Very high	95.9	Very high	89 Å²	89	42.9 Å²	42.9	44%	0.438	23%	0.229	S	C	.	.	H	α-helix	trans	-62.6	-45	177.4	-174.8	-175.1	70.7	0	0	112.3	K816 M817 F818 E823 K824	K816-M820 PolarHBondContact O-N 3.18Å; K816-M820 VanDerWaalsContact O-N 3.11Å; M817-M820 HydrophobicContact CE-CE 4.4Å; M817-M820 HydrophobicContact CG-CE 4.26Å; M817-M820 PolarHBondContact O-N 2.91Å; F818-M820 VanDerWaalsContact C-N 3.31Å; F818-M820 PolarHBondContact O-N 3.1Å; M820-E823 PolarHBondContact O-N 3.11Å; M820-K824 HydrophobicContact CG-CG 4.34Å; M820-K824 VanDerWaalsContact O-CB 3.3Å; M820-K824 WeakPolarHBondContact O-CB 3.3Å; M820-K824 WeakPolarHBondContact O-CG 3.46Å; M820-K824 PolarHBondContact O-N 2.87Å
821	V	96.4	Very high	95.7	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-66.6	-39.8	178.9	175.1	0	0	0	0	110.8	F775 F790 F810 M817 F818 I825 I826	F775-V821 HydrophobicContact CD1-CG2 4.41Å; F775-V821 HydrophobicContact CE1-CG2 3.51Å; F775-V821 HydrophobicContact CZ-CG2 3.94Å; F790-V821 HydrophobicContact CE1-CG1 4.17Å; F810-V821 HydrophobicContact CD2-CB 4.2Å; F810-V821 HydrophobicContact CD2-CG1 4.47Å; F810-V821 HydrophobicContact CD2-CG2 4.12Å; F810-V821 HydrophobicContact CE2-CB 4.05Å; F810-V821 HydrophobicContact CE2-CG1 3.82Å; F810-V821 HydrophobicContact CE2-CG2 4.14Å; M817-V821 HydrophobicContact CG-CG2 4.21Å; M817-V821 VanDerWaalsContact O-CG2 3.31Å; M817-V821 WeakPolarHBondContact O-CG2 3.32Å; M817-V821 PolarHBondContact O-N 3.39Å; F818-V821 PolarHBondContact O-N 3.07Å; V821-I825 HydrophobicContact CG1-CB 4.3Å; V821-I825 WeakPolarHBondContact O-CA 3.42Å; V821-I825 VanDerWaalsContact O-CB 3.27Å; V821-I825 WeakPolarHBondContact O-CB 3.4Å; V821-I825 PolarHBondContact O-N 2.9Å; V821-I826 HydrophobicContact CG1-CD1 4.12Å; V821-I826 HydrophobicContact CG1-CG1 4.28Å; V821-I826 PolarHBondContact O-N 2.71Å
822	L	97.6	Very high	95.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-59.5	-53.2	173.9	-76.9	171.8	0	0	0	112	F818 G819 I826 I827 L849 M856 L864 L868	F818-L822 HydrophobicContact CD1-CD1 3.91Å; F818-L822 HydrophobicContact CE1-CD1 3.43Å; F818-L822 VanDerWaalsContact CE1-CD1 3.43Å; F818-L822 HydrophobicContact CE1-CG 4.45Å; F818-L822 HydrophobicContact CE2-CD1 4.19Å; F818-L822 HydrophobicContact CE2-CG 4.44Å; F818-L822 HydrophobicContact CG-CD1 4.5Å; F818-L822 HydrophobicContact CZ-CD1 3.58Å; F818-L822 HydrophobicContact CZ-CG 4.27Å; F818-L822 PolarHBondContact O-N 2.92Å; G819-L822 PolarHBondContact O-N 3.01Å; L822-I826 HydrophobicContact CD2-CB 4.24Å; L822-I826 HydrophobicContact CD2-CD1 3.5Å; L822-I826 VanDerWaalsContact CD2-CD1 3.5Å; L822-I826 HydrophobicContact CD2-CG1 4.43Å; L822-I826 HydrophobicContact CD2-CG2 4.39Å; L822-I826 HydrophobicContact CG-CD1 4.19Å; L822-I826 PolarHBondContact O-N 3.13Å; L822-I827 WeakPolarHBondContact O-CB 3.24Å; L822-I827 WeakPolarHBondContact O-CG1 3.48Å; L822-I827 PolarHBondContact O-N 3.33Å; L822-L849 HydrophobicContact CD2-CD1 4.44Å; L822-M856 HydrophobicContact CD1-CE 4.15Å; L822-M856 HydrophobicContact CD1-SD 3.49Å; L822-M856 WeakPolarHBondContact CD1-SD 3.41Å; L822-L864 HydrophobicContact CB-CD1 4.02Å; L822-L864 HydrophobicContact CD1-CD1 4.4Å; L822-L868 HydrophobicContact CD2-CD1 3.94Å; L822-L868 HydrophobicContact CD2-CD2 3.86Å; L822-L868 HydrophobicContact CD2-CG 4.48Å
823	E	96.8	Very high	95.1	Very high	80 Å²	80	43.7 Å²	43.7	37%	0.374	22%	0.22	S	C	.	.	I	π-helix	trans	-69.1	-40.8	-174.2	-167	-168.9	139.7	0	0	112.8	G819 M820 P828 L864	G819-E823 WeakPolarHBondContact O-CB 3.13Å; G819-E823 PolarHBondContact O-N 2.86Å; M820-E823 PolarHBondContact O-N 3.11Å; E823-P828 WeakPolarHBondContact O-CD 3.46Å; E823-L864 HydrophobicContact CB-CD1 4.34Å; E823-L864 HydrophobicContact CB-CD2 3.89Å; E823-L864 HydrophobicContact CG-CD2 3.95Å
824	K	95.1	Very high	94.8	Very high	124 Å²	124	44 Å²	44	54%	0.539	23%	0.226	S	C	.	.	I	π-helix	trans	-98.6	-16.3	-170.9	-58.2	-52.9	-171.4	-156.9	0	114.4	M820 P828	M820-K824 HydrophobicContact CG-CG 4.34Å; M820-K824 VanDerWaalsContact O-CB 3.3Å; M820-K824 WeakPolarHBondContact O-CB 3.3Å; M820-K824 WeakPolarHBondContact O-CG 3.46Å; M820-K824 PolarHBondContact O-N 2.87Å; K824-P828 VanDerWaalsContact C-CG 3.44Å; K824-P828 VanDerWaalsContact O-CG 3.31Å; K824-P828 WeakPolarHBondContact O-CG 3.35Å
825	I	95.3	Very high	94.4	Very high	18 Å²	18	40.5 Å²	40.5	9%	0.092	22%	0.217	C	C	.	.	I	π-helix	trans	-126.3	-60.9	-174.4	-50.8	-67.5	0	0	0	111	L778 I787 F790 L791 V821 P828 E829	L778-I825 HydrophobicContact CD1-CD1 4.22Å; L778-I825 HydrophobicContact CD2-CD1 3.79Å; L778-I825 HydrophobicContact CD2-CG1 3.94Å; L778-I825 HydrophobicContact CG-CD1 4.24Å; I787-I825 HydrophobicContact CG2-CG2 4.48Å; F790-I825 HydrophobicContact CD1-CG2 4.2Å; F790-I825 HydrophobicContact CE1-CG2 4.33Å; L791-I825 HydrophobicContact CD2-CG2 4.2Å; V821-I825 HydrophobicContact CG1-CB 4.3Å; V821-I825 WeakPolarHBondContact O-CA 3.42Å; V821-I825 VanDerWaalsContact O-CB 3.27Å; V821-I825 WeakPolarHBondContact O-CB 3.4Å; V821-I825 PolarHBondContact O-N 2.9Å; I825-P828 WeakPolarHBondContact O-CD 3.46Å; I825-E829 WeakPolarHBondContact O-CB 3.29Å; I825-E829 WeakPolarHBondContact O-CG 3.05Å; I825-E829 PolarHBondContact O-N 2.77Å
826	I	97.2	Very high	94.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.219	C	C	.	.	I	π-helix	trans	-65.1	-57	-172.7	-61.9	167.1	0	0	0	111.3	L791 I794 V821 L822 I830 I846 L868	L791-I826 HydrophobicContact CD2-CB 4.25Å; L791-I826 HydrophobicContact CD2-CG1 3.83Å; I794-I826 HydrophobicContact CD1-CD1 3.68Å; I794-I826 HydrophobicContact CD1-CG1 3.76Å; V821-I826 HydrophobicContact CG1-CD1 4.12Å; V821-I826 HydrophobicContact CG1-CG1 4.28Å; V821-I826 PolarHBondContact O-N 2.71Å; L822-I826 HydrophobicContact CD2-CB 4.24Å; L822-I826 HydrophobicContact CD2-CD1 3.5Å; L822-I826 VanDerWaalsContact CD2-CD1 3.5Å; L822-I826 HydrophobicContact CD2-CG1 4.43Å; L822-I826 HydrophobicContact CD2-CG2 4.39Å; L822-I826 HydrophobicContact CG-CD1 4.19Å; L822-I826 PolarHBondContact O-N 3.13Å; I826-I830 WeakPolarHBondContact O-CB 3.35Å; I826-I830 WeakPolarHBondContact O-CG2 3.26Å; I826-I830 PolarHBondContact O-N 3.29Å; I826-I830 VanDerWaalsContact O-N 3.08Å; I826-I846 HydrophobicContact CG2-CD1 4.12Å; I826-I846 HydrophobicContact CG2-CG1 4.42Å; I826-L868 HydrophobicContact CG2-CD1 3.71Å
827	I	96.7	Very high	94	Very high	32 Å²	32	37.4 Å²	37.4	16%	0.164	20%	0.2	C	C	.	.	H	α-helix	trans	-56.7	-50.7	-177.9	-73.1	163.2	0	0	0	112.6	L822 L864 P867 L868 S871	L822-I827 WeakPolarHBondContact O-CB 3.24Å; L822-I827 WeakPolarHBondContact O-CG1 3.48Å; L822-I827 PolarHBondContact O-N 3.33Å; I827-L864 HydrophobicContact CD1-CD2 4.4Å; I827-P867 HydrophobicContact CD1-CB 3.8Å; I827-L868 HydrophobicContact CD1-CB 4.42Å; I827-L868 HydrophobicContact CG1-CB 4.34Å; I827-L868 HydrophobicContact CG1-CD1 4.23Å; I827-S871 WeakPolarHBondContact CA-OG 3.45Å; I827-S871 WeakPolarHBondContact CG2-OG 3.41Å; I827-S871 PolarHBondContact O-OG 3.01Å
828	P	94	Very high	93.9	Very high	62 Å²	62	39.8 Å²	39.8	40%	0.403	21%	0.211	S	C	.	.	H	α-helix	trans	-77.2	-28.7	-176.3	25.5	-32.4	0	0	0	114.5	E823 K824 I825	E823-P828 WeakPolarHBondContact O-CD 3.46Å; K824-P828 VanDerWaalsContact C-CG 3.44Å; K824-P828 VanDerWaalsContact O-CG 3.31Å; K824-P828 WeakPolarHBondContact O-CG 3.35Å; I825-P828 WeakPolarHBondContact O-CD 3.46Å
829	E	93.9	Very high	93.7	Very high	33 Å²	33	41.9 Å²	41.9	15%	0.154	22%	0.22	C	C	.	.	H	α-helix	trans	-107	-10.5	-168.4	-53.9	-71.8	139.8	0	0	114	I787 L791 I825 Q831 K832	I787-E829 HydrophobicContact CG2-CB 3.53Å; I787-E829 HydrophobicContact CG2-CG 3.81Å; L791-E829 HydrophobicContact CD1-CB 4.01Å; I825-E829 WeakPolarHBondContact O-CB 3.29Å; I825-E829 WeakPolarHBondContact O-CG 3.05Å; I825-E829 PolarHBondContact O-N 2.77Å; E829-Q831 PolarHBondContact O-N 3.04Å; E829-K832 WeakPolarHBondContact O-CB 3.24Å; E829-K832 PolarHBondContact O-N 3.2Å; E829-K832 IonicContact OE1-NZ 2.68Å; E829-K832 WeakPolarHBondContact OE2-CD 3.34Å; E829-K832 VanDerWaalsContact OE2-CE 3.31Å; E829-K832 WeakPolarHBondContact OE2-CE 3.28Å; E829-K832 IonicContact OE2-NZ 3.96Å; E829-K832 PolarHBondContact OE2-NZ 2.82Å
830	I	95	Very high	93.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-61.2	-29.7	-175.4	-165.3	69.2	0	0	0	114.1	L791 I826 K832 V833 C842 I846 L875	L791-I830 HydrophobicContact CB-CD1 4.24Å; L791-I830 HydrophobicContact CD1-CD1 4.3Å; L791-I830 HydrophobicContact CD2-CD1 4.41Å; I826-I830 WeakPolarHBondContact O-CB 3.35Å; I826-I830 WeakPolarHBondContact O-CG2 3.26Å; I826-I830 PolarHBondContact O-N 3.29Å; I826-I830 VanDerWaalsContact O-N 3.08Å; I830-K832 PolarHBondContact O-N 3.1Å; I830-K832 VanDerWaalsContact O-N 3.12Å; I830-V833 HydrophobicContact CD1-CG2 3.96Å; I830-V833 PolarHBondContact O-N 3.36Å; I830-V833 VanDerWaalsContact O-N 3.12Å; I830-C842 HydrophobicContact CD1-CB 3.72Å; I830-I846 HydrophobicContact CD1-CD1 3.96Å; I830-I846 HydrophobicContact CG1-CD1 3.79Å; I830-L875 HydrophobicContact CG1-CD1 4.38Å; I830-L875 HydrophobicContact CG1-CD2 4Å; I830-L875 WeakPolarHBondContact O-CD1 3.24Å
831	Q	92.4	Very high	93.7	Very high	41 Å²	41	39 Å²	39	19%	0.192	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-59.7	-22.5	175.8	-69.3	-51.6	-62.9	0	0	113.4	E829 V833 S871 G874 L875	E829-Q831 PolarHBondContact O-N 3.04Å; Q831-V833 VanDerWaalsContact C-N 3.3Å; Q831-V833 PolarHBondContact O-N 3.05Å; Q831-S871 PolarHBondContact NE2-O 3.36Å; Q831-S871 VanDerWaalsContact NE2-O 3.08Å; Q831-G874 VanDerWaalsContact OE1-C 3.29Å; Q831-G874 PolarHBondContact OE1-O 3.05Å; Q831-L875 VanDerWaalsContact NE2-CA 3.33Å
832	K	90.2	Very high	93.8	Very high	50 Å²	50	38.9 Å²	38.9	22%	0.217	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-79.4	-12.2	-179	-58.9	-177.9	-178.8	171.1	0	113	T784 K788 E829 I830 S834	T784-K832 HydrophobicContact CG2-CD 4.12Å; K788-K832 WeakPolarHBondContact CD-O 3.48Å; K788-K832 WeakPolarHBondContact CE-O 3.43Å; K788-K832 HydrophobicContact CG-CB 4.29Å; K788-K832 PolarHBondContact NZ-O 2.93Å; E829-K832 WeakPolarHBondContact O-CB 3.24Å; E829-K832 PolarHBondContact O-N 3.2Å; E829-K832 IonicContact OE1-NZ 2.68Å; E829-K832 WeakPolarHBondContact OE2-CD 3.34Å; E829-K832 VanDerWaalsContact OE2-CE 3.31Å; E829-K832 WeakPolarHBondContact OE2-CE 3.28Å; E829-K832 IonicContact OE2-NZ 3.96Å; E829-K832 PolarHBondContact OE2-NZ 2.82Å; I830-K832 PolarHBondContact O-N 3.1Å; I830-K832 VanDerWaalsContact O-N 3.12Å; K832-S834 PolarHBondContact O-N 2.93Å
833	V	91.2	Very high	93.7	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.012	20%	0.203	C	C	.	.			trans	-70.4	117.3	179.3	178.2	0	0	0	0	109.3	L791 V792 I830 Q831 E838 K839	L791-V833 HydrophobicContact CB-CG2 4.04Å; L791-V833 HydrophobicContact CD1-CG2 3.9Å; V792-V833 HydrophobicContact CG2-CG1 4.09Å; I830-V833 HydrophobicContact CD1-CG2 3.96Å; I830-V833 PolarHBondContact O-N 3.36Å; I830-V833 VanDerWaalsContact O-N 3.12Å; Q831-V833 VanDerWaalsContact C-N 3.3Å; Q831-V833 PolarHBondContact O-N 3.05Å; V833-E838 HydrophobicContact CG1-CB 3.8Å; V833-K839 HydrophobicContact CG1-CG 4.33Å; V833-K839 WeakPolarHBondContact O-CE 3.43Å; V833-K839 WeakPolarHBondContact O-CG 3.39Å
834	S	87.9	Confident	93.8	Very high	49 Å²	49	35.4 Å²	35.4	34%	0.343	19%	0.187	S	C	.	.			trans	-107.2	160.5	176.1	50.4	0	0	0	0	110.6	K832 E838 E880	K832-S834 PolarHBondContact O-N 2.93Å; S834-E838 WeakPolarHBondContact O-CB 3.49Å; S834-E880 VanDerWaalsContact CB-OE2 3.26Å; S834-E880 WeakPolarHBondContact CB-OE2 3.34Å
835	G	87.7	Confident	93.9	Very high	28 Å²	28	29.5 Å²	29.5	29%	0.289	16%	0.162	S	C	.	.	S	Bend	trans	99.1	140.1	-178.8	0	0	0	0	0	114.1	E838 K839	G835-E838 WeakPolarHBondContact CA-OE2 3.36Å; G835-K839 VanDerWaalsContact O-CB 3.27Å; G835-K839 WeakPolarHBondContact O-CB 3.41Å; G835-K839 VanDerWaalsContact O-CG 3.24Å; G835-K839 WeakPolarHBondContact O-CG 3.27Å; G835-K839 PolarHBondContact O-N 2.89Å
836	N	88.7	Confident	94.1	Very high	139 Å²	139	28.7 Å²	28.7	74%	0.743	16%	0.157	S	C	*	.	H	α-helix	trans	-65.2	-43.6	-174.1	-73.6	-37.7	0	0	0	112.3	K840	N836-K840 VanDerWaalsContact O-CB 3.27Å; N836-K840 WeakPolarHBondContact O-CB 3.44Å; N836-K840 PolarHBondContact O-N 3.3Å
837	V	91.5	Very high	94.1	Very high	16 Å²	16	28.6 Å²	28.6	10%	0.097	16%	0.157	C	C	.	.	H	α-helix	trans	-74.3	-43.9	-179.1	173.3	0	0	0	0	110.7	K840 I841 E913 D915	V837-K840 WeakPolarHBondContact O-CB 3.4Å; V837-K840 PolarHBondContact O-N 2.99Å; V837-I841 HydrophobicContact CG1-CD1 3.87Å; V837-I841 HydrophobicContact CG1-CG1 4.39Å; V837-I841 VanDerWaalsContact O-CG1 3.32Å; V837-I841 WeakPolarHBondContact O-CG1 3.26Å; V837-I841 PolarHBondContact O-N 2.91Å; V837-E913 HydrophobicContact CG2-CG 3.92Å; V837-E913 VanDerWaalsContact CG2-OE1 3.3Å; V837-E913 WeakPolarHBondContact CG2-OE1 3.31Å; V837-D915 HydrophobicContact CG2-CB 4.39Å
838	E	94	Very high	94.1	Very high	63 Å²	63	28.9 Å²	28.9	29%	0.294	16%	0.157	S	C	.	.	H	α-helix	trans	-62.5	-47.3	-179.5	-69.4	70.7	-155.8	0	0	111.5	V792 V833 S834 G835 K840 I841 C842	V792-E838 HydrophobicContact CG1-CG 4.45Å; V792-E838 HydrophobicContact CG2-CB 3.71Å; V792-E838 HydrophobicContact CG2-CG 3.86Å; V833-E838 HydrophobicContact CG1-CB 3.8Å; S834-E838 WeakPolarHBondContact O-CB 3.49Å; G835-E838 WeakPolarHBondContact CA-OE2 3.36Å; E838-K840 VanDerWaalsContact C-N 3.29Å; E838-K840 PolarHBondContact O-N 3.38Å; E838-I841 PolarHBondContact O-N 2.83Å; E838-C842 WeakPolarHBondContact O-CB 3.43Å; E838-C842 PolarHBondContact O-N 3.11Å; E838-C842 PolarHBondContact O-SG 3.31Å
839	K	94.2	Very high	94.3	Very high	44 Å²	44	25.9 Å²	25.9	19%	0.191	14%	0.138	C	C	.	.	H	α-helix	trans	-60.3	-40.7	173.8	-74.7	-172.5	179.4	-177.3	0	111.7	V833 G835 C842 A843 L875 E880	V833-K839 HydrophobicContact CG1-CG 4.33Å; V833-K839 WeakPolarHBondContact O-CE 3.43Å; V833-K839 WeakPolarHBondContact O-CG 3.39Å; G835-K839 VanDerWaalsContact O-CB 3.27Å; G835-K839 WeakPolarHBondContact O-CB 3.41Å; G835-K839 VanDerWaalsContact O-CG 3.24Å; G835-K839 WeakPolarHBondContact O-CG 3.27Å; G835-K839 PolarHBondContact O-N 2.89Å; K839-C842 PolarHBondContact O-N 3.39Å; K839-A843 VanDerWaalsContact O-CB 3.24Å; K839-A843 WeakPolarHBondContact O-CB 3.46Å; K839-A843 PolarHBondContact O-N 2.85Å; K839-L875 HydrophobicContact CD-CD1 4.41Å; K839-L875 HydrophobicContact CG-CD1 4.12Å; K839-E880 WeakPolarHBondContact CE-OE1 3.45Å; K839-E880 VanDerWaalsContact NZ-CD 3.28Å; K839-E880 IonicContact NZ-OE1 2.66Å; K839-E880 PolarHBondContact NZ-OE1 3.3Å
840	K	95.3	Very high	94.5	Very high	29 Å²	29	24.4 Å²	24.4	13%	0.126	13%	0.131	C	C	.	.	H	α-helix	trans	-63.3	-45	177.3	180	176.8	178.2	179.4	0	111.9	N836 V837 E838 A843 V844 D915 G918 V921 P924	N836-K840 VanDerWaalsContact O-CB 3.27Å; N836-K840 WeakPolarHBondContact O-CB 3.44Å; N836-K840 PolarHBondContact O-N 3.3Å; V837-K840 WeakPolarHBondContact O-CB 3.4Å; V837-K840 PolarHBondContact O-N 2.99Å; E838-K840 VanDerWaalsContact C-N 3.29Å; E838-K840 PolarHBondContact O-N 3.38Å; K840-A843 PolarHBondContact O-N 3.29Å; K840-V844 WeakPolarHBondContact O-CG2 3.43Å; K840-V844 PolarHBondContact O-N 3.41Å; K840-D915 WeakPolarHBondContact CE-OD2 3.27Å; K840-D915 IonicContact NZ-OD1 2.85Å; K840-D915 IonicContact NZ-OD2 2.75Å; K840-D915 PolarHBondContact NZ-OD2 2.89Å; K840-G918 PolarHBondContact NZ-O 3.41Å; K840-V921 WeakPolarHBondContact CE-O 3.33Å; K840-V921 PolarHBondContact NZ-O 2.89Å; K840-P924 HydrophobicContact CG-CG 4.09Å
841	I	96.8	Very high	94.5	Very high	6 Å²	6	25.3 Å²	25.3	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-57.6	-51.8	174.7	-70.3	166	0	0	0	110	V792 N795 L796 I799 V837 E838 A843 V844 G845 P916 V917	V792-I841 HydrophobicContact CG1-CB 4.47Å; V792-I841 HydrophobicContact CG1-CD1 3.95Å; V792-I841 HydrophobicContact CG1-CG2 4.1Å; V792-I841 WeakPolarHBondContact O-CG2 3.4Å; N795-I841 HydrophobicContact CB-CG2 4.11Å; L796-I841 HydrophobicContact CB-CG2 3.86Å; I799-I841 HydrophobicContact CD1-CG2 4.13Å; I799-I841 WeakPolarHBondContact CD1-O 3.41Å; V837-I841 HydrophobicContact CG1-CD1 3.87Å; V837-I841 HydrophobicContact CG1-CG1 4.39Å; V837-I841 VanDerWaalsContact O-CG1 3.32Å; V837-I841 WeakPolarHBondContact O-CG1 3.26Å; V837-I841 PolarHBondContact O-N 2.91Å; E838-I841 PolarHBondContact O-N 2.83Å; I841-A843 VanDerWaalsContact C-N 3.33Å; I841-A843 PolarHBondContact O-N 2.93Å; I841-V844 PolarHBondContact O-N 3.3Å; I841-G845 PolarHBondContact O-N 3.47Å; I841-P916 HydrophobicContact CD1-CG 3.56Å; I841-P916 HydrophobicContact CG1-CG 3.81Å; I841-V917 HydrophobicContact CG1-CG2 4.22Å
842	C	97.6	Very high	94.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-43.6	179.3	-76.1	0	0	0	0	112.6	N795 I830 E838 K839 V844 G845 I846 L875	N795-C842 PolarHBondContact OD1-O 3.31Å; I830-C842 HydrophobicContact CD1-CB 3.72Å; E838-C842 WeakPolarHBondContact O-CB 3.43Å; E838-C842 PolarHBondContact O-N 3.11Å; E838-C842 PolarHBondContact O-SG 3.31Å; K839-C842 PolarHBondContact O-N 3.39Å; C842-V844 PolarHBondContact O-N 2.97Å; C842-G845 PolarHBondContact O-N 3.03Å; C842-I846 WeakPolarHBondContact O-CB 3.22Å; C842-I846 VanDerWaalsContact O-CG1 3.31Å; C842-I846 WeakPolarHBondContact O-CG1 3.24Å; C842-I846 PolarHBondContact O-N 3.26Å; C842-L875 HydrophobicContact CB-CD2 4Å
843	A	97.3	Very high	95	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.8	-44.8	-179.7	0	0	0	0	0	113.1	K839 K840 I841 T847 L872 L875 F876 P924	K839-A843 VanDerWaalsContact O-CB 3.24Å; K839-A843 WeakPolarHBondContact O-CB 3.46Å; K839-A843 PolarHBondContact O-N 2.85Å; K840-A843 PolarHBondContact O-N 3.29Å; I841-A843 VanDerWaalsContact C-N 3.33Å; I841-A843 PolarHBondContact O-N 2.93Å; A843-T847 WeakPolarHBondContact O-CB 3.44Å; A843-T847 PolarHBondContact O-N 3.47Å; A843-T847 PolarHBondContact O-OG1 3.33Å; A843-L872 HydrophobicContact CB-CD1 3.96Å; A843-L875 HydrophobicContact CB-CD2 4.45Å; A843-F876 HydrophobicContact CB-CE1 3.41Å; A843-F876 VanDerWaalsContact CB-CE1 3.41Å; A843-F876 HydrophobicContact CB-CZ 3.72Å; A843-P924 HydrophobicContact CB-CB 3.76Å; A843-P924 HydrophobicContact CB-CG 4.46Å
844	V	97.6	Very high	95.1	Very high	7 Å²	7	28.4 Å²	28.4	4%	0.042	16%	0.158	C	C	.	.	H	α-helix	trans	-71.4	-39.9	179.3	178.5	0	0	0	0	110.8	I799 K840 I841 C842 T847 K848 V917 V921	I799-V844 HydrophobicContact CD1-CB 3.93Å; I799-V844 HydrophobicContact CD1-CG1 4.02Å; I799-V844 HydrophobicContact CG1-CB 4.29Å; I799-V844 HydrophobicContact CG1-CG1 3.9Å; K840-V844 WeakPolarHBondContact O-CG2 3.43Å; K840-V844 PolarHBondContact O-N 3.41Å; I841-V844 PolarHBondContact O-N 3.3Å; C842-V844 PolarHBondContact O-N 2.97Å; V844-T847 WeakPolarHBondContact O-CB 3.24Å; V844-T847 PolarHBondContact O-N 3.24Å; V844-K848 WeakPolarHBondContact O-CG 3.22Å; V844-K848 PolarHBondContact O-N 3.14Å; V844-V917 HydrophobicContact CG2-CG1 4.13Å; V844-V921 HydrophobicContact CG2-CB 4.17Å; V844-V921 HydrophobicContact CG2-CG1 3.8Å; V844-V921 HydrophobicContact CG2-CG2 4.12Å
845	G	97.7	Very high	95.4	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.8	-48.6	174.9	0	0	0	0	0	112.6	N795 C798 I841 C842 T847 K848 L849	N795-G845 VanDerWaalsContact OD1-C 3.26Å; N795-G845 WeakPolarHBondContact OD1-CA 3.28Å; C798-G845 PolarHBondContact SG-O 2.85Å; I841-G845 PolarHBondContact O-N 3.47Å; C842-G845 PolarHBondContact O-N 3.03Å; G845-T847 VanDerWaalsContact C-N 3.34Å; G845-T847 PolarHBondContact O-N 3.46Å; G845-K848 PolarHBondContact O-N 2.96Å; G845-L849 PolarHBondContact O-N 3.11Å
846	I	98.4	Very high	95.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.8	-37.7	177.7	-64.4	170.2	0	0	0	111.4	N795 I826 I830 C842 K848 L849 L850 L868 L872	N795-I846 WeakPolarHBondContact OD1-CG1 2.73Å; N795-I846 PolarHBondContact OD1-N 3.05Å; N795-I846 VanDerWaalsContact OD1-N 3.14Å; I826-I846 HydrophobicContact CG2-CD1 4.12Å; I826-I846 HydrophobicContact CG2-CG1 4.42Å; I830-I846 HydrophobicContact CD1-CD1 3.96Å; I830-I846 HydrophobicContact CG1-CD1 3.79Å; C842-I846 WeakPolarHBondContact O-CB 3.22Å; C842-I846 VanDerWaalsContact O-CG1 3.31Å; C842-I846 WeakPolarHBondContact O-CG1 3.24Å; C842-I846 PolarHBondContact O-N 3.26Å; I846-K848 VanDerWaalsContact C-N 3.3Å; I846-K848 PolarHBondContact O-N 2.97Å; I846-L849 WeakPolarHBondContact O-CB 3.45Å; I846-L849 PolarHBondContact O-N 3.05Å; I846-L849 VanDerWaalsContact O-N 3.12Å; I846-L850 HydrophobicContact CG2-CD1 3.96Å; I846-L850 HydrophobicContact CG2-CG 4.31Å; I846-L850 WeakPolarHBondContact O-CG 3.26Å; I846-L850 PolarHBondContact O-N 2.97Å; I846-L868 HydrophobicContact CD1-CD1 4.48Å; I846-L868 HydrophobicContact CG1-CD1 4.41Å; I846-L868 HydrophobicContact CG2-CD1 3.69Å; I846-L868 HydrophobicContact CG2-CD2 4.06Å; I846-L868 HydrophobicContact CG2-CG 3.64Å; I846-L872 HydrophobicContact CB-CD1 4.31Å; I846-L872 HydrophobicContact CB-CD2 4.27Å; I846-L872 HydrophobicContact CG2-CB 3.94Å; I846-L872 HydrophobicContact CG2-CD2 3.92Å; I846-L872 HydrophobicContact CG2-CG 4.35Å
847	T	98	Very high	95.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-55.7	-48	173.3	-61.5	0	0	0	0	110.5	A843 V844 G845 L849 L850 T851 L928	A843-T847 WeakPolarHBondContact O-CB 3.44Å; A843-T847 PolarHBondContact O-N 3.47Å; A843-T847 PolarHBondContact O-OG1 3.33Å; V844-T847 WeakPolarHBondContact O-CB 3.24Å; V844-T847 PolarHBondContact O-N 3.24Å; G845-T847 VanDerWaalsContact C-N 3.34Å; G845-T847 PolarHBondContact O-N 3.46Å; T847-L849 VanDerWaalsContact C-N 3.35Å; T847-L849 PolarHBondContact O-N 3.35Å; T847-L850 PolarHBondContact O-N 3.06Å; T847-L850 VanDerWaalsContact O-N 3.16Å; T847-T851 WeakPolarHBondContact O-CG2 3.45Å; T847-T851 PolarHBondContact O-N 3.45Å; T847-T851 PolarHBondContact O-OG1 3.36Å; T847-L928 HydrophobicContact CG2-CB 4.48Å; T847-L928 HydrophobicContact CG2-CD1 4.07Å
848	K	97.7	Very high	95.7	Very high	37 Å²	37	23.6 Å²	23.6	16%	0.161	12%	0.122	C	C	.	.	H	α-helix	trans	-63.4	-37	176.1	-67.1	-177.1	73.8	161	0	112.6	I799 A803 V844 G845 I846 L850 T851 E852	I799-K848 HydrophobicContact CG1-CD 4.42Å; I799-K848 PolarHBondContact O-NZ 3.15Å; A803-K848 HydrophobicContact CB-CB 4.25Å; A803-K848 VanDerWaalsContact CB-O 3.29Å; A803-K848 WeakPolarHBondContact CB-O 3.44Å; V844-K848 WeakPolarHBondContact O-CG 3.22Å; V844-K848 PolarHBondContact O-N 3.14Å; G845-K848 PolarHBondContact O-N 2.96Å; I846-K848 VanDerWaalsContact C-N 3.3Å; I846-K848 PolarHBondContact O-N 2.97Å; K848-L850 VanDerWaalsContact C-N 3.31Å; K848-L850 PolarHBondContact O-N 3.39Å; K848-T851 PolarHBondContact O-N 3.08Å; K848-E852 WeakPolarHBondContact CE-OE2 2.95Å; K848-E852 IonicContact NZ-OE2 3.07Å; K848-E852 CarbonylContact O-C 3.57Å; K848-E852 WeakPolarHBondContact O-CA 3.43Å; K848-E852 WeakPolarHBondContact O-CB 3.12Å; K848-E852 PolarHBondContact O-N 2.83Å
849	L	97.9	Very high	95.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-39.1	173.6	-69.2	171.2	0	0	0	112.3	A803 L806 F818 L822 G845 I846 T847 C853 M856 L868	A803-L849 HydrophobicContact CB-CD2 3.87Å; L806-L849 HydrophobicContact CD2-CD1 4.38Å; L806-L849 HydrophobicContact CD2-CD2 3.96Å; F818-L849 HydrophobicContact CE2-CD2 3.92Å; F818-L849 HydrophobicContact CZ-CD2 3.83Å; L822-L849 HydrophobicContact CD2-CD1 4.44Å; G845-L849 PolarHBondContact O-N 3.11Å; I846-L849 WeakPolarHBondContact O-CB 3.45Å; I846-L849 PolarHBondContact O-N 3.05Å; I846-L849 VanDerWaalsContact O-N 3.12Å; T847-L849 VanDerWaalsContact C-N 3.35Å; T847-L849 PolarHBondContact O-N 3.35Å; L849-C853 WeakPolarHBondContact O-CB 3.24Å; L849-M856 WeakPolarHBondContact O-CG 3.46Å; L849-L868 HydrophobicContact CB-CD2 4.2Å
850	L	96.6	Very high	95.4	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-72.3	-32.4	178.4	-70.2	165.9	0	0	0	112.7	I846 T847 K848 W865 L868 L869 L872 L928	I846-L850 HydrophobicContact CG2-CD1 3.96Å; I846-L850 HydrophobicContact CG2-CG 4.31Å; I846-L850 WeakPolarHBondContact O-CG 3.26Å; I846-L850 PolarHBondContact O-N 2.97Å; T847-L850 PolarHBondContact O-N 3.06Å; T847-L850 VanDerWaalsContact O-N 3.16Å; K848-L850 VanDerWaalsContact C-N 3.31Å; K848-L850 PolarHBondContact O-N 3.39Å; L850-W865 HydrophobicContact CB-CZ2 4.46Å; L850-W865 HydrophobicContact CD2-CD2 3.87Å; L850-W865 HydrophobicContact CD2-CG 3.94Å; L850-W865 HydrophobicContact CD2-CZ2 4.32Å; L850-W865 WeakPolarHBondContact CD2-O 3.39Å; L850-W865 PolarHBondContact O-NE1 3.12Å; L850-L868 HydrophobicContact CD2-CB 4.11Å; L850-L868 HydrophobicContact CD2-CD2 3.84Å; L850-L868 HydrophobicContact CD2-CG 4.05Å; L850-L868 HydrophobicContact CG-CD2 4.03Å; L850-L868 HydrophobicContact CG-CG 4.31Å; L850-L869 HydrophobicContact CD1-CB 4.07Å; L850-L869 HydrophobicContact CD1-CD1 3.98Å; L850-L869 HydrophobicContact CD2-CB 4.18Å; L850-L872 HydrophobicContact CD1-CD2 4.01Å; L850-L928 HydrophobicContact CD1-CD1 4.37Å
851	T	96.2	Very high	95.3	Very high	19 Å²	19	24.9 Å²	24.9	12%	0.117	13%	0.133	C	C	.	.	H	α-helix	trans	-115.3	-14.8	-167.7	66.3	0	0	0	0	116	T847 K848 L932 L935	T847-T851 WeakPolarHBondContact O-CG2 3.45Å; T847-T851 PolarHBondContact O-N 3.45Å; T847-T851 PolarHBondContact O-OG1 3.36Å; K848-T851 PolarHBondContact O-N 3.08Å; T851-L932 HydrophobicContact CG2-CD2 3.95Å; T851-L932 HydrophobicContact CG2-CG 4.31Å; T851-L935 HydrophobicContact CG2-CB 4.41Å; T851-L935 HydrophobicContact CG2-CD2 4.31Å
852	E	95.8	Very high	95.2	Very high	86 Å²	86	26.8 Å²	26.8	40%	0.402	15%	0.145	S	C	.	.	S	Bend	trans	-131	15.1	-174.4	-57.1	-177.6	-175.5	0	0	112.7	A803 K848	A803-E852 HydrophobicContact CB-CB 4.39Å; K848-E852 WeakPolarHBondContact CE-OE2 2.95Å; K848-E852 IonicContact NZ-OE2 3.07Å; K848-E852 CarbonylContact O-C 3.57Å; K848-E852 WeakPolarHBondContact O-CA 3.43Å; K848-E852 WeakPolarHBondContact O-CB 3.12Å; K848-E852 PolarHBondContact O-N 2.83Å
853	C	96.2	Very high	94.9	Very high	4 Å²	4	33.3 Å²	33.3	3%	0.027	17%	0.173	C	C	.	.			trans	-117.8	90.1	175.1	-167.5	0	0	0	0	110.4	A803 L849 P855 M856	A803-C853 HydrophobicContact CB-CB 3.84Å; L849-C853 WeakPolarHBondContact O-CB 3.24Å; C853-P855 VanDerWaalsContact C-N 3.29Å; C853-M856 HydrophobicContact CB-CB 4.4Å; C853-M856 HydrophobicContact CB-CG 3.95Å; C853-M856 VanDerWaalsContact O-CB 3.27Å; C853-M856 WeakPolarHBondContact O-CB 3.46Å; C853-M856 PolarHBondContact O-N 3.27Å
854	P	94.4	Very high	94.8	Very high	67 Å²	67	33.9 Å²	33.9	44%	0.435	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-38.4	-179.7	-25.2	32.5	0	0	0	115	M856 M857 D858	P854-M856 PolarHBondContact O-N 3.13Å; P854-M856 VanDerWaalsContact O-N 3.07Å; P854-M857 PolarHBondContact O-N 3.34Å; P854-D858 PolarHBondContact O-N 3.43Å
855	P	94.8	Very high	94.7	Very high	19 Å²	19	33.5 Å²	33.5	12%	0.123	17%	0.174	C	C	.	.	H	α-helix	trans	-55	-27.7	174.4	-29	36.5	0	0	0	114.8	L804 Q807 C853 M857 T859 Y861	L804-P855 HydrophobicContact CD1-CG 4.01Å; Q807-P855 HydrophobicContact CG-CB 4.11Å; Q807-P855 HydrophobicContact CG-CG 4.16Å; C853-P855 VanDerWaalsContact C-N 3.29Å; P855-M857 PolarHBondContact O-N 2.93Å; P855-T859 HydrophobicContact CB-CG2 4.09Å; P855-T859 WeakPolarHBondContact O-CB 3.46Å; P855-T859 PolarHBondContact O-N 3.41Å; P855-T859 PolarHBondContact O-OG1 3.27Å; P855-Y861 HydrophobicContact CB-CD2 4.15Å
856	M	94.1	Very high	94.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67.3	-15.9	176	-75.7	-67.5	-65	0	0	113.7	F818 L822 L849 C853 P854 T862 W865 L868	F818-M856 HydrophobicContact CE1-CG 3.98Å; F818-M856 HydrophobicContact CE1-SD 3.59Å; F818-M856 VanDerWaalsContact CE1-SD 3.59Å; F818-M856 HydrophobicContact CZ-CG 4.32Å; F818-M856 HydrophobicContact CZ-SD 4.13Å; L822-M856 HydrophobicContact CD1-CE 4.15Å; L822-M856 HydrophobicContact CD1-SD 3.49Å; L822-M856 WeakPolarHBondContact CD1-SD 3.41Å; L849-M856 WeakPolarHBondContact O-CG 3.46Å; C853-M856 HydrophobicContact CB-CB 4.4Å; C853-M856 HydrophobicContact CB-CG 3.95Å; C853-M856 VanDerWaalsContact O-CB 3.27Å; C853-M856 WeakPolarHBondContact O-CB 3.46Å; C853-M856 PolarHBondContact O-N 3.27Å; P854-M856 PolarHBondContact O-N 3.13Å; P854-M856 VanDerWaalsContact O-N 3.07Å; M856-T862 VanDerWaalsContact O-CA 3.23Å; M856-T862 WeakPolarHBondContact O-CA 3.26Å; M856-W865 HydrophobicContact CE-CB 4.04Å; M856-W865 HydrophobicContact CE-CG 4.43Å; M856-L868 HydrophobicContact CE-CD2 3.83Å
857	M	89.7	Confident	94.4	Very high	11 Å²	11	36 Å²	36	5%	0.054	19%	0.19	C	C	.	.	H	α-helix	trans	-115	-30.9	176.9	-61.8	-177	80.9	0	0	112.5	P854 P855 T862 L935 R942 V943 M946	P854-M857 PolarHBondContact O-N 3.34Å; P855-M857 PolarHBondContact O-N 2.93Å; M857-T862 PolarHBondContact O-OG1 2.94Å; M857-L935 HydrophobicContact CE-CD2 4.38Å; M857-L935 HydrophobicContact SD-CD1 3.86Å; M857-L935 HydrophobicContact SD-CD2 3.85Å; M857-L935 HydrophobicContact SD-CG 4.18Å; M857-R942 VanDerWaalsContact C-NH2 3.25Å; M857-R942 HydrophobicContact CE-CB 4.14Å; M857-R942 VanDerWaalsContact CE-CD 3.5Å; M857-R942 HydrophobicContact CE-CG 3.61Å; M857-R942 PolarHBondContact O-NH2 3.34Å; M857-V943 HydrophobicContact CE-CG2 4.28Å; M857-M946 HydrophobicContact CE-SD 3.61Å; M857-M946 HydrophobicContact CG-CE 4.31Å; M857-M946 HydrophobicContact CG-SD 4.34Å
858	D	88.9	Confident	94.4	Very high	102 Å²	102	36 Å²	36	55%	0.545	19%	0.19	S	C	.	.	H	α-helix	trans	-100.3	0.8	-169	-62.8	-36.2	0	0	0	114.2	P854 R942	P854-D858 PolarHBondContact O-N 3.43Å; D858-R942 IonicContact OD1-CZ 3.17Å; D858-R942 IonicContact OD1-NH1 2.74Å; D858-R942 PolarHBondContact OD1-NH1 3.07Å; D858-R942 IonicContact OD1-NH2 2.7Å; D858-R942 PolarHBondContact OD1-NH2 3.45Å
859	T	91.9	Very high	94.3	Very high	60 Å²	60	34.2 Å²	34.2	37%	0.368	18%	0.182	S	C	.	.	S	Bend	trans	-131	-171.7	-176.7	76.7	0	0	0	0	112.4	P855 Y861 T862	P855-T859 HydrophobicContact CB-CG2 4.09Å; P855-T859 WeakPolarHBondContact O-CB 3.46Å; P855-T859 PolarHBondContact O-N 3.41Å; P855-T859 PolarHBondContact O-OG1 3.27Å; T859-Y861 PolarHBondContact O-N 3.43Å; T859-Y861 VanDerWaalsContact O-N 3.1Å; T859-Y861 VanDerWaalsContact OG1-CD2 3.27Å; T859-Y861 WeakPolarHBondContact OG1-CD2 3.46Å; T859-Y861 PolarHBondContact OG1-N 3.25Å; T859-T862 WeakPolarHBondContact O-CB 3.43Å; T859-T862 PolarHBondContact O-N 3.14Å; T859-T862 VanDerWaalsContact O-N 3.15Å; T859-T862 PolarHBondContact O-OG1 3.18Å
860	E	90.5	Very high	94.2	Very high	90 Å²	90	37.4 Å²	37.4	42%	0.421	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.6	173.8	67.9	-174.6	138.8	0	0	114.2	K816 T862 K863	K816-E860 WeakPolarHBondContact CD-OE1 3.35Å; K816-E860 WeakPolarHBondContact CE-OE1 3.5Å; K816-E860 WeakPolarHBondContact CG-OE1 3.49Å; K816-E860 IonicContact NZ-OE1 3.08Å; K816-E860 PolarHBondContact NZ-OE1 3.05Å; K816-E860 IonicContact NZ-OE2 3.76Å; K816-E860 PolarHBondContact NZ-OE2 3.29Å; E860-T862 PolarHBondContact O-N 3.49Å; E860-K863 WeakPolarHBondContact O-CG 3.31Å
861	Y	94.2	Very high	94.1	Very high	13 Å²	13	38.1 Å²	38.1	5%	0.051	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-11.7	175.6	-53.5	-36.2	0	0	0	113.8	Q807 D811 K816 F818 P855 T859 K863 L864	Q807-Y861 HydrophobicContact CG-CE2 4.44Å; D811-Y861 PolarHBondContact OD1-OH 3.2Å; D811-Y861 VanDerWaalsContact OD1-OH 3.06Å; D811-Y861 WeakPolarHBondContact OD2-CE2 3.12Å; D811-Y861 PolarHBondContact OD2-OH 3.45Å; K816-Y861 VanDerWaalsContact CA-OH 3.27Å; K816-Y861 WeakPolarHBondContact CA-OH 3.49Å; F818-Y861 HydrophobicContact CB-CE2 4.3Å; F818-Y861 AromaticContact CD1-CD2 3.7Å; F818-Y861 HydrophobicContact CD1-CD2 3.7Å; F818-Y861 AromaticContact CD1-CE2 3.73Å; F818-Y861 HydrophobicContact CD1-CE2 3.73Å; F818-Y861 HydrophobicContact CD1-CG 4.26Å; F818-Y861 HydrophobicContact CE1-CD2 4.23Å; F818-Y861 HydrophobicContact CG-CE2 4.5Å; P855-Y861 HydrophobicContact CB-CD2 4.15Å; T859-Y861 PolarHBondContact O-N 3.43Å; T859-Y861 VanDerWaalsContact O-N 3.1Å; T859-Y861 VanDerWaalsContact OG1-CD2 3.27Å; T859-Y861 WeakPolarHBondContact OG1-CD2 3.46Å; T859-Y861 PolarHBondContact OG1-N 3.25Å; Y861-K863 PolarHBondContact O-N 2.93Å; Y861-K863 VanDerWaalsContact O-N 3.07Å; Y861-L864 WeakPolarHBondContact O-CA 3.41Å; Y861-L864 WeakPolarHBondContact O-CB 3.34Å; Y861-L864 PolarHBondContact O-N 3.32Å
862	T	93.1	Very high	94.2	Very high	46 Å²	46	37.2 Å²	37.2	28%	0.282	20%	0.197	S	C	.	.	H	α-helix	trans	-51.4	-34.7	176.4	-51.6	0	0	0	0	113	M856 M857 T859 E860 L864 W865 M946	M856-T862 VanDerWaalsContact O-CA 3.23Å; M856-T862 WeakPolarHBondContact O-CA 3.26Å; M857-T862 PolarHBondContact O-OG1 2.94Å; T859-T862 WeakPolarHBondContact O-CB 3.43Å; T859-T862 PolarHBondContact O-N 3.14Å; T859-T862 VanDerWaalsContact O-N 3.15Å; T859-T862 PolarHBondContact O-OG1 3.18Å; E860-T862 PolarHBondContact O-N 3.49Å; T862-L864 PolarHBondContact O-N 2.9Å; T862-W865 WeakPolarHBondContact O-CB 3.44Å; T862-W865 PolarHBondContact O-N 3.38Å; T862-M946 HydrophobicContact CG2-CE 3.81Å; T862-M946 HydrophobicContact CG2-SD 4.48Å
863	K	93.1	Very high	94.2	Very high	137 Å²	137	33.3 Å²	33.3	60%	0.596	18%	0.178	S	C	*	.	H	α-helix	trans	-63	-22	176.4	73	-171	179.5	173.5	0	114.1	E860 Y861 P867	E860-K863 WeakPolarHBondContact O-CG 3.31Å; Y861-K863 PolarHBondContact O-N 2.93Å; Y861-K863 VanDerWaalsContact O-N 3.07Å; K863-P867 WeakPolarHBondContact O-CD 3.27Å
864	L	95.1	Very high	94.1	Very high	11 Å²	11	33.6 Å²	33.6	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-93.8	-11.1	-179.3	-59	176.2	0	0	0	112.7	G819 L822 E823 I827 Y861 T862 P867 L868	G819-L864 WeakPolarHBondContact O-CD1 3.49Å; L822-L864 HydrophobicContact CB-CD1 4.02Å; L822-L864 HydrophobicContact CD1-CD1 4.4Å; E823-L864 HydrophobicContact CB-CD1 4.34Å; E823-L864 HydrophobicContact CB-CD2 3.89Å; E823-L864 HydrophobicContact CG-CD2 3.95Å; I827-L864 HydrophobicContact CD1-CD2 4.4Å; Y861-L864 WeakPolarHBondContact O-CA 3.41Å; Y861-L864 WeakPolarHBondContact O-CB 3.34Å; Y861-L864 PolarHBondContact O-N 3.32Å; T862-L864 PolarHBondContact O-N 2.9Å; L864-P867 WeakPolarHBondContact O-CD 3.25Å; L864-L868 VanDerWaalsContact O-CB 3.23Å; L864-L868 WeakPolarHBondContact O-CB 3.48Å; L864-L868 PolarHBondContact O-N 3.11Å
865	W	95.3	Very high	94	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.1	-50.2	-176.7	-169.3	101.8	0	0	0	112.3	L850 M856 T862 L868 L869 L932 L935 V943 M946 V947	L850-W865 HydrophobicContact CB-CZ2 4.46Å; L850-W865 HydrophobicContact CD2-CD2 3.87Å; L850-W865 HydrophobicContact CD2-CG 3.94Å; L850-W865 HydrophobicContact CD2-CZ2 4.32Å; L850-W865 WeakPolarHBondContact CD2-O 3.39Å; L850-W865 PolarHBondContact O-NE1 3.12Å; M856-W865 HydrophobicContact CE-CB 4.04Å; M856-W865 HydrophobicContact CE-CG 4.43Å; T862-W865 WeakPolarHBondContact O-CB 3.44Å; T862-W865 PolarHBondContact O-N 3.38Å; W865-L868 PolarHBondContact O-N 3.23Å; W865-L869 HydrophobicContact CH2-CD2 3.79Å; W865-L869 HydrophobicContact CZ3-CB 4.38Å; W865-L869 HydrophobicContact CZ3-CD2 3.58Å; W865-L869 PolarHBondContact O-N 3.19Å; W865-L932 HydrophobicContact CH2-CD2 3.79Å; W865-L932 HydrophobicContact CZ2-CD2 3.63Å; W865-L935 HydrophobicContact CZ2-CD2 4.34Å; W865-V943 HydrophobicContact CH2-CG1 3.89Å; W865-V943 HydrophobicContact CZ2-CG1 4.27Å; W865-M946 HydrophobicContact CB-CE 3.36Å; W865-M946 HydrophobicContact CD2-CE 3.46Å; W865-M946 VanDerWaalsContact CD2-CE 3.46Å; W865-M946 HydrophobicContact CE3-CB 4.01Å; W865-M946 HydrophobicContact CE3-CE 3.87Å; W865-M946 HydrophobicContact CG-CE 3.21Å; W865-M946 HydrophobicContact CZ3-CB 4.15Å; W865-V947 HydrophobicContact CH2-CG2 4.02Å; W865-V947 HydrophobicContact CZ3-CG2 3.84Å
866	T	94.5	Very high	94	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.043	16%	0.164	C	C	.	.	H	α-helix	trans	-68.5	-44.3	-179.6	-47.8	0	0	0	0	112.7	L868 L869 Q870 M946 S950 L951	T866-L868 VanDerWaalsContact C-N 3.3Å; T866-L868 PolarHBondContact O-N 3.49Å; T866-L869 PolarHBondContact O-N 3.3Å; T866-Q870 PolarHBondContact O-N 2.92Å; T866-M946 PolarHBondContact OG1-O 3.21Å; T866-S950 VanDerWaalsContact CB-OG 3.29Å; T866-S950 WeakPolarHBondContact CB-OG 3.38Å; T866-S950 VanDerWaalsContact CG2-OG 3.27Å; T866-S950 WeakPolarHBondContact CG2-OG 3.19Å; T866-L951 HydrophobicContact CG2-CB 3.81Å; T866-L951 HydrophobicContact CG2-CD1 4.17Å
867	P	95.1	Very high	93.9	Very high	45 Å²	45	34.3 Å²	34.3	29%	0.292	18%	0.178	S	C	.	.	H	α-helix	trans	-55.6	-40.9	170	-29.3	36.6	0	0	0	113.9	I827 K863 L864 Q870 S871	I827-P867 HydrophobicContact CD1-CB 3.8Å; K863-P867 WeakPolarHBondContact O-CD 3.27Å; L864-P867 WeakPolarHBondContact O-CD 3.25Å; P867-Q870 PolarHBondContact O-N 3.15Å; P867-S871 PolarHBondContact O-N 2.92Å; P867-S871 PolarHBondContact O-OG 3.24Å
868	L	96.6	Very high	93.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.6	-43.2	177.8	-178.6	64.8	0	0	0	112.1	L822 I826 I827 I846 L849 L850 M856 L864 W865 T866 Q870 S871 L872	L822-L868 HydrophobicContact CD2-CD1 3.94Å; L822-L868 HydrophobicContact CD2-CD2 3.86Å; L822-L868 HydrophobicContact CD2-CG 4.48Å; I826-L868 HydrophobicContact CG2-CD1 3.71Å; I827-L868 HydrophobicContact CD1-CB 4.42Å; I827-L868 HydrophobicContact CG1-CB 4.34Å; I827-L868 HydrophobicContact CG1-CD1 4.23Å; I846-L868 HydrophobicContact CD1-CD1 4.48Å; I846-L868 HydrophobicContact CG1-CD1 4.41Å; I846-L868 HydrophobicContact CG2-CD1 3.69Å; I846-L868 HydrophobicContact CG2-CD2 4.06Å; I846-L868 HydrophobicContact CG2-CG 3.64Å; L849-L868 HydrophobicContact CB-CD2 4.2Å; L850-L868 HydrophobicContact CD2-CB 4.11Å; L850-L868 HydrophobicContact CD2-CD2 3.84Å; L850-L868 HydrophobicContact CD2-CG 4.05Å; L850-L868 HydrophobicContact CG-CD2 4.03Å; L850-L868 HydrophobicContact CG-CG 4.31Å; M856-L868 HydrophobicContact CE-CD2 3.83Å; L864-L868 VanDerWaalsContact O-CB 3.23Å; L864-L868 WeakPolarHBondContact O-CB 3.48Å; L864-L868 PolarHBondContact O-N 3.11Å; W865-L868 PolarHBondContact O-N 3.23Å; T866-L868 VanDerWaalsContact C-N 3.3Å; T866-L868 PolarHBondContact O-N 3.49Å; L868-Q870 VanDerWaalsContact C-N 3.31Å; L868-Q870 PolarHBondContact O-N 3.35Å; L868-S871 PolarHBondContact O-N 3.23Å; L868-L872 PolarHBondContact O-N 2.97Å
869	L	96.6	Very high	93.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-42.2	173.5	175.7	62.1	0	0	0	111.4	L850 W865 T866 L872 I873 L928 L932 V947 L951 L959	L850-L869 HydrophobicContact CD1-CB 4.07Å; L850-L869 HydrophobicContact CD1-CD1 3.98Å; L850-L869 HydrophobicContact CD2-CB 4.18Å; W865-L869 HydrophobicContact CH2-CD2 3.79Å; W865-L869 HydrophobicContact CZ3-CB 4.38Å; W865-L869 HydrophobicContact CZ3-CD2 3.58Å; W865-L869 PolarHBondContact O-N 3.19Å; T866-L869 PolarHBondContact O-N 3.3Å; L869-L872 PolarHBondContact O-N 3.42Å; L869-I873 HydrophobicContact CD1-CD1 4.08Å; L869-I873 HydrophobicContact CD1-CG1 4.36Å; L869-I873 HydrophobicContact CG-CD1 3.99Å; L869-I873 WeakPolarHBondContact O-CG1 3.49Å; L869-I873 PolarHBondContact O-N 3.45Å; L869-L928 HydrophobicContact CD1-CD1 4.22Å; L869-L928 HydrophobicContact CD1-CD2 4.01Å; L869-L932 HydrophobicContact CD1-CD1 4.23Å; L869-V947 HydrophobicContact CD2-CG2 4.06Å; L869-L951 HydrophobicContact CD2-CD2 4.4Å; L869-L959 HydrophobicContact CD2-CD2 4.08Å
870	Q	95.5	Very high	92.3	Very high	66 Å²	66	39.9 Å²	39.9	31%	0.308	21%	0.208	S	C	.	.	H	α-helix	trans	-62.1	-44.1	176.9	-167.2	170.5	-41.2	0	0	111.8	T866 P867 L868 L872 I873 G874 L951 N952 A955	T866-Q870 PolarHBondContact O-N 2.92Å; P867-Q870 PolarHBondContact O-N 3.15Å; L868-Q870 VanDerWaalsContact C-N 3.31Å; L868-Q870 PolarHBondContact O-N 3.35Å; Q870-L872 VanDerWaalsContact C-N 3.32Å; Q870-L872 PolarHBondContact O-N 3.24Å; Q870-I873 PolarHBondContact O-N 3.14Å; Q870-G874 PolarHBondContact O-N 3.08Å; Q870-L951 HydrophobicContact CB-CD1 3.69Å; Q870-L951 HydrophobicContact CG-CD1 4.08Å; Q870-N952 PolarHBondContact NE2-ND2 3.47Å; Q870-A955 HydrophobicContact CG-CB 4.23Å
871	S	95.2	Very high	91.2	Very high	18 Å²	18	38.3 Å²	38.3	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-35.9	176	-68	0	0	0	0	112.8	I827 Q831 P867 L868 G874 L875	I827-S871 WeakPolarHBondContact CA-OG 3.45Å; I827-S871 WeakPolarHBondContact CG2-OG 3.41Å; I827-S871 PolarHBondContact O-OG 3.01Å; Q831-S871 PolarHBondContact NE2-O 3.36Å; Q831-S871 VanDerWaalsContact NE2-O 3.08Å; P867-S871 PolarHBondContact O-N 2.92Å; P867-S871 PolarHBondContact O-OG 3.24Å; L868-S871 PolarHBondContact O-N 3.23Å; S871-G874 PolarHBondContact O-N 2.89Å; S871-L875 PolarHBondContact O-N 3.26Å
872	L	96.9	Very high	89.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66.3	-42.3	173.5	177	57.8	0	0	0	112.1	A843 I846 L850 L868 L869 Q870 G874 L875 F876 L928	A843-L872 HydrophobicContact CB-CD1 3.96Å; I846-L872 HydrophobicContact CB-CD1 4.31Å; I846-L872 HydrophobicContact CB-CD2 4.27Å; I846-L872 HydrophobicContact CG2-CB 3.94Å; I846-L872 HydrophobicContact CG2-CD2 3.92Å; I846-L872 HydrophobicContact CG2-CG 4.35Å; L850-L872 HydrophobicContact CD1-CD2 4.01Å; L868-L872 PolarHBondContact O-N 2.97Å; L869-L872 PolarHBondContact O-N 3.42Å; Q870-L872 VanDerWaalsContact C-N 3.32Å; Q870-L872 PolarHBondContact O-N 3.24Å; L872-G874 VanDerWaalsContact C-N 3.29Å; L872-G874 PolarHBondContact O-N 3.07Å; L872-L875 HydrophobicContact CD1-CD2 4.44Å; L872-L875 WeakPolarHBondContact O-CB 3.41Å; L872-L875 PolarHBondContact O-N 3.5Å; L872-L875 VanDerWaalsContact O-N 3.14Å; L872-F876 HydrophobicContact CD1-CE1 4.07Å; L872-F876 HydrophobicContact CD1-CE2 3.94Å; L872-F876 HydrophobicContact CD1-CZ 3.61Å; L872-F876 HydrophobicContact CD2-CE2 4.43Å; L872-F876 HydrophobicContact CG-CE2 3.86Å; L872-F876 HydrophobicContact CG-CZ 4.05Å; L872-F876 WeakPolarHBondContact O-CD2 3.28Å; L872-F876 PolarHBondContact O-N 3.31Å; L872-L928 HydrophobicContact CD2-CD1 3.72Å; L872-L928 HydrophobicContact CD2-CD2 3.78Å; L872-L928 HydrophobicContact CD2-CG 4.26Å; L872-L928 HydrophobicContact CG-CD2 4.25Å
873	I	96.1	Very high	87.6	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-39.5	174.8	-66.5	164.9	0	0	0	110.2	L869 Q870 L875 F876 E877 L951 A955 Y958 L959 Y962	L869-I873 HydrophobicContact CD1-CD1 4.08Å; L869-I873 HydrophobicContact CD1-CG1 4.36Å; L869-I873 HydrophobicContact CG-CD1 3.99Å; L869-I873 WeakPolarHBondContact O-CG1 3.49Å; L869-I873 PolarHBondContact O-N 3.45Å; Q870-I873 PolarHBondContact O-N 3.14Å; I873-L875 VanDerWaalsContact C-N 3.26Å; I873-L875 PolarHBondContact O-N 3.4Å; I873-F876 WeakPolarHBondContact O-CB 3.48Å; I873-F876 PolarHBondContact O-N 3.02Å; I873-F876 VanDerWaalsContact O-N 3.12Å; I873-E877 HydrophobicContact CG2-CG 4.43Å; I873-E877 PolarHBondContact O-N 3.17Å; I873-L951 HydrophobicContact CD1-CD1 4.42Å; I873-L951 HydrophobicContact CD1-CD2 4.25Å; I873-A955 HydrophobicContact CB-CB 4.25Å; I873-A955 HydrophobicContact CD1-CB 3.88Å; I873-A955 HydrophobicContact CG2-CB 3.86Å; I873-Y958 HydrophobicContact CG2-CD2 4.2Å; I873-Y958 HydrophobicContact CG2-CG 4.41Å; I873-L959 HydrophobicContact CD1-CB 4.07Å; I873-Y962 HydrophobicContact CG1-CE2 4.19Å
874	G	93.9	Very high	85.5	Confident	10 Å²	10	43.8 Å²	43.8	10%	0.103	24%	0.241	C	C	.	.	H	α-helix	trans	-53.9	-45.1	171.2	0	0	0	0	0	111.8	Q831 Q870 S871 L872 F876 E877 L878	Q831-G874 VanDerWaalsContact OE1-C 3.29Å; Q831-G874 PolarHBondContact OE1-O 3.05Å; Q870-G874 PolarHBondContact O-N 3.08Å; S871-G874 PolarHBondContact O-N 2.89Å; L872-G874 VanDerWaalsContact C-N 3.29Å; L872-G874 PolarHBondContact O-N 3.07Å; G874-F876 PolarHBondContact O-N 3.06Å; G874-F876 VanDerWaalsContact O-N 3.08Å; G874-E877 PolarHBondContact O-N 3.31Å; G874-E877 VanDerWaalsContact O-N 3.15Å; G874-L878 WeakPolarHBondContact O-CB 3.37Å; G874-L878 PolarHBondContact O-N 3.4Å
875	L	94.1	Very high	82.8	Confident	9 Å²	9	48.7 Å²	48.7	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-24.1	-176.7	-176.6	66	0	0	0	112	I830 Q831 K839 C842 A843 S871 L872 I873	I830-L875 HydrophobicContact CG1-CD1 4.38Å; I830-L875 HydrophobicContact CG1-CD2 4Å; I830-L875 WeakPolarHBondContact O-CD1 3.24Å; Q831-L875 VanDerWaalsContact NE2-CA 3.33Å; K839-L875 HydrophobicContact CD-CD1 4.41Å; K839-L875 HydrophobicContact CG-CD1 4.12Å; C842-L875 HydrophobicContact CB-CD2 4Å; A843-L875 HydrophobicContact CB-CD2 4.45Å; S871-L875 PolarHBondContact O-N 3.26Å; L872-L875 HydrophobicContact CD1-CD2 4.44Å; L872-L875 WeakPolarHBondContact O-CB 3.41Å; L872-L875 PolarHBondContact O-N 3.5Å; L872-L875 VanDerWaalsContact O-N 3.14Å; I873-L875 VanDerWaalsContact C-N 3.26Å; I873-L875 PolarHBondContact O-N 3.4Å
876	F	93.9	Very high	80.2	Confident	32 Å²	32	56.3 Å²	56.3	14%	0.14	32%	0.315	C	S	.	.	H	α-helix	trans	-88.5	-28.9	179.9	-68.3	-26.7	0	0	0	115	A843 L872 I873 G874 P924 K925 L928 Y962	A843-F876 HydrophobicContact CB-CE1 3.41Å; A843-F876 VanDerWaalsContact CB-CE1 3.41Å; A843-F876 HydrophobicContact CB-CZ 3.72Å; L872-F876 HydrophobicContact CD1-CE1 4.07Å; L872-F876 HydrophobicContact CD1-CE2 3.94Å; L872-F876 HydrophobicContact CD1-CZ 3.61Å; L872-F876 HydrophobicContact CD2-CE2 4.43Å; L872-F876 HydrophobicContact CG-CE2 3.86Å; L872-F876 HydrophobicContact CG-CZ 4.05Å; L872-F876 WeakPolarHBondContact O-CD2 3.28Å; L872-F876 PolarHBondContact O-N 3.31Å; I873-F876 WeakPolarHBondContact O-CB 3.48Å; I873-F876 PolarHBondContact O-N 3.02Å; I873-F876 VanDerWaalsContact O-N 3.12Å; G874-F876 PolarHBondContact O-N 3.06Å; G874-F876 VanDerWaalsContact O-N 3.08Å; F876-P924 HydrophobicContact CE1-CB 3.7Å; F876-P924 HydrophobicContact CZ-CB 3.84Å; F876-K925 HydrophobicContact CB-CD 4.23Å; F876-K925 HydrophobicContact CB-CG 4.31Å; F876-K925 HydrophobicContact CD1-CG 4.19Å; F876-K925 HydrophobicContact CD2-CG 3.88Å; F876-K925 HydrophobicContact CE1-CG 4.45Å; F876-K925 HydrophobicContact CE2-CB 4.49Å; F876-K925 HydrophobicContact CE2-CG 4.17Å; F876-K925 HydrophobicContact CG-CD 4.35Å; F876-K925 HydrophobicContact CG-CG 3.89Å; F876-K925 HydrophobicContact CZ-CG 4.44Å; F876-K925 PolarHBondContact O-NZ 3.07Å; F876-L928 HydrophobicContact CE2-CB 4.45Å; F876-L928 HydrophobicContact CE2-CD2 3.87Å; F876-Y962 AromaticContact CD2-CE2 3.95Å; F876-Y962 HydrophobicContact CD2-CE2 3.95Å
877	E	92.2	Very high	77.7	Confident	60 Å²	60	60.9 Å²	60.9	28%	0.28	34%	0.336	S	S	.	.	H	α-helix	trans	-126.2	-25.7	-163.7	-58.4	-60.7	162.6	0	0	114	I873 G874 K925 Y958 Y962	I873-E877 HydrophobicContact CG2-CG 4.43Å; I873-E877 PolarHBondContact O-N 3.17Å; G874-E877 PolarHBondContact O-N 3.31Å; G874-E877 VanDerWaalsContact O-N 3.15Å; E877-K925 VanDerWaalsContact CD-NZ 3.26Å; E877-K925 IonicContact OE1-NZ 3.44Å; E877-K925 PolarHBondContact OE1-NZ 3.4Å; E877-K925 IonicContact OE2-NZ 3.12Å; E877-K925 PolarHBondContact OE2-NZ 2.81Å; E877-Y958 HydrophobicContact CB-CD1 4.47Å; E877-Y958 HydrophobicContact CB-CD2 4.3Å; E877-Y958 HydrophobicContact CB-CE1 4.27Å; E877-Y958 HydrophobicContact CB-CE2 4.09Å; E877-Y958 HydrophobicContact CB-CG 4.49Å; E877-Y958 HydrophobicContact CG-CD1 3.71Å; E877-Y958 HydrophobicContact CG-CD2 4.01Å; E877-Y958 HydrophobicContact CG-CE1 3.95Å; E877-Y958 HydrophobicContact CG-CE2 4.23Å; E877-Y958 HydrophobicContact CG-CG 3.76Å; E877-Y962 VanDerWaalsContact CD-OH 3.32Å; E877-Y962 WeakPolarHBondContact CG-OH 3.25Å; E877-Y962 VanDerWaalsContact OE1-CE1 3.24Å; E877-Y962 WeakPolarHBondContact OE1-CE1 3.44Å; E877-Y962 PolarHBondContact OE1-OH 3.47Å
878	L	87.3	Confident	74.6	Confident	100 Å²	100	67.5 Å²	67.5	52%	0.524	36%	0.363	S	S	.	.	S	Bend	trans	-79.3	147.2	174.5	-62	175.7	0	0	0	109.7	G874	G874-L878 WeakPolarHBondContact O-CB 3.37Å; G874-L878 PolarHBondContact O-N 3.4Å
879	P	79.4	Confident	71.3	Confident	107 Å²	107	74.6 Å²	74.6	70%	0.695	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-59.6	158.5	171.8	27.1	-34	0	0	0	110.5
880	E	71.1	Confident	68	Low	84 Å²	84	83 Å²	83	39%	0.393	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-58.2	143.9	170.2	-68.9	-171.6	-168.7	0	0	109.9	S834 K839 D882	S834-E880 VanDerWaalsContact CB-OE2 3.26Å; S834-E880 WeakPolarHBondContact CB-OE2 3.34Å; K839-E880 WeakPolarHBondContact CE-OE1 3.45Å; K839-E880 VanDerWaalsContact NZ-CD 3.28Å; K839-E880 IonicContact NZ-OE1 2.66Å; K839-E880 PolarHBondContact NZ-OE1 3.3Å; E880-D882 PolarHBondContact O-N 3.04Å
881	D	65.7	Low	64.9	Low	57 Å²	57	85.5 Å²	85.5	31%	0.305	45%	0.446	S	S	.	.			trans	-72.6	95.1	175	-176.2	-0.9	0	0	0	109.4	T883	D881-T883 PolarHBondContact O-N 3.48Å; D881-T883 VanDerWaalsContact OD1-CB 3.31Å; D881-T883 WeakPolarHBondContact OD1-CB 3.31Å; D881-T883 VanDerWaalsContact OD1-CG2 3.32Å; D881-T883 WeakPolarHBondContact OD1-CG2 3.48Å; D881-T883 PolarHBondContact OD1-N 2.98Å; D881-T883 VanDerWaalsContact OD1-N 3.14Å; D881-T883 PolarHBondContact OD1-OG1 3.24Å; D881-T883 PolarHBondContact OD2-OG1 3.48Å
882	D	58	Low	61.7	Low	139 Å²	139	90 Å²	90	74%	0.743	47%	0.47	S	S	*	.			trans	-75.7	4.6	179.8	-62	-24.5	0	0	0	113.4	E880 I884	E880-D882 PolarHBondContact O-N 3.04Å; D882-I884 PolarHBondContact O-N 3.01Å
883	T	53.9	Low	59	Low	119 Å²	119	93.4 Å²	93.4	73%	0.73	49%	0.487	S	S	*	.			trans	-71.2	6.6	-178.7	61.8	0	0	0	0	114.4	D881	D881-T883 PolarHBondContact O-N 3.48Å; D881-T883 VanDerWaalsContact OD1-CB 3.31Å; D881-T883 WeakPolarHBondContact OD1-CB 3.31Å; D881-T883 VanDerWaalsContact OD1-CG2 3.32Å; D881-T883 WeakPolarHBondContact OD1-CG2 3.48Å; D881-T883 PolarHBondContact OD1-N 2.98Å; D881-T883 VanDerWaalsContact OD1-N 3.14Å; D881-T883 PolarHBondContact OD1-OG1 3.24Å; D881-T883 PolarHBondContact OD2-OG1 3.48Å
884	I	49.8	Very low	55.9	Low	52 Å²	52	100 Å²	100	27%	0.267	52%	0.517	S	S	.	.	S	Bend	trans	-122.3	125.1	-177.7	-55.1	159.2	0	0	0	107	T784 D882 D886	T784-I884 HydrophobicContact CG2-CD1 3.6Å; D882-I884 PolarHBondContact O-N 3.01Å; I884-D886 PolarHBondContact O-N 2.77Å
885	P	38.7	Very low	53.1	Low	114 Å²	114	106.7 Å²	106.7	74%	0.74	55%	0.551	S	S	*	*			trans	-52	134.4	-179.3	-22.1	30.2	0	0	0	110.9	E887	P885-E887 PolarHBondContact O-N 2.65Å; P885-E887 VanDerWaalsContact O-N 3.11Å
886	D	39.4	Very low	50	Low	161 Å²	161	110.5 Å²	110.5	86%	0.861	58%	0.575	S	S	*	*			trans	-45.9	121.5	168.6	-81.8	-36.6	0	0	0	108.4	I884 E888	I884-D886 PolarHBondContact O-N 2.77Å; D886-E888 PolarHBondContact O-N 2.65Å; D886-E888 VanDerWaalsContact O-N 3.14Å
887	E	41.8	Very low	47.2	Very low	102 Å²	102	114.3 Å²	114.3	48%	0.477	60%	0.602	S	S	.	*			trans	-56.6	122.4	-178.2	-67.4	-175.5	-179.8	0	0	108.6	P885 H889	P885-E887 PolarHBondContact O-N 2.65Å; P885-E887 VanDerWaalsContact O-N 3.11Å; E887-H889 PolarHBondContact O-N 3.27Å; E887-H889 IonicContact OE2-CE1 3.57Å; E887-H889 PolarHBondContact OE2-CE1 2.99Å; E887-H889 VanDerWaalsContact OE2-CE1 3.26Å; E887-H889 IonicContact OE2-NE2 2.69Å; E887-H889 PolarHBondContact OE2-NE2 3Å
888	E	29.8	Very low	44.4	Very low	185 Å²	185	113.8 Å²	113.8	86%	0.864	61%	0.613	S	S	*	*			trans	-56.1	80.4	168.8	-69.6	173.9	163.4	0	0	109.2	D886 F890	D886-E888 PolarHBondContact O-N 2.65Å; D886-E888 VanDerWaalsContact O-N 3.14Å; E888-F890 VanDerWaalsContact C-N 3.28Å
889	H	28.7	Very low	42.2	Very low	148 Å²	148	119.4 Å²	119.4	69%	0.685	63%	0.629	S	S	*	*			trans	-89.1	5.6	174.7	-77.6	-36.8	0	0	0	112.9	E887 I891	E887-H889 PolarHBondContact O-N 3.27Å; E887-H889 IonicContact OE2-CE1 3.57Å; E887-H889 PolarHBondContact OE2-CE1 2.99Å; E887-H889 VanDerWaalsContact OE2-CE1 3.26Å; E887-H889 IonicContact OE2-NE2 2.69Å; E887-H889 PolarHBondContact OE2-NE2 3Å; H889-I891 PolarHBondContact O-N 3.27Å
890	F	26	Very low	40.7	Very low	178 Å²	178	120.7 Å²	120.7	78%	0.781	63%	0.626	S	S	*	*			trans	-94.7	86.6	160.7	-73.2	-85	0	0	0	108	E888 D892	E888-F890 VanDerWaalsContact C-N 3.28Å; F890-D892 PolarHBondContact O-N 2.93Å
891	I	30.6	Very low	40	Very low	117 Å²	117	118.1 Å²	118.1	60%	0.6	62%	0.616	S	S	*	*			trans	-69.8	85.9	145	-58.1	172.8	0	0	0	103.4	H889	H889-I891 PolarHBondContact O-N 3.27Å
892	D	29.3	Very low	40	Very low	114 Å²	114	119 Å²	119	61%	0.61	63%	0.631	S	S	*	*			trans	-52.5	146	154	-92.8	-32.1	0	0	0	106.2	F890 E894	F890-D892 PolarHBondContact O-N 2.93Å; D892-E894 PolarHBondContact O-N 3.49Å
893	I	38.8	Very low	41.2	Very low	70 Å²	70	113.7 Å²	113.7	36%	0.359	60%	0.601	S	S	.	*			trans	-66.5	77.1	164.6	-55	172.2	0	0	0	104.5	D895	I893-D895 PolarHBondContact O-N 3.34Å
894	E	31.5	Very low	42.6	Very low	141 Å²	141	109.1 Å²	109.1	66%	0.659	57%	0.574	S	S	*	*			trans	-60.5	135	166.6	-79.6	-168.8	172.1	0	0	105.4	D892 T896	D892-E894 PolarHBondContact O-N 3.49Å; E894-T896 WeakPolarHBondContact CB-OG1 3.4Å; E894-T896 PolarHBondContact O-N 2.83Å; E894-T896 PolarHBondContact OE2-OG1 3.45Å
895	D	34.9	Very low	44.5	Very low	152 Å²	152	111.2 Å²	111.2	81%	0.813	58%	0.582	S	S	*	*			trans	-65.3	43.3	160.1	-70.6	-42.3	0	0	0	110.1	I893 P897	I893-D895 PolarHBondContact O-N 3.34Å; D895-P897 WeakPolarHBondContact O-CD 3.38Å; D895-P897 VanDerWaalsContact O-N 3.15Å
896	T	29.5	Very low	46.9	Very low	88 Å²	88	105.8 Å²	105.8	54%	0.54	55%	0.547	S	S	.	.			trans	-64.4	117.3	172.7	-28.6	0	0	0	0	105.6	E894 G898	E894-T896 WeakPolarHBondContact CB-OG1 3.4Å; E894-T896 PolarHBondContact O-N 2.83Å; E894-T896 PolarHBondContact OE2-OG1 3.45Å; T896-G898 PolarHBondContact O-N 3.16Å
897	P	33.8	Very low	49.1	Very low	112 Å²	112	101.5 Å²	101.5	73%	0.727	54%	0.535	S	S	*	.			trans	-78	51.3	176.8	13.6	0.4	0	0	0	110.1	D895	D895-P897 WeakPolarHBondContact O-CD 3.38Å; D895-P897 VanDerWaalsContact O-N 3.15Å
898	G	34.6	Very low	51.3	Low	49 Å²	49	99 Å²	99	51%	0.505	52%	0.522	S	S	.	.			trans	-79.4	131.4	165.1	0	0	0	0	0	108.8	T896 Q900	T896-G898 PolarHBondContact O-N 3.16Å; G898-Q900 PolarHBondContact O-N 2.92Å; G898-Q900 VanDerWaalsContact O-N 3.12Å
899	Y	41	Very low	53.9	Low	218 Å²	218	90.1 Å²	90.1	86%	0.855	48%	0.481	S	S	*	.	S	Bend	trans	-70	-0.3	177	-71.7	-84.3	0	0	0	113.8
900	Q	48.2	Very low	56.1	Low	135 Å²	135	84.3 Å²	84.3	63%	0.631	46%	0.46	S	S	*	.	S	Bend	trans	-100.5	132.3	176.8	-67.7	-172.4	-1.1	0	0	109.6	T698 G898 A902	T698-Q900 PolarHBondContact OG1-OE1 3.12Å; G898-Q900 PolarHBondContact O-N 2.92Å; G898-Q900 VanDerWaalsContact O-N 3.12Å; Q900-A902 PolarHBondContact O-N 2.97Å; Q900-A902 VanDerWaalsContact O-N 3.12Å
901	T	55.4	Low	58.4	Low	30 Å²	30	79.3 Å²	79.3	18%	0.184	44%	0.439	C	S	.	.			trans	-60	113.6	174.4	40.1	0	0	0	0	110.3	Q657 E658 G699	Q657-T901 HydrophobicContact CB-CG2 4.26Å; E658-T901 HydrophobicContact CB-CG2 4.29Å; E658-T901 HydrophobicContact CG-CG2 3.86Å; G699-T901 WeakPolarHBondContact CA-O 3.29Å
902	A	66.6	Low	60.4	Low	74 Å²	74	81.8 Å²	81.8	61%	0.612	45%	0.445	S	S	*	.			trans	-69.6	144.3	175.3	0	0	0	0	0	110.5	Q900 S904	Q900-A902 PolarHBondContact O-N 2.97Å; Q900-A902 VanDerWaalsContact O-N 3.12Å; A902-S904 PolarHBondContact O-N 2.93Å
903	F	81.7	Confident	62.7	Low	29 Å²	29	83.6 Å²	83.6	13%	0.127	45%	0.45	C	S	.	.			trans	-71	123.1	173.6	175.3	-108.9	0	0	0	110	P661 Q665 G699 P702 A703 Q905	P661-F903 HydrophobicContact CB-CD2 4.28Å; Q665-F903 HydrophobicContact CG-CE2 4.26Å; G699-F903 VanDerWaalsContact O-CD2 3.32Å; G699-F903 WeakPolarHBondContact O-CD2 3.07Å; P702-F903 HydrophobicContact CB-CD1 3.97Å; P702-F903 HydrophobicContact CB-CD2 4.19Å; P702-F903 HydrophobicContact CB-CE1 3.71Å; P702-F903 HydrophobicContact CB-CE2 3.97Å; P702-F903 HydrophobicContact CB-CG 4.19Å; P702-F903 HydrophobicContact CB-CZ 3.71Å; P702-F903 HydrophobicContact CG-CB 4.37Å; P702-F903 HydrophobicContact CG-CD1 3.79Å; P702-F903 HydrophobicContact CG-CD2 4.18Å; P702-F903 HydrophobicContact CG-CE1 4.07Å; P702-F903 HydrophobicContact CG-CE2 4.46Å; P702-F903 HydrophobicContact CG-CG 3.84Å; P702-F903 HydrophobicContact CG-CZ 4.39Å; A703-F903 HydrophobicContact CB-CE2 3.96Å; F903-Q905 HydrophobicContact CE1-CB 3.83Å; F903-Q905 HydrophobicContact CZ-CB 4.14Å; F903-Q905 VanDerWaalsContact CZ-OE1 3.22Å
904	S	84.5	Confident	65	Low	22 Å²	22	83.8 Å²	83.8	15%	0.154	45%	0.449	C	S	.	.			trans	-111.4	115.5	170.2	-63.9	0	0	0	0	110	Y662 Q665 A902 L906	Y662-S904 WeakPolarHBondContact OH-CB 3.37Å; Q665-S904 PolarHBondContact NE2-O 3.35Å; A902-S904 PolarHBondContact O-N 2.93Å; S904-L906 PolarHBondContact O-N 3.15Å
905	Q	88.8	Confident	67.8	Low	96 Å²	96	79.2 Å²	79.2	45%	0.449	43%	0.429	S	S	.	.			trans	-72.5	123.8	178.2	-179.5	61.1	58.6	0	0	110.2	F903 A907	F903-Q905 HydrophobicContact CE1-CB 3.83Å; F903-Q905 HydrophobicContact CZ-CB 4.14Å; F903-Q905 VanDerWaalsContact CZ-OE1 3.22Å; Q905-A907 PolarHBondContact O-N 3.2Å
906	L	90.3	Very high	70.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	40%	0.396	C	S	.	.			trans	-75.1	118.5	168.7	-68	173.5	0	0	0	109.2	F619 E620 Y662 Q665 V666 S904 F908 A909 G910	F619-L906 HydrophobicContact CB-CD1 3.94Å; F619-L906 HydrophobicContact CB-CD2 3.67Å; F619-L906 HydrophobicContact CB-CG 4.43Å; E620-L906 HydrophobicContact CG-CD2 3.68Å; E620-L906 WeakPolarHBondContact OE1-CA 3.3Å; Y662-L906 HydrophobicContact CD1-CD1 3.88Å; Y662-L906 HydrophobicContact CD1-CD2 3.64Å; Y662-L906 HydrophobicContact CD1-CG 3.67Å; Y662-L906 HydrophobicContact CE1-CD2 3.59Å; Y662-L906 HydrophobicContact CE1-CG 3.95Å; Q665-L906 HydrophobicContact CB-CD1 4.03Å; V666-L906 HydrophobicContact CG2-CD1 4.21Å; S904-L906 PolarHBondContact O-N 3.15Å; L906-F908 VanDerWaalsContact C-N 3.35Å; L906-F908 PolarHBondContact O-N 3.19Å; L906-A909 HydrophobicContact CB-CB 3.43Å; L906-A909 VanDerWaalsContact CB-CB 3.43Å; L906-A909 HydrophobicContact CD1-CB 4Å; L906-A909 HydrophobicContact CG-CB 4.37Å; L906-A909 PolarHBondContact O-N 2.82Å; L906-A909 VanDerWaalsContact O-N 3.07Å; L906-G910 PolarHBondContact O-N 2.71Å
907	A	85.8	Confident	73.3	Confident	72 Å²	72	69.5 Å²	69.5	60%	0.595	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-61.1	-43.1	177.6	0	0	0	0	0	111.2	E620 Q905 A909 G910	E620-A907 WeakPolarHBondContact OE1-CB 3.13Å; E620-A907 PolarHBondContact OE1-N 3.5Å; E620-A907 PolarHBondContact OE2-N 3.32Å; Q905-A907 PolarHBondContact O-N 3.2Å; A907-A909 VanDerWaalsContact C-N 3.26Å; A907-A909 PolarHBondContact O-N 3.1Å; A907-G910 PolarHBondContact O-N 3.24Å
908	F	87.2	Confident	75.8	Confident	48 Å²	48	65.3 Å²	65.3	21%	0.211	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-82.3	-3.1	175.9	-55.2	-61.5	0	0	0	112.7	M577 E620 C623 L624 R627 L906	M577-F908 HydrophobicContact CG-CE2 4Å; M577-F908 HydrophobicContact SD-CE2 3.94Å; E620-F908 HydrophobicContact CB-CD2 3.96Å; E620-F908 HydrophobicContact CB-CE2 4.47Å; E620-F908 HydrophobicContact CG-CD2 4.41Å; E620-F908 WeakPolarHBondContact OE2-CB 3.19Å; E620-F908 WeakPolarHBondContact OE2-CD2 3.27Å; E620-F908 PolarHBondContact OE2-N 3.04Å; C623-F908 HydrophobicContact CB-CB 3.86Å; L624-F908 HydrophobicContact CB-CB 4.22Å; L624-F908 HydrophobicContact CB-CD2 4.05Å; L624-F908 HydrophobicContact CB-CG 4.04Å; L624-F908 HydrophobicContact CD1-CD1 3.87Å; L624-F908 HydrophobicContact CD1-CE1 4.1Å; L624-F908 HydrophobicContact CD1-CG 4.15Å; L624-F908 HydrophobicContact CD2-CD2 4.21Å; L624-F908 HydrophobicContact CD2-CE1 4.43Å; L624-F908 HydrophobicContact CD2-CE2 4Å; L624-F908 HydrophobicContact CD2-CZ 4.11Å; L624-F908 HydrophobicContact CG-CG 4.48Å; R627-F908 PolarHBondContact NE-O 3.25Å; R627-F908 PolarHBondContact NH2-O 3.39Å; L906-F908 VanDerWaalsContact C-N 3.35Å; L906-F908 PolarHBondContact O-N 3.19Å
909	A	85.1	Confident	77.9	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-86.5	-20.5	165	0	0	0	0	0	112.5	R627 Q665 R706 L906 A907	R627-A909 VanDerWaalsContact NH2-C 3.28Å; R627-A909 PolarHBondContact NH2-O 2.88Å; R627-A909 VanDerWaalsContact NH2-O 3.11Å; Q665-A909 HydrophobicContact CB-CB 4.13Å; R706-A909 PolarHBondContact NH1-O 3.06Å; R706-A909 PolarHBondContact NH2-O 2.92Å; L906-A909 HydrophobicContact CB-CB 3.43Å; L906-A909 VanDerWaalsContact CB-CB 3.43Å; L906-A909 HydrophobicContact CD1-CB 4Å; L906-A909 HydrophobicContact CG-CB 4.37Å; L906-A909 PolarHBondContact O-N 2.82Å; L906-A909 VanDerWaalsContact O-N 3.07Å; A907-A909 VanDerWaalsContact C-N 3.26Å; A907-A909 PolarHBondContact O-N 3.1Å
910	G	75.1	Confident	79.6	Confident	25 Å²	25	69.3 Å²	69.3	26%	0.258	37%	0.368	S	S	.	.			trans	-42.9	139.4	-165.6	0	0	0	0	0	117.9	R627 L906 A907	R627-G910 PolarHBondContact NH2-O 3.49Å; L906-G910 PolarHBondContact O-N 2.71Å; A907-G910 PolarHBondContact O-N 3.24Å
911	K	73.7	Confident	81.4	Confident	74 Å²	74	63.5 Å²	63.5	32%	0.322	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-68.2	144.7	177.2	-166	-177.6	177.4	177.2	0	110.1
912	K	72.7	Confident	82.8	Confident	168 Å²	168	68.3 Å²	68.3	73%	0.73	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-68.8	139.9	167.4	-69.9	-179.7	-179.9	175.2	0	109.2	H914	K912-H914 PolarHBondContact O-N 3.35Å
913	E	77.6	Confident	84	Confident	152 Å²	152	68 Å²	68	71%	0.71	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-57.9	123.3	170.8	-168.5	176	-169.3	0	0	108.9	V837	V837-E913 HydrophobicContact CG2-CG 3.92Å; V837-E913 VanDerWaalsContact CG2-OE1 3.3Å; V837-E913 WeakPolarHBondContact CG2-OE1 3.31Å
914	H	86.4	Confident	84.6	Confident	75 Å²	75	67.8 Å²	67.8	35%	0.347	36%	0.356	S	S	.	.			trans	-112.6	121.5	-176.6	174.2	61.2	0	0	0	109.3	E756 K912 P916	E756-H914 IonicContact OE1-CD2 2.84Å; E756-H914 IonicContact OE1-CE1 2.57Å; E756-H914 IonicContact OE1-NE2 2.76Å; E756-H914 PolarHBondContact OE1-NE2 3.29Å; E756-H914 IonicContact OE2-CD2 3.74Å; E756-H914 PolarHBondContact OE2-CD2 3.48Å; E756-H914 IonicContact OE2-NE2 2.7Å; E756-H914 PolarHBondContact OE2-NE2 3.27Å; K912-H914 PolarHBondContact O-N 3.35Å; H914-P916 WeakPolarHBondContact O-CD 3.41Å
915	D	91	Very high	85.1	Confident	45 Å²	45	69.6 Å²	69.6	24%	0.241	36%	0.361	C	S	.	.			trans	-101.5	105.3	176.6	175.6	4.2	0	0	0	109.7	V837 K840 V917 G918	V837-D915 HydrophobicContact CG2-CB 4.39Å; K840-D915 WeakPolarHBondContact CE-OD2 3.27Å; K840-D915 IonicContact NZ-OD1 2.85Å; K840-D915 IonicContact NZ-OD2 2.75Å; K840-D915 PolarHBondContact NZ-OD2 2.89Å; D915-V917 PolarHBondContact O-N 3.11Å; D915-V917 WeakPolarHBondContact OD1-CB 3.44Å; D915-V917 PolarHBondContact OD1-N 2.89Å; D915-G918 PolarHBondContact O-N 3.41Å; D915-G918 PolarHBondContact OD1-N 3.41Å; D915-G918 PolarHBondContact OD2-N 3.25Å
916	P	90.2	Very high	85.4	Confident	19 Å²	19	67.6 Å²	67.6	12%	0.123	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-15	-177.6	30.1	-37.1	0	0	0	113.6	E756 L796 I841 H914	E756-P916 WeakPolarHBondContact OE1-CA 3.26Å; E756-P916 WeakPolarHBondContact OE1-CB 3.3Å; L796-P916 HydrophobicContact CD1-CB 3.79Å; L796-P916 HydrophobicContact CD1-CG 3.76Å; I841-P916 HydrophobicContact CD1-CG 3.56Å; I841-P916 HydrophobicContact CG1-CG 3.81Å; H914-P916 WeakPolarHBondContact O-CD 3.41Å
917	V	89.8	Confident	85.7	Confident	16 Å²	16	69.5 Å²	69.5	10%	0.097	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-29.9	173.5	-176.6	0	0	0	0	110.4	I799 I841 V844 D915 V921	I799-V917 HydrophobicContact CD1-CG2 4Å; I841-V917 HydrophobicContact CG1-CG2 4.22Å; V844-V917 HydrophobicContact CG2-CG1 4.13Å; D915-V917 PolarHBondContact O-N 3.11Å; D915-V917 WeakPolarHBondContact OD1-CB 3.44Å; D915-V917 PolarHBondContact OD1-N 2.89Å; V917-V921 HydrophobicContact CG1-CB 3.74Å; V917-V921 HydrophobicContact CG1-CG2 3.81Å
918	G	85	Confident	86.3	Confident	25 Å²	25	66.1 Å²	66.1	26%	0.258	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	62.5	-162.8	-179.7	0	0	0	0	0	113.7	K840 D915 M920	K840-G918 PolarHBondContact NZ-O 3.41Å; D915-G918 PolarHBondContact O-N 3.41Å; D915-G918 PolarHBondContact OD1-N 3.41Å; D915-G918 PolarHBondContact OD2-N 3.25Å; G918-M920 PolarHBondContact O-N 3.2Å
919	Q	79.4	Confident	86.7	Confident	169 Å²	169	63.8 Å²	63.8	79%	0.79	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-71.8	-4.3	-179.6	-65.1	-175.5	-7	0	0	113.9	V921 N922	Q919-V921 PolarHBondContact O-N 3.04Å; Q919-N922 PolarHBondContact O-OD1 3.34Å; Q919-N922 VanDerWaalsContact O-OD1 3.14Å
920	M	76.4	Confident	87.2	Confident	182 Å²	182	68.6 Å²	68.6	90%	0.897	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-62.5	-27.9	178.3	-62.1	-172.4	88.5	0	0	112	G918	G918-M920 PolarHBondContact O-N 3.2Å
921	V	86.3	Confident	88.2	Confident	12 Å²	12	68.1 Å²	68.1	7%	0.073	34%	0.339	C	S	.	.			trans	-124.5	87.8	173.7	-177.9	0	0	0	0	109.5	K840 V844 V917 Q919 P924 H927	K840-V921 WeakPolarHBondContact CE-O 3.33Å; K840-V921 PolarHBondContact NZ-O 2.89Å; V844-V921 HydrophobicContact CG2-CB 4.17Å; V844-V921 HydrophobicContact CG2-CG1 3.8Å; V844-V921 HydrophobicContact CG2-CG2 4.12Å; V917-V921 HydrophobicContact CG1-CB 3.74Å; V917-V921 HydrophobicContact CG1-CG2 3.81Å; Q919-V921 PolarHBondContact O-N 3.04Å; V921-P924 HydrophobicContact CG1-CG 4.38Å; V921-H927 HydrophobicContact CG1-CB 3.64Å
922	N	85	Confident	89.3	Confident	131 Å²	131	64.6 Å²	64.6	70%	0.701	32%	0.323	S	S	*	.	S	Bend	trans	-72.5	-34.5	176.9	-72	-27.6	0	0	0	112.7	Q919	Q919-N922 PolarHBondContact O-OD1 3.34Å; Q919-N922 VanDerWaalsContact O-OD1 3.14Å
923	N	92.3	Very high	90.3	Very high	67 Å²	67	59.2 Å²	59.2	36%	0.358	30%	0.301	S	S	.	.			trans	-130.4	106.6	179	-174.4	-28.3	0	0	0	110.1	K925 I926 H927	N923-K925 PolarHBondContact O-N 2.92Å; N923-K925 WeakPolarHBondContact OD1-CA 3.4Å; N923-K925 VanDerWaalsContact OD1-CB 3.29Å; N923-K925 WeakPolarHBondContact OD1-CB 3.46Å; N923-K925 PolarHBondContact OD1-N 3.4Å; N923-I926 HydrophobicContact CB-CB 4.14Å; N923-I926 HydrophobicContact CB-CD1 3.99Å; N923-I926 HydrophobicContact CB-CG1 4.1Å; N923-I926 PolarHBondContact O-N 3.42Å; N923-I926 PolarHBondContact OD1-N 2.78Å; N923-H927 PolarHBondContact O-N 3.24Å
924	P	94	Very high	91.2	Very high	26 Å²	26	59.2 Å²	59.2	17%	0.169	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-29.9	178.6	-27.6	36.7	0	0	0	114.5	K840 A843 F876 V921 H927 L928	K840-P924 HydrophobicContact CG-CG 4.09Å; A843-P924 HydrophobicContact CB-CB 3.76Å; A843-P924 HydrophobicContact CB-CG 4.46Å; F876-P924 HydrophobicContact CE1-CB 3.7Å; F876-P924 HydrophobicContact CZ-CB 3.84Å; V921-P924 HydrophobicContact CG1-CG 4.38Å; P924-H927 PolarHBondContact O-N 3.23Å; P924-L928 PolarHBondContact O-N 3.41Å
925	K	95.9	Very high	91.5	Very high	59 Å²	59	56.7 Å²	56.7	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-68.2	-43.9	178.1	-49	-172.5	-173.4	-162.3	0	111.2	F876 E877 N923 L928 A929 Y962	F876-K925 HydrophobicContact CB-CD 4.23Å; F876-K925 HydrophobicContact CB-CG 4.31Å; F876-K925 HydrophobicContact CD1-CG 4.19Å; F876-K925 HydrophobicContact CD2-CG 3.88Å; F876-K925 HydrophobicContact CE1-CG 4.45Å; F876-K925 HydrophobicContact CE2-CB 4.49Å; F876-K925 HydrophobicContact CE2-CG 4.17Å; F876-K925 HydrophobicContact CG-CD 4.35Å; F876-K925 HydrophobicContact CG-CG 3.89Å; F876-K925 HydrophobicContact CZ-CG 4.44Å; F876-K925 PolarHBondContact O-NZ 3.07Å; E877-K925 VanDerWaalsContact CD-NZ 3.26Å; E877-K925 IonicContact OE1-NZ 3.44Å; E877-K925 PolarHBondContact OE1-NZ 3.4Å; E877-K925 IonicContact OE2-NZ 3.12Å; E877-K925 PolarHBondContact OE2-NZ 2.81Å; N923-K925 PolarHBondContact O-N 2.92Å; N923-K925 WeakPolarHBondContact OD1-CA 3.4Å; N923-K925 VanDerWaalsContact OD1-CB 3.29Å; N923-K925 WeakPolarHBondContact OD1-CB 3.46Å; N923-K925 PolarHBondContact OD1-N 3.4Å; K925-L928 PolarHBondContact O-N 3.15Å; K925-A929 PolarHBondContact O-N 3.26Å; K925-A929 VanDerWaalsContact O-N 3.17Å; K925-Y962 HydrophobicContact CB-CD1 3.99Å; K925-Y962 HydrophobicContact CB-CD2 4.43Å; K925-Y962 HydrophobicContact CB-CE1 4.19Å; K925-Y962 HydrophobicContact CB-CG 4.14Å; K925-Y962 HydrophobicContact CD-CD1 4.24Å; K925-Y962 HydrophobicContact CD-CE1 3.7Å; K925-Y962 HydrophobicContact CG-CE1 4.32Å
926	I	95.1	Very high	91.7	Very high	54 Å²	54	54.5 Å²	54.5	28%	0.277	28%	0.276	S	S	.	.	H	α-helix	trans	-66.6	-40.7	175.1	-65.9	177.6	0	0	0	110.4	N923 L928 A929 Q930 A966	N923-I926 HydrophobicContact CB-CB 4.14Å; N923-I926 HydrophobicContact CB-CD1 3.99Å; N923-I926 HydrophobicContact CB-CG1 4.1Å; N923-I926 PolarHBondContact O-N 3.42Å; N923-I926 PolarHBondContact OD1-N 2.78Å; I926-L928 VanDerWaalsContact C-N 3.34Å; I926-L928 PolarHBondContact O-N 3.18Å; I926-A929 PolarHBondContact O-N 2.77Å; I926-Q930 HydrophobicContact CG2-CG 4.31Å; I926-Q930 WeakPolarHBondContact O-CG 3.34Å; I926-Q930 PolarHBondContact O-N 3.23Å; I926-A966 HydrophobicContact CG2-CB 4Å
927	H	96	Very high	91.8	Very high	41 Å²	41	57 Å²	57	19%	0.19	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-43.1	176.6	-179.9	65.9	0	0	0	112.1	V921 N923 P924 A929 Q930 S931	V921-H927 HydrophobicContact CG1-CB 3.64Å; N923-H927 PolarHBondContact O-N 3.24Å; P924-H927 PolarHBondContact O-N 3.23Å; H927-A929 PolarHBondContact O-N 3.06Å; H927-Q930 PolarHBondContact O-N 2.88Å; H927-S931 WeakPolarHBondContact O-CB 3.32Å; H927-S931 PolarHBondContact O-N 3.4Å; H927-S931 PolarHBondContact O-OG 2.73Å
928	L	97.1	Very high	91.8	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-56.8	-50.1	172.8	174.6	62.8	0	0	0	111.7	T847 L850 L869 L872 F876 P924 K925 I926 Q930 S931 L932 L959 Y962	T847-L928 HydrophobicContact CG2-CB 4.48Å; T847-L928 HydrophobicContact CG2-CD1 4.07Å; L850-L928 HydrophobicContact CD1-CD1 4.37Å; L869-L928 HydrophobicContact CD1-CD1 4.22Å; L869-L928 HydrophobicContact CD1-CD2 4.01Å; L872-L928 HydrophobicContact CD2-CD1 3.72Å; L872-L928 HydrophobicContact CD2-CD2 3.78Å; L872-L928 HydrophobicContact CD2-CG 4.26Å; L872-L928 HydrophobicContact CG-CD2 4.25Å; F876-L928 HydrophobicContact CE2-CB 4.45Å; F876-L928 HydrophobicContact CE2-CD2 3.87Å; P924-L928 PolarHBondContact O-N 3.41Å; K925-L928 PolarHBondContact O-N 3.15Å; I926-L928 VanDerWaalsContact C-N 3.34Å; I926-L928 PolarHBondContact O-N 3.18Å; L928-Q930 PolarHBondContact O-N 2.83Å; L928-S931 PolarHBondContact O-N 2.97Å; L928-L932 HydrophobicContact CD1-CD1 3.74Å; L928-L932 HydrophobicContact CD1-CG 3.92Å; L928-L932 HydrophobicContact CG-CD1 3.89Å; L928-L932 HydrophobicContact CG-CG 4.44Å; L928-L932 WeakPolarHBondContact O-CB 3.43Å; L928-L932 WeakPolarHBondContact O-CG 3.47Å; L928-L932 PolarHBondContact O-N 3.04Å; L928-L959 HydrophobicContact CD2-CD1 4.49Å; L928-Y962 HydrophobicContact CD2-CD2 4.38Å
929	A	96.2	Very high	92	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-45.6	-178.9	0	0	0	0	0	112.6	K925 I926 H927 L932 H933 L963 A966 V968	K925-A929 PolarHBondContact O-N 3.26Å; K925-A929 VanDerWaalsContact O-N 3.17Å; I926-A929 PolarHBondContact O-N 2.77Å; H927-A929 PolarHBondContact O-N 3.06Å; A929-L932 PolarHBondContact O-N 3.4Å; A929-H933 WeakPolarHBondContact O-CB 3.5Å; A929-H933 PolarHBondContact O-N 2.92Å; A929-L963 HydrophobicContact CB-CD2 4.08Å; A929-A966 HydrophobicContact CB-CB 3.63Å; A929-V968 HydrophobicContact CB-CG2 4.2Å
930	Q	95.9	Very high	92.4	Very high	100 Å²	100	57.2 Å²	57.2	47%	0.467	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-41.9	178.3	-70.5	175.1	-18.3	0	0	112.2	I926 H927 L928 H933 K934 A966	I926-Q930 HydrophobicContact CG2-CG 4.31Å; I926-Q930 WeakPolarHBondContact O-CG 3.34Å; I926-Q930 PolarHBondContact O-N 3.23Å; H927-Q930 PolarHBondContact O-N 2.88Å; L928-Q930 PolarHBondContact O-N 2.83Å; Q930-H933 PolarHBondContact O-N 2.87Å; Q930-K934 PolarHBondContact O-N 2.7Å; Q930-A966 HydrophobicContact CG-CB 4.21Å
931	S	96.2	Very high	92.9	Very high	15 Å²	15	50.4 Å²	50.4	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-40	178.2	-64.4	0	0	0	0	111.8	H927 L928 K934 L935	H927-S931 WeakPolarHBondContact O-CB 3.32Å; H927-S931 PolarHBondContact O-N 3.4Å; H927-S931 PolarHBondContact O-OG 2.73Å; L928-S931 PolarHBondContact O-N 2.97Å; S931-K934 PolarHBondContact O-N 2.92Å; S931-L935 PolarHBondContact O-N 2.97Å
932	L	95.8	Very high	92.9	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-40.2	174.2	-74	172.8	0	0	0	112.2	T851 W865 L869 L928 A929 K934 L935 S936 V943 L959 L970	T851-L932 HydrophobicContact CG2-CD2 3.95Å; T851-L932 HydrophobicContact CG2-CG 4.31Å; W865-L932 HydrophobicContact CH2-CD2 3.79Å; W865-L932 HydrophobicContact CZ2-CD2 3.63Å; L869-L932 HydrophobicContact CD1-CD1 4.23Å; L928-L932 HydrophobicContact CD1-CD1 3.74Å; L928-L932 HydrophobicContact CD1-CG 3.92Å; L928-L932 HydrophobicContact CG-CD1 3.89Å; L928-L932 HydrophobicContact CG-CG 4.44Å; L928-L932 WeakPolarHBondContact O-CB 3.43Å; L928-L932 WeakPolarHBondContact O-CG 3.47Å; L928-L932 PolarHBondContact O-N 3.04Å; A929-L932 PolarHBondContact O-N 3.4Å; L932-K934 VanDerWaalsContact C-N 3.35Å; L932-L935 PolarHBondContact O-N 3.16Å; L932-S936 WeakPolarHBondContact O-CB 3.46Å; L932-S936 PolarHBondContact O-N 3.22Å; L932-V943 HydrophobicContact CD2-CG1 4.31Å; L932-L959 HydrophobicContact CD1-CD1 3.76Å; L932-L970 HydrophobicContact CB-CD2 3.83Å
933	H	95.2	Very high	93.1	Very high	56 Å²	56	47.8 Å²	47.8	26%	0.259	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-44.5	173.9	172.5	65	0	0	0	111.9	A929 Q930 L935 S936 T937 V968 T969	A929-H933 WeakPolarHBondContact O-CB 3.5Å; A929-H933 PolarHBondContact O-N 2.92Å; Q930-H933 PolarHBondContact O-N 2.87Å; H933-L935 VanDerWaalsContact C-N 3.34Å; H933-L935 PolarHBondContact O-N 3.36Å; H933-S936 PolarHBondContact O-N 2.88Å; H933-T937 WeakPolarHBondContact O-CB 3.5Å; H933-T937 PolarHBondContact O-N 3.47Å; H933-T937 PolarHBondContact O-OG1 3.22Å; H933-V968 HydrophobicContact CB-CB 3.69Å; H933-V968 HydrophobicContact CB-CG1 4.11Å; H933-V968 HydrophobicContact CB-CG2 3.85Å; H933-T969 PolarHBondContact ND1-O 3Å
934	K	95.3	Very high	92.9	Very high	152 Å²	152	46.6 Å²	46.6	66%	0.661	26%	0.261	S	S	*	.	H	α-helix	trans	-60.1	-44	175.6	-174.2	-177.9	177	-172.4	0	111.5	Q930 S931 L932 T937 A938	Q930-K934 PolarHBondContact O-N 2.7Å; S931-K934 PolarHBondContact O-N 2.92Å; L932-K934 VanDerWaalsContact C-N 3.35Å; K934-T937 PolarHBondContact O-N 2.76Å; K934-A938 PolarHBondContact O-N 3.26Å; K934-A938 VanDerWaalsContact O-N 3.09Å
935	L	94.2	Very high	92.6	Very high	21 Å²	21	48.4 Å²	48.4	11%	0.11	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-45.7	175.2	-178.1	68.7	0	0	0	112	T851 M857 W865 S931 L932 H933 T937 A938 C939 V943	T851-L935 HydrophobicContact CG2-CB 4.41Å; T851-L935 HydrophobicContact CG2-CD2 4.31Å; M857-L935 HydrophobicContact CE-CD2 4.38Å; M857-L935 HydrophobicContact SD-CD1 3.86Å; M857-L935 HydrophobicContact SD-CD2 3.85Å; M857-L935 HydrophobicContact SD-CG 4.18Å; W865-L935 HydrophobicContact CZ2-CD2 4.34Å; S931-L935 PolarHBondContact O-N 2.97Å; L932-L935 PolarHBondContact O-N 3.16Å; H933-L935 VanDerWaalsContact C-N 3.34Å; H933-L935 PolarHBondContact O-N 3.36Å; L935-T937 VanDerWaalsContact C-N 3.25Å; L935-T937 PolarHBondContact O-N 3.23Å; L935-A938 CarbonylContact O-C 3.54Å; L935-A938 PolarHBondContact O-N 2.68Å; L935-A938 VanDerWaalsContact O-N 3.08Å; L935-C939 PolarHBondContact O-N 2.87Å; L935-V943 HydrophobicContact CB-CG2 4.33Å; L935-V943 HydrophobicContact CD2-CG2 3.68Å; L935-V943 HydrophobicContact CG-CG2 3.75Å
936	S	93.6	Very high	92.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-36.1	178.5	-148	0	0	0	0	111.6	L932 H933 C939 P940 L971	L932-S936 WeakPolarHBondContact O-CB 3.46Å; L932-S936 PolarHBondContact O-N 3.22Å; H933-S936 PolarHBondContact O-N 2.88Å; S936-C939 CarbonylContact O-C 3.2Å; S936-C939 PolarHBondContact O-N 2.86Å; S936-P940 VanDerWaalsContact O-CA 3.23Å; S936-P940 WeakPolarHBondContact O-CA 3.37Å; S936-P940 VanDerWaalsContact O-N 3.1Å; S936-L971 PolarHBondContact OG-N 3.15Å; S936-L971 PolarHBondContact OG-O 2.86Å
937	T	92.6	Very high	91.8	Very high	70 Å²	70	44.3 Å²	44.3	43%	0.429	26%	0.256	S	S	.	.	H	α-helix	trans	-67.6	-38	174.5	-53.6	0	0	0	0	111.7	H933 K934 L935 L971	H933-T937 WeakPolarHBondContact O-CB 3.5Å; H933-T937 PolarHBondContact O-N 3.47Å; H933-T937 PolarHBondContact O-OG1 3.22Å; K934-T937 PolarHBondContact O-N 2.76Å; L935-T937 VanDerWaalsContact C-N 3.25Å; L935-T937 PolarHBondContact O-N 3.23Å; T937-L971 HydrophobicContact CG2-CD1 4.3Å
938	A	90.6	Very high	91.1	Very high	77 Å²	77	46.9 Å²	46.9	64%	0.636	28%	0.278	S	S	*	.	H	α-helix	trans	-74	-27.3	177.3	0	0	0	0	0	113.2	K934 L935	K934-A938 PolarHBondContact O-N 3.26Å; K934-A938 VanDerWaalsContact O-N 3.09Å; L935-A938 CarbonylContact O-C 3.54Å; L935-A938 PolarHBondContact O-N 2.68Å; L935-A938 VanDerWaalsContact O-N 3.08Å
939	C	88.6	Confident	89.9	Confident	43 Å²	43	51.7 Å²	51.7	29%	0.291	31%	0.307	S	S	.	.	S	Bend	trans	-134.3	70.8	179.1	-66.5	0	0	0	0	111.4	L935 S936 G941 R942	L935-C939 PolarHBondContact O-N 2.87Å; S936-C939 CarbonylContact O-C 3.2Å; S936-C939 PolarHBondContact O-N 2.86Å; C939-G941 PolarHBondContact O-N 3.41Å; C939-R942 HydrophobicContact CB-CB 4.17Å; C939-R942 WeakPolarHBondContact O-CB 3.34Å; C939-R942 PolarHBondContact O-N 3.14Å
940	P	87.4	Confident	89	Confident	95 Å²	95	55.1 Å²	55.1	62%	0.617	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	137.8	-174.1	-27.2	35.8	0	0	0	113.4	S936 R942	S936-P940 VanDerWaalsContact O-CA 3.23Å; S936-P940 WeakPolarHBondContact O-CA 3.37Å; S936-P940 VanDerWaalsContact O-N 3.1Å; P940-R942 PolarHBondContact O-N 3.33Å; P940-R942 VanDerWaalsContact O-N 3.15Å
941	G	86.8	Confident	88.5	Confident	39 Å²	39	51.2 Å²	51.2	40%	0.402	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-17.3	179.1	0	0	0	0	0	115.4	C939 S945 L971	C939-G941 PolarHBondContact O-N 3.41Å; G941-S945 WeakPolarHBondContact O-CB 3.43Å; G941-S945 PolarHBondContact O-N 3.28Å; G941-L971 PolarHBondContact N-O 3.17Å
942	R	87.8	Confident	88.1	Confident	89 Å²	89	53.6 Å²	53.6	34%	0.336	33%	0.325	S	S	.	.	H	α-helix	trans	-77.3	-47.4	-176.6	-162.6	171.1	-178	-179.9	8.9	112.6	M857 D858 C939 P940 S945 M946	M857-R942 VanDerWaalsContact C-NH2 3.25Å; M857-R942 HydrophobicContact CE-CB 4.14Å; M857-R942 VanDerWaalsContact CE-CD 3.5Å; M857-R942 HydrophobicContact CE-CG 3.61Å; M857-R942 PolarHBondContact O-NH2 3.34Å; D858-R942 IonicContact OD1-CZ 3.17Å; D858-R942 IonicContact OD1-NH1 2.74Å; D858-R942 PolarHBondContact OD1-NH1 3.07Å; D858-R942 IonicContact OD1-NH2 2.7Å; D858-R942 PolarHBondContact OD1-NH2 3.45Å; C939-R942 HydrophobicContact CB-CB 4.17Å; C939-R942 WeakPolarHBondContact O-CB 3.34Å; C939-R942 PolarHBondContact O-N 3.14Å; P940-R942 PolarHBondContact O-N 3.33Å; P940-R942 VanDerWaalsContact O-N 3.15Å; R942-S945 WeakPolarHBondContact O-CB 3.43Å; R942-S945 PolarHBondContact O-N 2.91Å; R942-M946 HydrophobicContact CG-SD 4.18Å; R942-M946 VanDerWaalsContact O-CG 3.31Å; R942-M946 WeakPolarHBondContact O-CG 3.42Å; R942-M946 PolarHBondContact O-N 2.8Å
943	V	89.2	Confident	87.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-64.9	-47.6	179.5	-175	0	0	0	0	111.8	M857 W865 L932 L935 S945 M946 V947 L970	M857-V943 HydrophobicContact CE-CG2 4.28Å; W865-V943 HydrophobicContact CH2-CG1 3.89Å; W865-V943 HydrophobicContact CZ2-CG1 4.27Å; L932-V943 HydrophobicContact CD2-CG1 4.31Å; L935-V943 HydrophobicContact CB-CG2 4.33Å; L935-V943 HydrophobicContact CD2-CG2 3.68Å; L935-V943 HydrophobicContact CG-CG2 3.75Å; V943-S945 VanDerWaalsContact C-N 3.28Å; V943-S945 PolarHBondContact O-N 3.31Å; V943-M946 PolarHBondContact O-N 3.33Å; V943-V947 HydrophobicContact CG1-CG2 4.31Å; V943-V947 WeakPolarHBondContact O-CG2 3.45Å; V943-V947 PolarHBondContact O-N 2.81Å; V943-L970 HydrophobicContact CG1-CD1 4.24Å; V943-L970 HydrophobicContact CG1-CD2 4.27Å
944	P	88.1	Confident	87.5	Confident	41 Å²	41	61 Å²	61	27%	0.266	37%	0.374	S	S	.	.	H	α-helix	trans	-56.6	-41.8	174.1	-24.7	33.9	0	0	0	112.7	V947 S948 L970	P944-V947 PolarHBondContact O-N 3.16Å; P944-S948 WeakPolarHBondContact O-CB 3.33Å; P944-S948 PolarHBondContact O-N 3.33Å; P944-S948 PolarHBondContact O-OG 3.14Å; P944-L970 HydrophobicContact CG-CB 3.95Å
945	S	87.5	Confident	87.2	Confident	65 Å²	65	54.1 Å²	54.1	46%	0.455	35%	0.345	S	S	.	.	H	α-helix	trans	-59.1	-49.9	176.2	-179.4	0	0	0	0	111	G941 R942 V943 V947 S948 T949	G941-S945 WeakPolarHBondContact O-CB 3.43Å; G941-S945 PolarHBondContact O-N 3.28Å; R942-S945 WeakPolarHBondContact O-CB 3.43Å; R942-S945 PolarHBondContact O-N 2.91Å; V943-S945 VanDerWaalsContact C-N 3.28Å; V943-S945 PolarHBondContact O-N 3.31Å; S945-V947 PolarHBondContact O-N 2.98Å; S945-S948 PolarHBondContact O-N 3.23Å; S945-S948 PolarHBondContact O-OG 3.19Å; S945-T949 PolarHBondContact O-N 3.27Å; S945-T949 PolarHBondContact O-OG1 3.19Å
946	M	86.5	Confident	87.1	Confident	19 Å²	19	55.8 Å²	55.8	9%	0.094	35%	0.354	C	S	.	.	H	α-helix	trans	-63.7	-39.7	-179.1	-67.9	172.7	68.2	0	0	112.8	M857 T862 W865 T866 R942 V943	M857-M946 HydrophobicContact CE-SD 3.61Å; M857-M946 HydrophobicContact CG-CE 4.31Å; M857-M946 HydrophobicContact CG-SD 4.34Å; T862-M946 HydrophobicContact CG2-CE 3.81Å; T862-M946 HydrophobicContact CG2-SD 4.48Å; W865-M946 HydrophobicContact CB-CE 3.36Å; W865-M946 HydrophobicContact CD2-CE 3.46Å; W865-M946 VanDerWaalsContact CD2-CE 3.46Å; W865-M946 HydrophobicContact CE3-CB 4.01Å; W865-M946 HydrophobicContact CE3-CE 3.87Å; W865-M946 HydrophobicContact CG-CE 3.21Å; W865-M946 HydrophobicContact CZ3-CB 4.15Å; T866-M946 PolarHBondContact OG1-O 3.21Å; R942-M946 HydrophobicContact CG-SD 4.18Å; R942-M946 VanDerWaalsContact O-CG 3.31Å; R942-M946 WeakPolarHBondContact O-CG 3.42Å; R942-M946 PolarHBondContact O-N 2.8Å; V943-M946 PolarHBondContact O-N 3.33Å
947	V	87.1	Confident	87	Confident	8 Å²	8	62.6 Å²	62.6	5%	0.048	39%	0.386	C	S	.	.	H	α-helix	trans	-63.9	-43.9	174.8	171.8	0	0	0	0	111.1	W865 L869 V943 P944 S945 T949 L951 L956 L959 L970	W865-V947 HydrophobicContact CH2-CG2 4.02Å; W865-V947 HydrophobicContact CZ3-CG2 3.84Å; L869-V947 HydrophobicContact CD2-CG2 4.06Å; V943-V947 HydrophobicContact CG1-CG2 4.31Å; V943-V947 WeakPolarHBondContact O-CG2 3.45Å; V943-V947 PolarHBondContact O-N 2.81Å; P944-V947 PolarHBondContact O-N 3.16Å; S945-V947 PolarHBondContact O-N 2.98Å; V947-T949 VanDerWaalsContact C-N 3.29Å; V947-T949 PolarHBondContact O-N 3.45Å; V947-L951 HydrophobicContact CG1-CD2 3.97Å; V947-L951 VanDerWaalsContact O-CB 3.26Å; V947-L951 WeakPolarHBondContact O-CB 3.48Å; V947-L951 PolarHBondContact O-N 3.09Å; V947-L956 HydrophobicContact CG1-CD1 3.53Å; V947-L959 HydrophobicContact CG1-CD2 4.1Å; V947-L959 HydrophobicContact CG2-CD2 4.3Å; V947-L970 HydrophobicContact CG2-CD1 4.25Å
948	S	81.2	Confident	87.1	Confident	94 Å²	94	64.2 Å²	64.2	66%	0.657	39%	0.385	S	S	*	.	H	α-helix	trans	-70.9	-18.7	-177.5	68.9	0	0	0	0	114.9	P944 S945	P944-S948 WeakPolarHBondContact O-CB 3.33Å; P944-S948 PolarHBondContact O-N 3.33Å; P944-S948 PolarHBondContact O-OG 3.14Å; S945-S948 PolarHBondContact O-N 3.23Å; S945-S948 PolarHBondContact O-OG 3.19Å
949	T	72.1	Confident	87.2	Confident	101 Å²	101	60.6 Å²	60.6	62%	0.62	36%	0.355	S	S	*	.	H	α-helix	trans	-78.7	-30.5	-169.6	-54.4	0	0	0	0	112.5	S945 V947	S945-T949 PolarHBondContact O-N 3.27Å; S945-T949 PolarHBondContact O-OG1 3.19Å; V947-T949 VanDerWaalsContact C-N 3.29Å; V947-T949 PolarHBondContact O-N 3.45Å
950	S	76.2	Confident	87.4	Confident	72 Å²	72	63.3 Å²	63.3	50%	0.503	36%	0.363	S	S	.	.	H	α-helix	trans	-159.3	3.4	-171.9	51.9	0	0	0	0	117	T866	T866-S950 VanDerWaalsContact CB-OG 3.29Å; T866-S950 WeakPolarHBondContact CB-OG 3.38Å; T866-S950 VanDerWaalsContact CG2-OG 3.27Å; T866-S950 WeakPolarHBondContact CG2-OG 3.19Å
951	L	86.1	Confident	87.7	Confident	19 Å²	19	60.3 Å²	60.3	10%	0.099	35%	0.35	C	S	.	.			trans	-72.5	131.9	175.6	-165.6	67.6	0	0	0	109.4	T866 L869 Q870 I873 V947 A955 L956 L959	T866-L951 HydrophobicContact CG2-CB 3.81Å; T866-L951 HydrophobicContact CG2-CD1 4.17Å; L869-L951 HydrophobicContact CD2-CD2 4.4Å; Q870-L951 HydrophobicContact CB-CD1 3.69Å; Q870-L951 HydrophobicContact CG-CD1 4.08Å; I873-L951 HydrophobicContact CD1-CD1 4.42Å; I873-L951 HydrophobicContact CD1-CD2 4.25Å; V947-L951 HydrophobicContact CG1-CD2 3.97Å; V947-L951 VanDerWaalsContact O-CB 3.26Å; V947-L951 WeakPolarHBondContact O-CB 3.48Å; V947-L951 PolarHBondContact O-N 3.09Å; L951-A955 HydrophobicContact CD1-CB 3.87Å; L951-A955 HydrophobicContact CD2-CB 4.26Å; L951-A955 HydrophobicContact CG-CB 3.93Å; L951-L956 HydrophobicContact CD2-CB 4.18Å; L951-L956 HydrophobicContact CD2-CD1 4.25Å; L951-L959 HydrophobicContact CD2-CD2 4.15Å
952	N	88.8	Confident	88.1	Confident	64 Å²	64	59.2 Å²	59.2	34%	0.342	33%	0.334	S	S	.	.			trans	-63.9	157.6	177.6	75.4	1.2	0	0	0	111.7	Q870 E954 A955 L956	Q870-N952 PolarHBondContact NE2-ND2 3.47Å; N952-E954 VanDerWaalsContact C-N 3.3Å; N952-E954 PolarHBondContact O-N 2.92Å; N952-A955 PolarHBondContact O-N 3.5Å; N952-A955 WeakPolarHBondContact OD1-CA 3.38Å; N952-A955 WeakPolarHBondContact OD1-CB 3.34Å; N952-A955 PolarHBondContact OD1-N 2.71Å; N952-L956 WeakPolarHBondContact O-CB 3.25Å; N952-L956 PolarHBondContact O-N 3.36Å
953	A	87.9	Confident	88.5	Confident	83 Å²	83	55.9 Å²	55.9	69%	0.686	32%	0.322	S	S	*	.	H	α-helix	trans	-61.2	-37.3	-173.1	0	0	0	0	0	113.1	L956 Q957	A953-L956 PolarHBondContact O-N 3.02Å; A953-Q957 PolarHBondContact O-N 3.19Å
954	E	89	Confident	88.7	Confident	130 Å²	130	63 Å²	63	61%	0.607	36%	0.356	S	S	*	.	H	α-helix	trans	-66.9	-49.1	178.6	-68.3	178.8	176.1	0	0	111.9	N952 L956 Q957 Y958	N952-E954 VanDerWaalsContact C-N 3.3Å; N952-E954 PolarHBondContact O-N 2.92Å; E954-L956 VanDerWaalsContact C-N 3.26Å; E954-L956 PolarHBondContact O-N 2.82Å; E954-Q957 WeakPolarHBondContact O-CB 3.41Å; E954-Q957 PolarHBondContact O-N 3.24Å; E954-Q957 VanDerWaalsContact O-N 3.1Å; E954-Y958 WeakPolarHBondContact O-CD2 3.11Å; E954-Y958 PolarHBondContact O-N 3.41Å
955	A	90.1	Very high	89	Confident	6 Å²	6	64.4 Å²	64.4	5%	0.05	37%	0.371	C	S	.	.	H	α-helix	trans	-64.4	-34	177.7	0	0	0	0	0	111.6	Q870 I873 L951 N952 Q957 Y958 L959	Q870-A955 HydrophobicContact CG-CB 4.23Å; I873-A955 HydrophobicContact CB-CB 4.25Å; I873-A955 HydrophobicContact CD1-CB 3.88Å; I873-A955 HydrophobicContact CG2-CB 3.86Å; L951-A955 HydrophobicContact CD1-CB 3.87Å; L951-A955 HydrophobicContact CD2-CB 4.26Å; L951-A955 HydrophobicContact CG-CB 3.93Å; N952-A955 PolarHBondContact O-N 3.5Å; N952-A955 WeakPolarHBondContact OD1-CA 3.38Å; N952-A955 WeakPolarHBondContact OD1-CB 3.34Å; N952-A955 PolarHBondContact OD1-N 2.71Å; A955-Q957 VanDerWaalsContact C-N 3.33Å; A955-Q957 PolarHBondContact O-N 3.07Å; A955-Y958 PolarHBondContact O-N 2.86Å; A955-L959 WeakPolarHBondContact O-CB 3.43Å; A955-L959 PolarHBondContact O-N 3.49Å
956	L	91.2	Very high	89.2	Confident	57 Å²	57	62 Å²	62	30%	0.298	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-41.8	173	-175.3	65.2	0	0	0	111.8	V947 L951 N952 A953 E954 L959 Q960	V947-L956 HydrophobicContact CG1-CD1 3.53Å; L951-L956 HydrophobicContact CD2-CB 4.18Å; L951-L956 HydrophobicContact CD2-CD1 4.25Å; N952-L956 WeakPolarHBondContact O-CB 3.25Å; N952-L956 PolarHBondContact O-N 3.36Å; A953-L956 PolarHBondContact O-N 3.02Å; E954-L956 VanDerWaalsContact C-N 3.26Å; E954-L956 PolarHBondContact O-N 2.82Å; L956-L959 PolarHBondContact O-N 3.24Å; L956-Q960 VanDerWaalsContact O-CG 3.3Å; L956-Q960 WeakPolarHBondContact O-CG 3.35Å; L956-Q960 PolarHBondContact O-N 2.82Å
957	Q	92.2	Very high	89.6	Confident	142 Å²	142	66.4 Å²	66.4	66%	0.664	39%	0.388	S	S	*	.	H	α-helix	trans	-64.7	-44.8	176.9	-174.1	179.2	-4.3	0	0	111.8	A953 E954 A955 Q960 G961	A953-Q957 PolarHBondContact O-N 3.19Å; E954-Q957 WeakPolarHBondContact O-CB 3.41Å; E954-Q957 PolarHBondContact O-N 3.24Å; E954-Q957 VanDerWaalsContact O-N 3.1Å; A955-Q957 VanDerWaalsContact C-N 3.33Å; A955-Q957 PolarHBondContact O-N 3.07Å; Q957-Q960 PolarHBondContact O-N 3.02Å; Q957-G961 PolarHBondContact O-N 2.76Å
958	Y	94.4	Very high	90	Very high	104 Å²	104	67.2 Å²	67.2	41%	0.408	39%	0.393	S	S	.	.	H	α-helix	trans	-60.8	-45.6	175	-71.1	-60.6	0	0	0	111.8	I873 E877 E954 A955 Q960 G961 Y962	I873-Y958 HydrophobicContact CG2-CD2 4.2Å; I873-Y958 HydrophobicContact CG2-CG 4.41Å; E877-Y958 HydrophobicContact CB-CD1 4.47Å; E877-Y958 HydrophobicContact CB-CD2 4.3Å; E877-Y958 HydrophobicContact CB-CE1 4.27Å; E877-Y958 HydrophobicContact CB-CE2 4.09Å; E877-Y958 HydrophobicContact CB-CG 4.49Å; E877-Y958 HydrophobicContact CG-CD1 3.71Å; E877-Y958 HydrophobicContact CG-CD2 4.01Å; E877-Y958 HydrophobicContact CG-CE1 3.95Å; E877-Y958 HydrophobicContact CG-CE2 4.23Å; E877-Y958 HydrophobicContact CG-CG 3.76Å; E954-Y958 WeakPolarHBondContact O-CD2 3.11Å; E954-Y958 PolarHBondContact O-N 3.41Å; A955-Y958 PolarHBondContact O-N 2.86Å; Y958-Q960 VanDerWaalsContact C-N 3.33Å; Y958-Q960 PolarHBondContact O-N 2.94Å; Y958-G961 WeakPolarHBondContact O-CA 3.4Å; Y958-G961 PolarHBondContact O-N 2.94Å; Y958-Y962 WeakPolarHBondContact O-CD1 3.38Å; Y958-Y962 WeakPolarHBondContact O-CE1 3.31Å; Y958-Y962 VanDerWaalsContact O-CG 3.31Å; Y958-Y962 PolarHBondContact O-N 3.48Å
959	L	93.5	Very high	90.4	Very high	2 Å²	2	67 Å²	67	1%	0.01	39%	0.387	C	S	.	.	H	α-helix	trans	-60.1	-42.2	177.6	-177.5	63.1	0	0	0	112.2	L869 I873 L928 L932 V947 L951 A955 L956 G961 Y962 L963	L869-L959 HydrophobicContact CD2-CD2 4.08Å; I873-L959 HydrophobicContact CD1-CB 4.07Å; L928-L959 HydrophobicContact CD2-CD1 4.49Å; L932-L959 HydrophobicContact CD1-CD1 3.76Å; V947-L959 HydrophobicContact CG1-CD2 4.1Å; V947-L959 HydrophobicContact CG2-CD2 4.3Å; L951-L959 HydrophobicContact CD2-CD2 4.15Å; A955-L959 WeakPolarHBondContact O-CB 3.43Å; A955-L959 PolarHBondContact O-N 3.49Å; L956-L959 PolarHBondContact O-N 3.24Å; L959-G961 VanDerWaalsContact C-N 3.29Å; L959-G961 PolarHBondContact O-N 3.2Å; L959-Y962 HydrophobicContact CD1-CD2 4.21Å; L959-Y962 PolarHBondContact O-N 3Å; L959-L963 HydrophobicContact CG-CD1 4.3Å; L959-L963 WeakPolarHBondContact O-CG 3.45Å; L959-L963 PolarHBondContact O-N 3.11Å
960	Q	92.4	Very high	91.2	Very high	99 Å²	99	64 Å²	64	46%	0.463	37%	0.367	S	S	.	.	H	α-helix	trans	-59.9	-40.4	173.4	-74.5	174.8	2.8	0	0	111.6	L956 Q957 Y958 Y962 L963 Q964	L956-Q960 VanDerWaalsContact O-CG 3.3Å; L956-Q960 WeakPolarHBondContact O-CG 3.35Å; L956-Q960 PolarHBondContact O-N 2.82Å; Q957-Q960 PolarHBondContact O-N 3.02Å; Y958-Q960 VanDerWaalsContact C-N 3.33Å; Y958-Q960 PolarHBondContact O-N 2.94Å; Q960-Y962 VanDerWaalsContact C-N 3.35Å; Q960-Y962 PolarHBondContact O-N 3.43Å; Q960-L963 PolarHBondContact O-N 2.93Å; Q960-Q964 WeakPolarHBondContact O-CG 3.5Å; Q960-Q964 PolarHBondContact O-N 2.94Å
961	G	93.6	Very high	91.5	Very high	33 Å²	33	65.7 Å²	65.7	34%	0.34	37%	0.37	S	S	.	.	H	α-helix	trans	-59.2	-43	173	0	0	0	0	0	112.7	Q957 Y958 L959 Q964 A965	Q957-G961 PolarHBondContact O-N 2.76Å; Y958-G961 WeakPolarHBondContact O-CA 3.4Å; Y958-G961 PolarHBondContact O-N 2.94Å; L959-G961 VanDerWaalsContact C-N 3.29Å; L959-G961 PolarHBondContact O-N 3.2Å; G961-Q964 PolarHBondContact O-N 3.44Å; G961-A965 WeakPolarHBondContact O-CB 3.47Å; G961-A965 PolarHBondContact O-N 3.42Å
962	Y	96.3	Very high	91.8	Very high	15 Å²	15	68 Å²	68	6%	0.059	38%	0.384	C	S	.	.	H	α-helix	trans	-66.2	-42.7	177.8	-50	-22.7	0	0	0	112.2	I873 F876 E877 K925 L928 Y958 L959 Q960 A965 A966	I873-Y962 HydrophobicContact CG1-CE2 4.19Å; F876-Y962 AromaticContact CD2-CE2 3.95Å; F876-Y962 HydrophobicContact CD2-CE2 3.95Å; E877-Y962 VanDerWaalsContact CD-OH 3.32Å; E877-Y962 WeakPolarHBondContact CG-OH 3.25Å; E877-Y962 VanDerWaalsContact OE1-CE1 3.24Å; E877-Y962 WeakPolarHBondContact OE1-CE1 3.44Å; E877-Y962 PolarHBondContact OE1-OH 3.47Å; K925-Y962 HydrophobicContact CB-CD1 3.99Å; K925-Y962 HydrophobicContact CB-CD2 4.43Å; K925-Y962 HydrophobicContact CB-CE1 4.19Å; K925-Y962 HydrophobicContact CB-CG 4.14Å; K925-Y962 HydrophobicContact CD-CD1 4.24Å; K925-Y962 HydrophobicContact CD-CE1 3.7Å; K925-Y962 HydrophobicContact CG-CE1 4.32Å; L928-Y962 HydrophobicContact CD2-CD2 4.38Å; Y958-Y962 WeakPolarHBondContact O-CD1 3.38Å; Y958-Y962 WeakPolarHBondContact O-CE1 3.31Å; Y958-Y962 VanDerWaalsContact O-CG 3.31Å; Y958-Y962 PolarHBondContact O-N 3.48Å; L959-Y962 HydrophobicContact CD1-CD2 4.21Å; L959-Y962 PolarHBondContact O-N 3Å; Q960-Y962 VanDerWaalsContact C-N 3.35Å; Q960-Y962 PolarHBondContact O-N 3.43Å; Y962-A965 PolarHBondContact O-N 3.25Å; Y962-A966 VanDerWaalsContact O-CB 3.28Å; Y962-A966 WeakPolarHBondContact O-CB 3.41Å; Y962-A966 PolarHBondContact O-N 2.89Å
963	L	94.6	Very high	92	Very high	19 Å²	19	68.2 Å²	68.2	10%	0.099	39%	0.386	C	S	.	.	H	α-helix	trans	-60.9	-44.1	177.1	-71	169.5	0	0	0	111.3	A929 L959 Q960 A966 S967 V968 L970	A929-L963 HydrophobicContact CB-CD2 4.08Å; L959-L963 HydrophobicContact CG-CD1 4.3Å; L959-L963 WeakPolarHBondContact O-CG 3.45Å; L959-L963 PolarHBondContact O-N 3.11Å; Q960-L963 PolarHBondContact O-N 2.93Å; L963-A966 CarbonylContact O-C 3.52Å; L963-A966 PolarHBondContact O-N 3.05Å; L963-S967 PolarHBondContact O-N 2.93Å; L963-V968 CarbonylContact C-O 3.6Å; L963-V968 WeakPolarHBondContact CB-O 3.32Å; L963-V968 HydrophobicContact CD2-CG2 3.82Å; L963-V968 PolarHBondContact O-N 2.59Å; L963-L970 HydrophobicContact CD1-CD1 4.06Å; L963-L970 HydrophobicContact CD1-CD2 4.48Å; L963-L970 HydrophobicContact CD1-CG 3.86Å; L963-L970 HydrophobicContact CD2-CD2 3.96Å; L963-L970 HydrophobicContact CD2-CG 4.18Å
964	Q	94.7	Very high	92.2	Very high	149 Å²	149	67.4 Å²	67.4	70%	0.696	37%	0.369	S	S	*	.	H	α-helix	trans	-63.2	-47.3	174.4	-73.4	177.7	1.9	0	0	111.9	Q960 G961 A966 S967	Q960-Q964 WeakPolarHBondContact O-CG 3.5Å; Q960-Q964 PolarHBondContact O-N 2.94Å; G961-Q964 PolarHBondContact O-N 3.44Å; Q964-A966 PolarHBondContact O-N 3.35Å; Q964-S967 PolarHBondContact O-N 3.09Å
965	A	93.3	Very high	92.4	Very high	71 Å²	71	63.7 Å²	63.7	59%	0.587	36%	0.355	S	S	*	.	H	α-helix	trans	-61.3	-34.4	178	0	0	0	0	0	112.5	G961 Y962 S967	G961-A965 WeakPolarHBondContact O-CB 3.47Å; G961-A965 PolarHBondContact O-N 3.42Å; Y962-A965 PolarHBondContact O-N 3.25Å; A965-S967 VanDerWaalsContact C-N 3.34Å
966	A	93.1	Very high	92.5	Very high	15 Å²	15	67.3 Å²	67.3	12%	0.124	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-4.2	175.4	0	0	0	0	0	114	I926 A929 Q930 Y962 L963 Q964 V968	I926-A966 HydrophobicContact CG2-CB 4Å; A929-A966 HydrophobicContact CB-CB 3.63Å; Q930-A966 HydrophobicContact CG-CB 4.21Å; Y962-A966 VanDerWaalsContact O-CB 3.28Å; Y962-A966 WeakPolarHBondContact O-CB 3.41Å; Y962-A966 PolarHBondContact O-N 2.89Å; L963-A966 CarbonylContact O-C 3.52Å; L963-A966 PolarHBondContact O-N 3.05Å; Q964-A966 PolarHBondContact O-N 3.35Å; A966-V968 VanDerWaalsContact C-N 3.33Å; A966-V968 HydrophobicContact CB-CG2 3.85Å; A966-V968 PolarHBondContact O-N 2.63Å
967	S	94.3	Very high	92.6	Very high	112 Å²	112	68 Å²	68	78%	0.783	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	39.9	-175.7	-58	0	0	0	0	114.2	L963 Q964 A965	L963-S967 PolarHBondContact O-N 2.93Å; Q964-S967 PolarHBondContact O-N 3.09Å; A965-S967 VanDerWaalsContact C-N 3.34Å
968	V	94.1	Very high	92.6	Very high	25 Å²	25	62.7 Å²	62.7	15%	0.152	36%	0.359	C	S	.	.			trans	-130.5	161	-179.9	-65.2	0	0	0	0	111.6	A929 H933 L963 A966	A929-V968 HydrophobicContact CB-CG2 4.2Å; H933-V968 HydrophobicContact CB-CB 3.69Å; H933-V968 HydrophobicContact CB-CG1 4.11Å; H933-V968 HydrophobicContact CB-CG2 3.85Å; L963-V968 CarbonylContact C-O 3.6Å; L963-V968 WeakPolarHBondContact CB-O 3.32Å; L963-V968 HydrophobicContact CD2-CG2 3.82Å; L963-V968 PolarHBondContact O-N 2.59Å; A966-V968 VanDerWaalsContact C-N 3.33Å; A966-V968 HydrophobicContact CB-CG2 3.85Å; A966-V968 PolarHBondContact O-N 2.63Å
969	T	91.2	Very high	92.5	Very high	89 Å²	89	59.5 Å²	59.5	55%	0.546	36%	0.355	S	S	.	.			trans	-132.7	151.7	178.5	57.6	0	0	0	0	111	H933	H933-T969 PolarHBondContact ND1-O 3Å
970	L	89.1	Confident	92.4	Very high	38 Å²	38	64.3 Å²	64.3	20%	0.199	38%	0.384	C	S	.	.			trans	-80.7	125.6	171.4	-54.2	178	0	0	0	108.8	L932 V943 P944 V947 L963	L932-L970 HydrophobicContact CB-CD2 3.83Å; V943-L970 HydrophobicContact CG1-CD1 4.24Å; V943-L970 HydrophobicContact CG1-CD2 4.27Å; P944-L970 HydrophobicContact CG-CB 3.95Å; V947-L970 HydrophobicContact CG2-CD1 4.25Å; L963-L970 HydrophobicContact CD1-CD1 4.06Å; L963-L970 HydrophobicContact CD1-CD2 4.48Å; L963-L970 HydrophobicContact CD1-CG 3.86Å; L963-L970 HydrophobicContact CD2-CD2 3.96Å; L963-L970 HydrophobicContact CD2-CG 4.18Å
971	L	82.1	Confident	92.4	Very high	107 Å²	107	61.2 Å²	61.2	56%	0.56	38%	0.377	S	S	*	.			trans	-93.4	0	-177.9	-62.4	179.3	0	0	0	113	S936 T937 G941	S936-L971 PolarHBondContact OG-N 3.15Å; S936-L971 PolarHBondContact OG-O 2.86Å; T937-L971 HydrophobicContact CG2-CD1 4.3Å; G941-L971 PolarHBondContact N-O 3.17Å

Retrieved 971 of 971 residues in 574.5 ms (Link to these results)

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