G4VDS9_SCHMA Loading...

Prominin (Prom) protein

AlphaFold DB , UniProt , Accession G4VDS9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 904 aa.

						>G4VDS9_SCHMA|G4VDS9
MDSIYSSAKAIVSRAQPSLDGGIITFTLNNLIKIPSSNVNQSLSHTDITIIDHILSTYSRTGYALSIVCSIIWTILLIIVSYSTCRQRKRIKKRSETLLYLAPTENHTSRETIEIAIHPKHSPKSTFYRTRERLQSKWICLVIQFLLLTILTILLGTAVLLGFTVCGQFHTNLVSTPSHEESIGRLLTPTELMQTNPEKTHVFPRILRGLAQIRAYISEFIPQTKHDIEPVVKSLIEATESMQDRMTNEFNSILFNDIGVTEAFQLGDILGEHVVTLMTKYIAIVQSNTAFKHTFDRLKVEFQTWLRLVNTESPNNNDYQSCTGHCNELRSTFYNNVSIRPDTFMPEINFAIALKFLTTDRNQTAESVQAQLNHGKELSNSQLEKTKTLMAEKINIPESIRNMTNKQWDQLEPQLTKAIEEIDKISIFITRSISPKVSSTSSLFLTLNLFFWFSILLITIGLMWLIIRYHFVPTEISLHTRNRIRLGASIGFCILAFSIILACLFYLIGGYLYTEGCRYVNPEQNVINITDYDPIHHNYIQRAMFPVDAHINAFINRNWPAIVTMASQFSHMPIPHIRSPIYGILHNCHDNQGILQAMDSIRDFDMTTLNDPEMSDRFINLGKDIMIDSLRTINVDEMFPKETDENLAMASRLDDFIVNYEEVRSKLPKTYLSIQSPSDESTDYTLWPVKKMWNLWDIYYTNILSNRLSIEQIDRLNVATEKVRQTFTQLDNIISDIDGNLIVLSKLKKIAPHVAKLQKRLIELKTIMNNKTDLINRAVSLFDQHIKAKTPVEAEKLILQFGPKIMSKVGQCYRLYAAAEDLNGAICNGIVSVLNGFWFLFGWVTFIGTLIMLFSLLLLMHKTPIDQSSTVEKSYHRNIKHKDIPSMGTETSTNPSELEALNNR
					

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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	76.6	Confident	81.1	Confident	64 Å²	64	56.1 Å²	56.1	32%	0.315	33%	0.333	S	S	.	.				0	-44.4	0	-78.4	-53.3	-66.2	0	0	111.7	S3 I4 Y5 L161 V165	M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 3.44Å; M1-I4 WeakPolarHBondContact O-CA 3.32Å; M1-I4 WeakPolarHBondContact O-CB 3.24Å; M1-I4 PolarHBondContact O-N 3.2Å; M1-I4 HydrophobicContact SD-CD1 4.22Å; M1-Y5 HydrophobicContact CB-CD2 4.4Å; M1-Y5 HydrophobicContact CB-CE2 3.96Å; M1-Y5 HydrophobicContact CE-CE1 3.73Å; M1-Y5 HydrophobicContact CE-CE2 3.96Å; M1-Y5 VanDerWaalsContact CE-OH 3.25Å; M1-Y5 WeakPolarHBondContact CE-OH 2.97Å; M1-Y5 PolarHBondContact O-N 3.45Å; M1-L161 HydrophobicContact SD-CD2 3.7Å; M1-V165 HydrophobicContact CE-CB 4.4Å; M1-V165 HydrophobicContact CE-CG2 3.21Å; M1-V165 HydrophobicContact SD-CG2 4.08Å
2	D	80.3	Confident	81	Confident	129 Å²	129	51.4 Å²	51.4	69%	0.69	31%	0.305	S	S	*	.	H	α-helix	trans	-54.6	-38.9	-174.5	-53.2	-33.8	0	0	0	115.2	I4 Y5 S6	D2-I4 VanDerWaalsContact C-N 3.26Å; D2-I4 PolarHBondContact O-N 3.12Å; D2-Y5 PolarHBondContact O-N 3.43Å; D2-S6 VanDerWaalsContact O-CB 3.31Å; D2-S6 WeakPolarHBondContact O-CB 3.12Å; D2-S6 PolarHBondContact O-N 3.49Å
3	S	82.1	Confident	80.7	Confident	93 Å²	93	50.9 Å²	50.9	65%	0.65	31%	0.306	S	S	*	.	H	α-helix	trans	-61.8	-32.9	175.2	-47.4	0	0	0	0	113	M1 S7	M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 3.44Å; S3-S7 WeakPolarHBondContact O-CB 3.35Å; S3-S7 PolarHBondContact O-N 3.21Å; S3-S7 PolarHBondContact O-OG 3.35Å
4	I	81.5	Confident	80.4	Confident	19 Å²	19	62.9 Å²	62.9	10%	0.097	34%	0.343	C	S	.	.	H	α-helix	trans	-71.9	-47.1	176.7	-65	172.6	0	0	0	109.6	M1 D2 S6 S7 A8 L161 F839 L840	M1-I4 WeakPolarHBondContact O-CA 3.32Å; M1-I4 WeakPolarHBondContact O-CB 3.24Å; M1-I4 PolarHBondContact O-N 3.2Å; M1-I4 HydrophobicContact SD-CD1 4.22Å; D2-I4 VanDerWaalsContact C-N 3.26Å; D2-I4 PolarHBondContact O-N 3.12Å; I4-S6 VanDerWaalsContact C-N 3.32Å; I4-S6 PolarHBondContact O-N 3.5Å; I4-S7 PolarHBondContact O-N 3.21Å; I4-A8 WeakPolarHBondContact O-CB 3.47Å; I4-A8 PolarHBondContact O-N 3.42Å; I4-L161 HydrophobicContact CD1-CD1 3.67Å; I4-L161 HydrophobicContact CD1-CD2 4.12Å; I4-L161 HydrophobicContact CD1-CG 4.36Å; I4-F839 HydrophobicContact CG2-CB 4.46Å; I4-F839 HydrophobicContact CG2-CD1 3.6Å; I4-F839 HydrophobicContact CG2-CE1 4.14Å; I4-F839 HydrophobicContact CG2-CG 4.24Å; I4-L840 HydrophobicContact CD1-CD2 4.32Å
5	Y	82.9	Confident	80	Confident	13 Å²	13	59.6 Å²	59.6	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-60.9	-42.5	176.7	-64.3	-37.5	0	0	0	111.8	M1 D2 A8 K9 Q168 S832	M1-Y5 HydrophobicContact CB-CD2 4.4Å; M1-Y5 HydrophobicContact CB-CE2 3.96Å; M1-Y5 HydrophobicContact CE-CE1 3.73Å; M1-Y5 HydrophobicContact CE-CE2 3.96Å; M1-Y5 VanDerWaalsContact CE-OH 3.25Å; M1-Y5 WeakPolarHBondContact CE-OH 2.97Å; M1-Y5 PolarHBondContact O-N 3.45Å; D2-Y5 PolarHBondContact O-N 3.43Å; Y5-A8 PolarHBondContact O-N 2.94Å; Y5-K9 WeakPolarHBondContact O-CB 3.2Å; Y5-K9 VanDerWaalsContact O-CG 3.25Å; Y5-K9 WeakPolarHBondContact O-CG 3.34Å; Y5-K9 PolarHBondContact O-N 3.23Å; Y5-Q168 PolarHBondContact OH-OE1 3.32Å; Y5-S832 WeakPolarHBondContact CD1-O 3.27Å; Y5-S832 VanDerWaalsContact CE1-O 3.29Å; Y5-S832 WeakPolarHBondContact CE1-O 3.42Å
6	S	82.1	Confident	79.5	Confident	76 Å²	76	56.9 Å²	56.9	53%	0.531	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.2	-178.8	0	0	0	0	111.9	D2 I4 A8 K9 A10	D2-S6 VanDerWaalsContact O-CB 3.31Å; D2-S6 WeakPolarHBondContact O-CB 3.12Å; D2-S6 PolarHBondContact O-N 3.49Å; I4-S6 VanDerWaalsContact C-N 3.32Å; I4-S6 PolarHBondContact O-N 3.5Å; S6-A8 PolarHBondContact O-N 3.25Å; S6-K9 PolarHBondContact O-N 3.32Å; S6-A10 WeakPolarHBondContact O-CB 3.32Å; S6-A10 PolarHBondContact O-N 3.32Å
7	S	82.3	Confident	78.6	Confident	52 Å²	52	59.3 Å²	59.3	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-44.2	177.1	-59.5	0	0	0	0	111.9	S3 I4 A10 I11	S3-S7 WeakPolarHBondContact O-CB 3.35Å; S3-S7 PolarHBondContact O-N 3.21Å; S3-S7 PolarHBondContact O-OG 3.35Å; I4-S7 PolarHBondContact O-N 3.21Å; S7-A10 PolarHBondContact O-N 3.39Å; S7-I11 VanDerWaalsContact O-CG1 3.3Å; S7-I11 WeakPolarHBondContact O-CG1 3.37Å; S7-I11 PolarHBondContact O-N 3.32Å
8	A	82.6	Confident	77.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-46.1	177.6	0	0	0	0	0	111.3	I4 Y5 S6 A10 I11 V12 N835 W838 F839	I4-A8 WeakPolarHBondContact O-CB 3.47Å; I4-A8 PolarHBondContact O-N 3.42Å; Y5-A8 PolarHBondContact O-N 2.94Å; S6-A8 PolarHBondContact O-N 3.25Å; A8-A10 VanDerWaalsContact C-N 3.33Å; A8-A10 PolarHBondContact O-N 2.83Å; A8-I11 PolarHBondContact O-N 3.28Å; A8-V12 WeakPolarHBondContact O-CB 3.41Å; A8-V12 VanDerWaalsContact O-CG2 3.25Å; A8-V12 WeakPolarHBondContact O-CG2 3.43Å; A8-V12 PolarHBondContact O-N 3.35Å; A8-N835 HydrophobicContact CB-CB 4Å; A8-N835 WeakPolarHBondContact CB-O 3.48Å; A8-W838 HydrophobicContact CB-CZ2 4.2Å; A8-F839 HydrophobicContact CB-CB 4.25Å; A8-F839 HydrophobicContact CB-CD2 4.46Å
9	K	79.7	Confident	76.5	Confident	56 Å²	56	61.5 Å²	61.5	24%	0.243	34%	0.344	C	S	.	.	H	α-helix	trans	-58.2	-43.5	174.3	-75.4	176.5	-179.2	-177.7	0	111.7	Y5 S6 I11 V12 S13 Y513	Y5-K9 WeakPolarHBondContact O-CB 3.2Å; Y5-K9 VanDerWaalsContact O-CG 3.25Å; Y5-K9 WeakPolarHBondContact O-CG 3.34Å; Y5-K9 PolarHBondContact O-N 3.23Å; S6-K9 PolarHBondContact O-N 3.32Å; K9-I11 PolarHBondContact O-N 3.37Å; K9-V12 PolarHBondContact O-N 3.42Å; K9-S13 WeakPolarHBondContact O-CB 3.4Å; K9-S13 PolarHBondContact O-N 3.05Å; K9-S13 PolarHBondContact O-OG 3.34Å; K9-Y513 HydrophobicContact CB-CE1 4.35Å; K9-Y513 HydrophobicContact CB-CE2 4.39Å; K9-Y513 HydrophobicContact CD-CE2 4.03Å; K9-Y513 HydrophobicContact CG-CD2 4.31Å; K9-Y513 HydrophobicContact CG-CE2 3.82Å
10	A	80.5	Confident	75.8	Confident	42 Å²	42	64 Å²	64	35%	0.347	36%	0.357	S	S	.	.	H	α-helix	trans	-66.7	-33.9	179	0	0	0	0	0	113.5	S6 S7 A8 S13 R14	S6-A10 WeakPolarHBondContact O-CB 3.32Å; S6-A10 PolarHBondContact O-N 3.32Å; S7-A10 PolarHBondContact O-N 3.39Å; A8-A10 VanDerWaalsContact C-N 3.33Å; A8-A10 PolarHBondContact O-N 2.83Å; A10-S13 PolarHBondContact O-OG 3.29Å; A10-R14 WeakPolarHBondContact O-CG 3.44Å
11	I	81.1	Confident	75.2	Confident	73 Å²	73	61 Å²	61	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-70.9	-46.1	174.7	-67.1	164.3	0	0	0	110.1	S7 A8 K9 R14 A15 W838 F839	S7-I11 VanDerWaalsContact O-CG1 3.3Å; S7-I11 WeakPolarHBondContact O-CG1 3.37Å; S7-I11 PolarHBondContact O-N 3.32Å; A8-I11 PolarHBondContact O-N 3.28Å; K9-I11 PolarHBondContact O-N 3.37Å; I11-R14 PolarHBondContact O-N 3.31Å; I11-A15 PolarHBondContact O-N 2.85Å; I11-W838 HydrophobicContact CB-CH2 4.25Å; I11-W838 HydrophobicContact CB-CZ2 4.34Å; I11-W838 HydrophobicContact CD1-CH2 4Å; I11-W838 HydrophobicContact CG2-CH2 3.85Å; I11-W838 HydrophobicContact CG2-CZ2 4.23Å; I11-F839 HydrophobicContact CD1-CD2 4.08Å; I11-F839 HydrophobicContact CD1-CE2 3.76Å
12	V	80.7	Confident	75	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-40.8	-179.9	174.9	0	0	0	0	111.1	A8 K9 R14 A15 Y506 G510 Y513 T514 W838	A8-V12 WeakPolarHBondContact O-CB 3.41Å; A8-V12 VanDerWaalsContact O-CG2 3.25Å; A8-V12 WeakPolarHBondContact O-CG2 3.43Å; A8-V12 PolarHBondContact O-N 3.35Å; K9-V12 PolarHBondContact O-N 3.42Å; V12-R14 PolarHBondContact O-N 2.94Å; V12-A15 VanDerWaalsContact O-CB 3.31Å; V12-A15 WeakPolarHBondContact O-CB 3.41Å; V12-A15 PolarHBondContact O-N 3.21Å; V12-Y506 HydrophobicContact CG2-CD2 4.25Å; V12-Y506 HydrophobicContact CG2-CE2 3.88Å; V12-G510 WeakPolarHBondContact CG1-O 3.19Å; V12-Y513 HydrophobicContact CB-CD1 4.1Å; V12-Y513 HydrophobicContact CG1-CD1 3.57Å; V12-Y513 HydrophobicContact CG1-CE1 4.39Å; V12-Y513 HydrophobicContact CG1-CG 4.36Å; V12-T514 HydrophobicContact CG1-CG2 3.52Å; V12-W838 HydrophobicContact CG2-CZ2 4.15Å
13	S	76.8	Confident	74.9	Confident	45 Å²	45	54.1 Å²	54.1	32%	0.315	31%	0.305	S	S	.	.	H	α-helix	trans	-62	-28.6	178.9	68.4	0	0	0	0	113	K9 A10	K9-S13 WeakPolarHBondContact O-CB 3.4Å; K9-S13 PolarHBondContact O-N 3.05Å; K9-S13 PolarHBondContact O-OG 3.34Å; A10-S13 PolarHBondContact O-OG 3.29Å
14	R	77	Confident	74.6	Confident	218 Å²	218	52 Å²	52	82%	0.823	29%	0.286	S	S	*	.	H	α-helix	trans	-79.7	-18.8	174.4	-69.9	176	-177.9	-178.6	1.7	113.6	A10 I11 V12 Q16	A10-R14 WeakPolarHBondContact O-CG 3.44Å; I11-R14 PolarHBondContact O-N 3.31Å; V12-R14 PolarHBondContact O-N 2.94Å; R14-Q16 VanDerWaalsContact C-N 3.25Å; R14-Q16 PolarHBondContact O-N 3.44Å
15	A	73.9	Confident	74.2	Confident	14 Å²	14	51.8 Å²	51.8	12%	0.116	29%	0.285	C	S	.	.	H	α-helix	trans	-72.4	-20.5	-177.9	0	0	0	0	0	112.9	I11 V12 T61 G62 Y506	I11-A15 PolarHBondContact O-N 2.85Å; V12-A15 VanDerWaalsContact O-CB 3.31Å; V12-A15 WeakPolarHBondContact O-CB 3.41Å; V12-A15 PolarHBondContact O-N 3.21Å; A15-T61 WeakPolarHBondContact O-CB 3.45Å; A15-G62 PolarHBondContact O-N 3.45Å; A15-Y506 VanDerWaalsContact CB-OH 3.26Å; A15-Y506 WeakPolarHBondContact CB-OH 3.39Å
16	Q	71.8	Confident	73.8	Confident	17 Å²	17	52.2 Å²	52.2	8%	0.079	29%	0.288	C	S	.	.	S	Bend	trans	-138.8	128.9	-177.2	-169.9	173.5	-3.6	0	0	112.2	R14 T61 T514 E515 R518	R14-Q16 VanDerWaalsContact C-N 3.25Å; R14-Q16 PolarHBondContact O-N 3.44Å; Q16-T61 HydrophobicContact CB-CG2 4.31Å; Q16-T61 HydrophobicContact CG-CG2 3.84Å; Q16-T514 HydrophobicContact CB-CG2 4.16Å; Q16-T514 PolarHBondContact OE1-OG1 2.94Å; Q16-E515 PolarHBondContact NE2-OE1 3.39Å; Q16-E515 PolarHBondContact OE1-OE1 3.02Å; Q16-R518 PolarHBondContact O-NH1 3.39Å
17	P	64.9	Low	73.7	Confident	97 Å²	97	50.8 Å²	50.8	63%	0.63	28%	0.276	S	S	*	.			trans	-56.1	150.3	174	7.3	-9.4	0	0	0	111.8	L19 R518	P17-L19 PolarHBondContact O-N 3.3Å; P17-R518 PolarHBondContact O-NH2 3.15Å
18	S	60.7	Low	73.4	Confident	45 Å²	45	49.4 Å²	49.4	32%	0.315	26%	0.264	S	S	.	.	S	Bend	trans	-75.9	0.2	-171.4	57.9	0	0	0	0	115.5
19	L	56.2	Low	73	Confident	115 Å²	115	53.5 Å²	53.5	60%	0.602	29%	0.286	S	S	*	.			trans	-101.4	-3.6	-146	-75.2	163.1	0	0	0	117.7	P17	P17-L19 PolarHBondContact O-N 3.3Å
20	D	62.5	Low	72.9	Confident	112 Å²	112	53.9 Å²	53.9	60%	0.599	29%	0.291	S	S	*	.	S	Bend	trans	-110.7	4.2	-168.7	-68.2	-11.6	0	0	0	115.6	G22 T25	D20-G22 PolarHBondContact O-N 3.36Å; D20-T25 WeakPolarHBondContact O-CB 3.34Å; D20-T25 WeakPolarHBondContact O-CG2 3.31Å; D20-T25 PolarHBondContact O-OG1 3Å
21	G	63.8	Low	72.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.			trans	61.4	2.2	-176.8	0	0	0	0	0	115.5	T25 Y519	G21-T25 VanDerWaalsContact CA-OG1 3.27Å; G21-T25 WeakPolarHBondContact CA-OG1 3.24Å; G21-Y519 VanDerWaalsContact C-CE2 3.5Å
22	G	72.4	Confident	72.1	Confident	3 Å²	3	55.6 Å²	55.6	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	65.5	-144.7	169.8	0	0	0	0	0	116.2	D20 I24 T25 F26 E515	D20-G22 PolarHBondContact O-N 3.36Å; G22-I24 PolarHBondContact O-N 3.27Å; G22-I24 VanDerWaalsContact O-N 3.14Å; G22-T25 PolarHBondContact O-N 3.13Å; G22-T25 VanDerWaalsContact O-N 3.12Å; G22-F26 PolarHBondContact O-N 2.99Å; G22-F26 VanDerWaalsContact O-N 3.08Å; G22-E515 VanDerWaalsContact CA-CD 3.49Å; G22-E515 WeakPolarHBondContact CA-OE2 3.28Å
23	I	76.6	Confident	71.5	Confident	46 Å²	46	63.1 Å²	63.1	24%	0.236	33%	0.326	C	S	.	.	H	α-helix	trans	-58.8	-27.9	-176.1	-161.6	170.4	0	0	0	112.9	F26 T27 I50 Y511 E515	I23-F26 PolarHBondContact O-N 3.2Å; I23-T27 VanDerWaalsContact O-CB 3.3Å; I23-T27 WeakPolarHBondContact O-CB 3.28Å; I23-T27 PolarHBondContact O-N 3.35Å; I23-T27 PolarHBondContact O-OG1 3.22Å; I23-I50 HydrophobicContact CD1-CG2 4.35Å; I23-Y511 HydrophobicContact CD1-CE1 4.49Å; I23-E515 HydrophobicContact CB-CB 4.47Å; I23-E515 PolarHBondContact N-OE2 2.94Å
24	I	76.2	Confident	71	Confident	50 Å²	50	62.5 Å²	62.5	26%	0.256	32%	0.319	S	S	.	.	H	α-helix	trans	-66.2	-52.1	177.2	-62.6	173.6	0	0	0	109.6	G22 F26 T27 L28 V547 I581	G22-I24 PolarHBondContact O-N 3.27Å; G22-I24 VanDerWaalsContact O-N 3.14Å; I24-F26 VanDerWaalsContact C-N 3.28Å; I24-F26 PolarHBondContact O-N 3.46Å; I24-T27 PolarHBondContact O-N 3.39Å; I24-L28 HydrophobicContact CG2-CD1 3.86Å; I24-L28 WeakPolarHBondContact O-CG 3.31Å; I24-L28 PolarHBondContact O-N 3.04Å; I24-V547 HydrophobicContact CB-CG1 4.35Å; I24-V547 HydrophobicContact CD1-CG1 4.1Å; I24-V547 HydrophobicContact CG2-CG1 3.89Å; I24-I581 HydrophobicContact CD1-CD1 4.38Å
25	T	73.3	Confident	70.3	Confident	13 Å²	13	56.4 Å²	56.4	8%	0.08	31%	0.308	C	S	.	.	H	α-helix	trans	-59.1	-41	176.1	-53.6	0	0	0	0	111.7	D20 G21 G22 N29 H550	D20-T25 WeakPolarHBondContact O-CB 3.34Å; D20-T25 WeakPolarHBondContact O-CG2 3.31Å; D20-T25 PolarHBondContact O-OG1 3Å; G21-T25 VanDerWaalsContact CA-OG1 3.27Å; G21-T25 WeakPolarHBondContact CA-OG1 3.24Å; G22-T25 PolarHBondContact O-N 3.13Å; G22-T25 VanDerWaalsContact O-N 3.12Å; T25-N29 WeakPolarHBondContact CG2-ND2 3.49Å; T25-N29 WeakPolarHBondContact O-CB 3.05Å; T25-N29 PolarHBondContact O-N 3.47Å; T25-N29 PolarHBondContact O-ND2 3.46Å; T25-H550 HydrophobicContact CG2-CB 4.03Å; T25-H550 PolarHBondContact OG1-CD2 2.73Å
26	F	75.3	Confident	69.4	Low	22 Å²	22	59.4 Å²	59.4	10%	0.096	33%	0.328	C	S	.	.	H	α-helix	trans	-61.8	-46.5	176.1	174.5	-97.1	0	0	0	111.9	G22 I23 I24 N29 N30 L31 I48 H53	G22-F26 PolarHBondContact O-N 2.99Å; G22-F26 VanDerWaalsContact O-N 3.08Å; I23-F26 PolarHBondContact O-N 3.2Å; I24-F26 VanDerWaalsContact C-N 3.28Å; I24-F26 PolarHBondContact O-N 3.46Å; F26-N29 PolarHBondContact O-N 3.13Å; F26-N30 HydrophobicContact CD2-CB 4.45Å; F26-N30 WeakPolarHBondContact CD2-ND2 3.33Å; F26-N30 HydrophobicContact CE2-CB 3.99Å; F26-N30 WeakPolarHBondContact CE2-ND2 3.44Å; F26-N30 HydrophobicContact CZ-CB 4.06Å; F26-N30 WeakPolarHBondContact O-CB 3.48Å; F26-N30 PolarHBondContact O-N 2.97Å; F26-N30 PolarHBondContact O-ND2 3.47Å; F26-L31 HydrophobicContact CD1-CD1 4.5Å; F26-L31 HydrophobicContact CE1-CD1 4.15Å; F26-L31 HydrophobicContact CE1-CG 4.22Å; F26-I48 HydrophobicContact CE2-CG2 3.83Å; F26-I48 HydrophobicContact CZ-CB 4.47Å; F26-I48 HydrophobicContact CZ-CG2 3.73Å; F26-H53 HydrophobicContact CD1-CB 3.72Å; F26-H53 AromaticContact CD1-CG 3.75Å; F26-H53 HydrophobicContact CD2-CB 3.8Å; F26-H53 AromaticContact CD2-CG 3.68Å; F26-H53 AromaticContact CD2-ND1 3.4Å; F26-H53 WeakPolarHBondContact CD2-ND1 3.23Å; F26-H53 HydrophobicContact CE1-CB 3.63Å; F26-H53 HydrophobicContact CE2-CB 3.71Å; F26-H53 HydrophobicContact CG-CB 3.81Å; F26-H53 AromaticContact CG-CE1 3.99Å; F26-H53 AromaticContact CG-CG 3.48Å; F26-H53 VanDerWaalsContact CG-CG 3.48Å; F26-H53 AromaticContact CG-ND1 3.47Å; F26-H53 WeakPolarHBondContact CG-ND1 3.47Å; F26-H53 HydrophobicContact CZ-CB 3.64Å
27	T	78.7	Confident	68.3	Low	46 Å²	46	64 Å²	64	28%	0.282	36%	0.362	S	S	.	.	I	π-helix	trans	-61.5	-47.2	-179.8	-60.6	0	0	0	0	110.9	I23 I24 N29 L31 I32	I23-T27 VanDerWaalsContact O-CB 3.3Å; I23-T27 WeakPolarHBondContact O-CB 3.28Å; I23-T27 PolarHBondContact O-N 3.35Å; I23-T27 PolarHBondContact O-OG1 3.22Å; I24-T27 PolarHBondContact O-N 3.39Å; T27-N29 PolarHBondContact O-N 2.98Å; T27-L31 HydrophobicContact CG2-CB 4.18Å; T27-L31 HydrophobicContact CG2-CD1 4.07Å; T27-L31 WeakPolarHBondContact O-CA 3.41Å; T27-L31 WeakPolarHBondContact O-CB 3.45Å; T27-L31 PolarHBondContact O-N 2.93Å; T27-I32 HydrophobicContact CG2-CG1 4.46Å; T27-I32 PolarHBondContact O-N 3.05Å; T27-I32 VanDerWaalsContact O-N 3.11Å
28	L	77	Confident	67.3	Low	24 Å²	24	66.2 Å²	66.2	13%	0.126	37%	0.368	C	S	.	.	I	π-helix	trans	-58.1	-51	177.5	-70.4	162.4	0	0	0	111	I24 I32 I551 F554	I24-L28 HydrophobicContact CG2-CD1 3.86Å; I24-L28 WeakPolarHBondContact O-CG 3.31Å; I24-L28 PolarHBondContact O-N 3.04Å; L28-I32 HydrophobicContact CD2-CD1 3.87Å; L28-I551 HydrophobicContact CD1-CG1 3.73Å; L28-F554 HydrophobicContact CB-CB 4.45Å; L28-F554 HydrophobicContact CB-CD1 4.39Å; L28-F554 HydrophobicContact CB-CD2 3.91Å; L28-F554 HydrophobicContact CB-CE2 4.26Å; L28-F554 HydrophobicContact CB-CG 3.98Å; L28-F554 HydrophobicContact CD2-CD1 3.77Å; L28-F554 HydrophobicContact CD2-CE1 3.95Å; L28-F554 HydrophobicContact CD2-CG 4.19Å; L28-F554 WeakPolarHBondContact O-CE2 3.32Å
29	N	74.7	Confident	66.6	Low	86 Å²	86	70.2 Å²	70.2	46%	0.46	39%	0.391	S	S	.	.	I	π-helix	trans	-76.2	-25	-172.8	-72.6	-36.3	0	0	0	115.1	T25 F26 T27	T25-N29 WeakPolarHBondContact CG2-ND2 3.49Å; T25-N29 WeakPolarHBondContact O-CB 3.05Å; T25-N29 PolarHBondContact O-N 3.47Å; T25-N29 PolarHBondContact O-ND2 3.46Å; F26-N29 PolarHBondContact O-N 3.13Å; T27-N29 PolarHBondContact O-N 2.98Å
30	N	76	Confident	65.9	Low	64 Å²	64	72.2 Å²	72.2	34%	0.342	40%	0.402	S	S	.	.	I	π-helix	trans	-121.7	-30.6	-170.5	-58.2	-80.8	0	0	0	114.5	F26	F26-N30 HydrophobicContact CD2-CB 4.45Å; F26-N30 WeakPolarHBondContact CD2-ND2 3.33Å; F26-N30 HydrophobicContact CE2-CB 3.99Å; F26-N30 WeakPolarHBondContact CE2-ND2 3.44Å; F26-N30 HydrophobicContact CZ-CB 4.06Å; F26-N30 WeakPolarHBondContact O-CB 3.48Å; F26-N30 PolarHBondContact O-N 2.97Å; F26-N30 PolarHBondContact O-ND2 3.47Å
31	L	73.1	Confident	65	Low	67 Å²	67	75.4 Å²	75.4	35%	0.351	41%	0.414	S	S	.	.	I	π-helix	trans	-99.7	-33.8	-173.9	-60.8	176.8	0	0	0	112.4	F26 T27 K33 I50	F26-L31 HydrophobicContact CD1-CD1 4.5Å; F26-L31 HydrophobicContact CE1-CD1 4.15Å; F26-L31 HydrophobicContact CE1-CG 4.22Å; T27-L31 HydrophobicContact CG2-CB 4.18Å; T27-L31 HydrophobicContact CG2-CD1 4.07Å; T27-L31 WeakPolarHBondContact O-CA 3.41Å; T27-L31 WeakPolarHBondContact O-CB 3.45Å; T27-L31 PolarHBondContact O-N 2.93Å; L31-K33 PolarHBondContact O-N 3.33Å; L31-K33 VanDerWaalsContact O-N 3.09Å; L31-I50 HydrophobicContact CD1-CD1 3.96Å; L31-I50 HydrophobicContact CD1-CG1 3.55Å
32	I	72	Confident	63.8	Low	84 Å²	84	81.1 Å²	81.1	43%	0.431	45%	0.453	S	S	.	.			trans	-80.2	95.5	176.8	-54.6	-171	0	0	0	109.1	T27 L28 I34 F554	T27-I32 HydrophobicContact CG2-CG1 4.46Å; T27-I32 PolarHBondContact O-N 3.05Å; T27-I32 VanDerWaalsContact O-N 3.11Å; L28-I32 HydrophobicContact CD2-CD1 3.87Å; I32-I34 HydrophobicContact CG2-CG1 4.15Å; I32-I34 PolarHBondContact O-N 3.16Å; I32-F554 HydrophobicContact CB-CZ 4.25Å; I32-F554 HydrophobicContact CG2-CZ 4.18Å
33	K	68.5	Low	62.3	Low	158 Å²	158	86.9 Å²	86.9	69%	0.687	48%	0.483	S	S	*	.			trans	-81.1	99.3	172.8	-65.7	-177.7	-176.8	177.2	0	109.1	L31 D47	L31-K33 PolarHBondContact O-N 3.33Å; L31-K33 VanDerWaalsContact O-N 3.09Å; K33-D47 IonicContact NZ-OD1 3.77Å; K33-D47 PolarHBondContact NZ-OD1 2.84Å
34	I	65.8	Low	60.7	Low	31 Å²	31	90.4 Å²	90.4	16%	0.159	51%	0.511	C	S	.	.			trans	-80.2	127	168.4	-66.6	171.7	0	0	0	107.4	I32 S36 F554 N558 A561 I562 M565	I32-I34 HydrophobicContact CG2-CG1 4.15Å; I32-I34 PolarHBondContact O-N 3.16Å; I34-S36 PolarHBondContact O-N 2.98Å; I34-F554 HydrophobicContact CD1-CE1 3.92Å; I34-F554 HydrophobicContact CD1-CZ 3.6Å; I34-F554 HydrophobicContact CG1-CZ 4.44Å; I34-N558 HydrophobicContact CD1-CB 3.46Å; I34-N558 VanDerWaalsContact CD1-CB 3.46Å; I34-A561 HydrophobicContact CG2-CB 3.32Å; I34-I562 HydrophobicContact CD1-CG1 4.31Å; I34-M565 HydrophobicContact CB-CE 4.24Å; I34-M565 HydrophobicContact CG1-CE 4.21Å; I34-M565 HydrophobicContact CG2-CE 3.39Å
35	P	63.4	Low	59.4	Low	90 Å²	90	95.6 Å²	95.6	58%	0.584	53%	0.534	S	S	*	.			trans	-60.4	102.5	174.1	23.2	-31.4	0	0	0	108.8	M565	P35-M565 HydrophobicContact CG-CG 4.35Å; P35-M565 HydrophobicContact CG-SD 3.82Å
36	S	54.6	Low	58.5	Low	78 Å²	78	100.3 Å²	100.3	55%	0.545	56%	0.563	S	S	.	*			trans	-75.5	131.7	170.8	56.3	0	0	0	0	108.1	I34 N38	I34-S36 PolarHBondContact O-N 2.98Å; S36-N38 PolarHBondContact O-N 3.4Å
37	S	47.7	Very low	57.8	Low	113 Å²	113	104.8 Å²	104.8	79%	0.79	59%	0.588	S	S	*	*	S	Bend	trans	-67.9	13.5	-177.8	47.3	0	0	0	0	114.8
38	N	45.8	Very low	57.4	Low	143 Å²	143	105.8 Å²	105.8	77%	0.765	59%	0.591	S	S	*	*			trans	-128.5	73.7	174.3	-80.2	-28.5	0	0	0	110.5	S36 N40	S36-N38 PolarHBondContact O-N 3.4Å; N38-N40 PolarHBondContact O-N 3.23Å; N38-N40 VanDerWaalsContact O-N 3.09Å
39	V	44.6	Very low	57.6	Low	129 Å²	129	107.5 Å²	107.5	78%	0.782	60%	0.603	S	S	*	*			trans	-72.1	94.3	166.8	179.9	0	0	0	0	107.9
40	N	41.5	Very low	57.9	Low	158 Å²	158	107.2 Å²	107.2	85%	0.845	60%	0.6	S	S	*	*			trans	-158.4	15.5	154.2	-100.1	-11.9	0	0	0	114.2	N38 S42	N38-N40 PolarHBondContact O-N 3.23Å; N38-N40 VanDerWaalsContact O-N 3.09Å; N40-S42 PolarHBondContact O-N 3.49Å
41	Q	43.6	Very low	58.2	Low	179 Å²	179	109.5 Å²	109.5	84%	0.836	61%	0.611	S	S	*	*			trans	-93.8	86.7	166.7	-76.3	-176.8	-5.9	0	0	109.6	L43	Q41-L43 PolarHBondContact O-N 2.8Å
42	S	39.3	Very low	58.6	Low	119 Å²	119	109.8 Å²	109.8	83%	0.832	61%	0.613	S	S	*	*			trans	-65	72	153.5	59.8	0	0	0	0	109	N40	N40-S42 PolarHBondContact O-N 3.49Å
43	L	41.5	Very low	59	Low	125 Å²	125	107.1 Å²	107.1	65%	0.654	60%	0.599	S	S	*	*			trans	-112.8	122.7	155.9	-98.5	92.2	0	0	0	107	Q41 H45	Q41-L43 PolarHBondContact O-N 2.8Å; L43-H45 PolarHBondContact O-N 3.39Å
44	S	41.1	Very low	59.7	Low	119 Å²	119	101.8 Å²	101.8	83%	0.832	58%	0.577	S	S	*	*			trans	-52.9	80.2	168.7	54.1	0	0	0	0	110.3	T46	S44-T46 VanDerWaalsContact C-N 3.29Å; S44-T46 PolarHBondContact O-N 3.34Å
45	H	49.6	Very low	60.6	Low	159 Å²	159	105.2 Å²	105.2	74%	0.736	60%	0.595	S	S	*	*			trans	-67.8	98.5	162.5	-95	-74.7	0	0	0	105.6	L43 D47	L43-H45 PolarHBondContact O-N 3.39Å; H45-D47 PolarHBondContact O-N 3.4Å; H45-D47 VanDerWaalsContact O-N 3.12Å
46	T	54.2	Low	61.5	Low	112 Å²	112	102.7 Å²	102.7	69%	0.687	58%	0.58	S	S	*	*			trans	-44.7	119.3	162.1	39.9	0	0	0	0	107.4	S44 I48	S44-T46 VanDerWaalsContact C-N 3.29Å; S44-T46 PolarHBondContact O-N 3.34Å; T46-I48 VanDerWaalsContact C-N 3.34Å; T46-I48 WeakPolarHBondContact O-CG1 3.46Å; T46-I48 PolarHBondContact O-N 2.79Å
47	D	62.1	Low	62.7	Low	116 Å²	116	99.6 Å²	99.6	62%	0.62	56%	0.558	S	S	*	*			trans	-58.7	98.3	178.8	-77.1	-46	0	0	0	108.4	K33 H45 T49	K33-D47 IonicContact NZ-OD1 3.77Å; K33-D47 PolarHBondContact NZ-OD1 2.84Å; H45-D47 PolarHBondContact O-N 3.4Å; H45-D47 VanDerWaalsContact O-N 3.12Å; D47-T49 PolarHBondContact O-N 3.44Å
48	I	70.2	Confident	64.4	Low	68 Å²	68	96 Å²	96	35%	0.349	53%	0.527	S	S	.	.			trans	-71.7	117.2	179.2	-51.3	-179.7	0	0	0	106.5	F26 T46 D52	F26-I48 HydrophobicContact CE2-CG2 3.83Å; F26-I48 HydrophobicContact CZ-CB 4.47Å; F26-I48 HydrophobicContact CZ-CG2 3.73Å; T46-I48 VanDerWaalsContact C-N 3.34Å; T46-I48 WeakPolarHBondContact O-CG1 3.46Å; T46-I48 PolarHBondContact O-N 2.79Å; I48-D52 HydrophobicContact CG2-CB 4.08Å
49	T	81.1	Confident	66.1	Low	60 Å²	60	93 Å²	93	37%	0.368	52%	0.518	S	S	.	.			trans	-90.7	163.9	-176	67.4	0	0	0	0	111.8	D47 I51 D52 H53	D47-T49 PolarHBondContact O-N 3.44Å; T49-I51 PolarHBondContact O-N 2.95Å; T49-I51 PolarHBondContact OG1-N 3.49Å; T49-D52 PolarHBondContact N-OD2 3.3Å; T49-D52 WeakPolarHBondContact O-CB 3.12Å; T49-D52 PolarHBondContact O-N 3.48Å; T49-D52 VanDerWaalsContact O-N 3.13Å; T49-D52 VanDerWaalsContact OG1-CG 3.24Å; T49-D52 PolarHBondContact OG1-N 3.41Å; T49-D52 PolarHBondContact OG1-OD2 2.87Å; T49-H53 PolarHBondContact O-N 3.32Å
50	I	79.8	Confident	67.4	Low	80 Å²	80	96.8 Å²	96.8	41%	0.41	52%	0.518	S	S	.	.	H	α-helix	trans	-57.8	-33	170.7	-64.4	172	0	0	0	110.9	I23 L31 D52 H53 I54	I23-I50 HydrophobicContact CD1-CG2 4.35Å; L31-I50 HydrophobicContact CD1-CD1 3.96Å; L31-I50 HydrophobicContact CD1-CG1 3.55Å; I50-D52 VanDerWaalsContact C-N 3.34Å; I50-H53 WeakPolarHBondContact O-CB 3.31Å; I50-H53 PolarHBondContact O-N 3.29Å; I50-I54 HydrophobicContact CG2-CD1 3.94Å; I50-I54 HydrophobicContact CG2-CG1 4.41Å; I50-I54 WeakPolarHBondContact O-CG1 3.25Å; I50-I54 PolarHBondContact O-N 2.77Å
51	I	82.8	Confident	69.2	Low	112 Å²	112	90.4 Å²	90.4	57%	0.574	49%	0.485	S	S	*	.	H	α-helix	trans	-64.8	-41.6	178.6	-59.7	175.9	0	0	0	110.3	T49 H53 I54 L55	T49-I51 PolarHBondContact O-N 2.95Å; T49-I51 PolarHBondContact OG1-N 3.49Å; I51-H53 VanDerWaalsContact C-N 3.28Å; I51-H53 PolarHBondContact O-N 2.9Å; I51-I54 PolarHBondContact O-N 2.68Å; I51-L55 HydrophobicContact CG2-CD1 3.9Å; I51-L55 HydrophobicContact CG2-CG 4.29Å; I51-L55 WeakPolarHBondContact O-CB 3.26Å; I51-L55 WeakPolarHBondContact O-CG 3.46Å; I51-L55 PolarHBondContact O-N 2.99Å
52	D	81.3	Confident	70.8	Confident	73 Å²	73	83.3 Å²	83.3	39%	0.39	46%	0.459	S	S	.	.	H	α-helix	trans	-62.5	-37.8	177	-59.2	-46.8	0	0	0	111.6	I48 T49 I50 S56	I48-D52 HydrophobicContact CG2-CB 4.08Å; T49-D52 PolarHBondContact N-OD2 3.3Å; T49-D52 WeakPolarHBondContact O-CB 3.12Å; T49-D52 PolarHBondContact O-N 3.48Å; T49-D52 VanDerWaalsContact O-N 3.13Å; T49-D52 VanDerWaalsContact OG1-CG 3.24Å; T49-D52 PolarHBondContact OG1-N 3.41Å; T49-D52 PolarHBondContact OG1-OD2 2.87Å; I50-D52 VanDerWaalsContact C-N 3.34Å; D52-S56 WeakPolarHBondContact O-CB 3.48Å; D52-S56 PolarHBondContact O-N 3.21Å
53	H	81	Confident	73	Confident	27 Å²	27	77.6 Å²	77.6	13%	0.125	42%	0.419	C	S	.	.	H	α-helix	trans	-64.5	-48.7	173.8	-179.4	67.1	0	0	0	112	F26 T49 I50 I51 L55 S56 T57 Y511 E515	F26-H53 HydrophobicContact CD1-CB 3.72Å; F26-H53 AromaticContact CD1-CG 3.75Å; F26-H53 HydrophobicContact CD2-CB 3.8Å; F26-H53 AromaticContact CD2-CG 3.68Å; F26-H53 AromaticContact CD2-ND1 3.4Å; F26-H53 WeakPolarHBondContact CD2-ND1 3.23Å; F26-H53 HydrophobicContact CE1-CB 3.63Å; F26-H53 HydrophobicContact CE2-CB 3.71Å; F26-H53 HydrophobicContact CG-CB 3.81Å; F26-H53 AromaticContact CG-CE1 3.99Å; F26-H53 AromaticContact CG-CG 3.48Å; F26-H53 VanDerWaalsContact CG-CG 3.48Å; F26-H53 AromaticContact CG-ND1 3.47Å; F26-H53 WeakPolarHBondContact CG-ND1 3.47Å; F26-H53 HydrophobicContact CZ-CB 3.64Å; T49-H53 PolarHBondContact O-N 3.32Å; I50-H53 WeakPolarHBondContact O-CB 3.31Å; I50-H53 PolarHBondContact O-N 3.29Å; I51-H53 VanDerWaalsContact C-N 3.28Å; I51-H53 PolarHBondContact O-N 2.9Å; H53-L55 VanDerWaalsContact C-N 3.33Å; H53-L55 PolarHBondContact O-N 3.06Å; H53-S56 PolarHBondContact O-N 2.9Å; H53-T57 WeakPolarHBondContact O-CB 3.23Å; H53-T57 PolarHBondContact O-N 3.39Å; H53-T57 PolarHBondContact O-OG1 3.49Å; H53-Y511 PolarHBondContact CD2-OH 3.09Å; H53-E515 IonicContact NE2-OE2 3.98Å; H53-E515 PolarHBondContact NE2-OE2 3.14Å
54	I	82.8	Confident	75	Confident	47 Å²	47	73.2 Å²	73.2	24%	0.241	40%	0.401	C	S	.	.	H	α-helix	trans	-57.5	-48	177.8	-67.8	165.5	0	0	0	110.5	I50 I51 T57 Y58 Y511	I50-I54 HydrophobicContact CG2-CD1 3.94Å; I50-I54 HydrophobicContact CG2-CG1 4.41Å; I50-I54 WeakPolarHBondContact O-CG1 3.25Å; I50-I54 PolarHBondContact O-N 2.77Å; I51-I54 PolarHBondContact O-N 2.68Å; I54-T57 PolarHBondContact O-N 3.42Å; I54-Y58 HydrophobicContact CG2-CD2 3.85Å; I54-Y58 HydrophobicContact CG2-CE2 3.36Å; I54-Y58 PolarHBondContact O-N 3.17Å; I54-Y511 HydrophobicContact CB-CE2 4.39Å; I54-Y511 HydrophobicContact CG1-CE1 4.12Å; I54-Y511 HydrophobicContact CG1-CE2 3.97Å; I54-Y511 WeakPolarHBondContact CG1-OH 3.06Å; I54-Y511 HydrophobicContact CG2-CE2 4.45Å
55	L	84.3	Confident	77.1	Confident	102 Å²	102	73.3 Å²	73.3	53%	0.534	39%	0.392	S	S	.	.	H	α-helix	trans	-64	-42.7	179.1	-70.5	173.8	0	0	0	111.9	I51 H53 Y58 S59	I51-L55 HydrophobicContact CG2-CD1 3.9Å; I51-L55 HydrophobicContact CG2-CG 4.29Å; I51-L55 WeakPolarHBondContact O-CB 3.26Å; I51-L55 WeakPolarHBondContact O-CG 3.46Å; I51-L55 PolarHBondContact O-N 2.99Å; H53-L55 VanDerWaalsContact C-N 3.33Å; H53-L55 PolarHBondContact O-N 3.06Å; L55-Y58 PolarHBondContact O-N 3.36Å; L55-S59 WeakPolarHBondContact O-CB 3.41Å; L55-S59 PolarHBondContact O-N 2.99Å
56	S	82.4	Confident	78.8	Confident	38 Å²	38	67.4 Å²	67.4	27%	0.266	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-46.7	174.9	173.5	0	0	0	0	111.1	D52 H53 Y58 S59 R60	D52-S56 WeakPolarHBondContact O-CB 3.48Å; D52-S56 PolarHBondContact O-N 3.21Å; H53-S56 PolarHBondContact O-N 2.9Å; S56-Y58 VanDerWaalsContact C-N 3.35Å; S56-Y58 PolarHBondContact O-N 3.21Å; S56-S59 PolarHBondContact O-N 3.3Å; S56-S59 VanDerWaalsContact O-N 3.11Å; S56-S59 PolarHBondContact O-OG 2.88Å; S56-R60 WeakPolarHBondContact O-CG 3.28Å; S56-R60 PolarHBondContact O-N 3.37Å
57	T	80.7	Confident	80.4	Confident	12 Å²	12	64.7 Å²	64.7	7%	0.074	35%	0.349	C	S	.	.	H	α-helix	trans	-60.5	-44.5	177.3	-61.9	0	0	0	0	110.9	H53 I54 S59 R60 T61 Y511	H53-T57 WeakPolarHBondContact O-CB 3.23Å; H53-T57 PolarHBondContact O-N 3.39Å; H53-T57 PolarHBondContact O-OG1 3.49Å; I54-T57 PolarHBondContact O-N 3.42Å; T57-S59 VanDerWaalsContact C-N 3.31Å; T57-S59 PolarHBondContact O-N 2.86Å; T57-R60 PolarHBondContact O-N 2.9Å; T57-T61 HydrophobicContact CG2-CG2 4.36Å; T57-T61 WeakPolarHBondContact O-CB 3.31Å; T57-T61 WeakPolarHBondContact O-CG2 3.32Å; T57-T61 PolarHBondContact O-N 3.42Å; T57-T61 PolarHBondContact O-OG1 3Å; T57-Y511 HydrophobicContact CG2-CD2 4.2Å; T57-Y511 HydrophobicContact CG2-CE2 4.1Å
58	Y	82.2	Confident	81.7	Confident	38 Å²	38	62.8 Å²	62.8	15%	0.149	34%	0.342	C	S	.	.	H	α-helix	trans	-62.8	-36.5	174.7	-67.5	-23.4	0	0	0	113.2	I54 L55 S56 Y63 A64 L507 Y511	I54-Y58 HydrophobicContact CG2-CD2 3.85Å; I54-Y58 HydrophobicContact CG2-CE2 3.36Å; I54-Y58 PolarHBondContact O-N 3.17Å; L55-Y58 PolarHBondContact O-N 3.36Å; S56-Y58 VanDerWaalsContact C-N 3.35Å; S56-Y58 PolarHBondContact O-N 3.21Å; Y58-Y63 HydrophobicContact CD1-CD1 4.42Å; Y58-Y63 AromaticContact CD1-CD2 3.67Å; Y58-Y63 HydrophobicContact CD1-CD2 3.67Å; Y58-Y63 HydrophobicContact CD1-CE2 4.48Å; Y58-Y63 AromaticContact CD1-CG 3.72Å; Y58-Y63 HydrophobicContact CD1-CG 3.72Å; Y58-Y63 HydrophobicContact CE1-CD1 4.48Å; Y58-Y63 HydrophobicContact CE1-CD2 4.15Å; Y58-Y63 HydrophobicContact CE1-CG 4.17Å; Y58-A64 WeakPolarHBondContact O-CB 3.39Å; Y58-A64 PolarHBondContact O-N 3.21Å; Y58-L507 HydrophobicContact CD1-CD2 3.95Å; Y58-L507 HydrophobicContact CD2-CD2 4.44Å; Y58-L507 HydrophobicContact CE1-CB 4.3Å; Y58-L507 HydrophobicContact CE1-CD2 3.87Å; Y58-L507 HydrophobicContact CE2-CB 4.46Å; Y58-L507 HydrophobicContact CE2-CD2 4.38Å; Y58-L507 HydrophobicContact CG-CD2 4.24Å; Y58-L507 PolarHBondContact OH-O 3.41Å; Y58-Y511 AromaticContact CE1-CD2 3.89Å; Y58-Y511 HydrophobicContact CE1-CD2 3.89Å; Y58-Y511 HydrophobicContact CE1-CG 4.28Å
59	S	81	Confident	82.6	Confident	81 Å²	81	62.6 Å²	62.6	57%	0.566	35%	0.345	S	S	*	.	H	α-helix	trans	-73.1	-30.8	-178.8	74.9	0	0	0	0	114.3	L55 S56 T57	L55-S59 WeakPolarHBondContact O-CB 3.41Å; L55-S59 PolarHBondContact O-N 2.99Å; S56-S59 PolarHBondContact O-N 3.3Å; S56-S59 VanDerWaalsContact O-N 3.11Å; S56-S59 PolarHBondContact O-OG 2.88Å; T57-S59 VanDerWaalsContact C-N 3.31Å; T57-S59 PolarHBondContact O-N 2.86Å
60	R	73.6	Confident	83	Confident	208 Å²	208	60.3 Å²	60.3	79%	0.785	33%	0.332	S	S	*	.	H	α-helix	trans	-95	-9.7	-171.9	-70.6	-178.7	179	-176.9	1.1	114.8	S56 T57	S56-R60 WeakPolarHBondContact O-CG 3.28Å; S56-R60 PolarHBondContact O-N 3.37Å; T57-R60 PolarHBondContact O-N 2.9Å
61	T	77.9	Confident	83.6	Confident	24 Å²	24	60.9 Å²	60.9	15%	0.147	34%	0.335	C	S	.	.	S	Bend	trans	-120.6	-177.9	-168	61.4	0	0	0	0	111.7	A15 Q16 T57 Y63 A64	A15-T61 WeakPolarHBondContact O-CB 3.45Å; Q16-T61 HydrophobicContact CB-CG2 4.31Å; Q16-T61 HydrophobicContact CG-CG2 3.84Å; T57-T61 HydrophobicContact CG2-CG2 4.36Å; T57-T61 WeakPolarHBondContact O-CB 3.31Å; T57-T61 WeakPolarHBondContact O-CG2 3.32Å; T57-T61 PolarHBondContact O-N 3.42Å; T57-T61 PolarHBondContact O-OG1 3Å; T61-Y63 PolarHBondContact O-N 3.24Å; T61-Y63 WeakPolarHBondContact OG1-CD2 3.16Å; T61-Y63 PolarHBondContact OG1-N 3.29Å; T61-A64 PolarHBondContact O-N 2.87Å
62	G	78.6	Confident	84	Confident	29 Å²	29	59.8 Å²	59.8	30%	0.299	33%	0.329	S	S	.	.	H	α-helix	trans	-58.1	-13.2	175.1	0	0	0	0	0	114.7	A15 A64 L65 S66	A15-G62 PolarHBondContact O-N 3.45Å; G62-A64 PolarHBondContact O-N 2.96Å; G62-L65 PolarHBondContact O-N 3.43Å; G62-S66 PolarHBondContact O-N 2.9Å
63	Y	84.3	Confident	84.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.7	-39.9	174.8	-64.7	-60.9	0	0	0	112.6	Y58 T61 L65 S66 I67 Y506 L507 G510 Y511 T514	Y58-Y63 HydrophobicContact CD1-CD1 4.42Å; Y58-Y63 AromaticContact CD1-CD2 3.67Å; Y58-Y63 HydrophobicContact CD1-CD2 3.67Å; Y58-Y63 HydrophobicContact CD1-CE2 4.48Å; Y58-Y63 AromaticContact CD1-CG 3.72Å; Y58-Y63 HydrophobicContact CD1-CG 3.72Å; Y58-Y63 HydrophobicContact CE1-CD1 4.48Å; Y58-Y63 HydrophobicContact CE1-CD2 4.15Å; Y58-Y63 HydrophobicContact CE1-CG 4.17Å; T61-Y63 PolarHBondContact O-N 3.24Å; T61-Y63 WeakPolarHBondContact OG1-CD2 3.16Å; T61-Y63 PolarHBondContact OG1-N 3.29Å; Y63-L65 VanDerWaalsContact C-N 3.32Å; Y63-L65 PolarHBondContact O-N 2.83Å; Y63-S66 WeakPolarHBondContact O-CB 3.31Å; Y63-S66 PolarHBondContact O-N 3.35Å; Y63-S66 VanDerWaalsContact O-N 3.14Å; Y63-I67 WeakPolarHBondContact O-CG1 3.48Å; Y63-I67 PolarHBondContact O-N 3.22Å; Y63-Y506 AromaticContact CD1-CD1 3.93Å; Y63-Y506 HydrophobicContact CD1-CD1 3.93Å; Y63-Y506 AromaticContact CD1-CE1 3.33Å; Y63-Y506 HydrophobicContact CD1-CE1 3.33Å; Y63-Y506 AromaticContact CD1-CZ 3.78Å; Y63-Y506 HydrophobicContact CE1-CD1 4.28Å; Y63-Y506 AromaticContact CE1-CE1 3.74Å; Y63-Y506 HydrophobicContact CE1-CE1 3.74Å; Y63-Y506 HydrophobicContact CE1-CE2 4.32Å; Y63-Y506 AromaticContact CE1-CZ 3.74Å; Y63-Y506 HydrophobicContact CG-CE1 4.43Å; Y63-L507 HydrophobicContact CD1-CD2 3.91Å; Y63-L507 HydrophobicContact CG-CD2 4.17Å; Y63-G510 PolarHBondContact OH-O 2.93Å; Y63-G510 VanDerWaalsContact OH-O 3.07Å; Y63-Y511 PolarHBondContact OH-N 3.44Å; Y63-T514 WeakPolarHBondContact OH-CG2 3.47Å; Y63-T514 PolarHBondContact OH-OG1 2.96Å
64	A	84.9	Confident	84.9	Confident	33 Å²	33	60 Å²	60	27%	0.273	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-43.5	177.9	0	0	0	0	0	111.8	Y58 T61 G62 S66 I67 V68	Y58-A64 WeakPolarHBondContact O-CB 3.39Å; Y58-A64 PolarHBondContact O-N 3.21Å; T61-A64 PolarHBondContact O-N 2.87Å; G62-A64 PolarHBondContact O-N 2.96Å; A64-S66 VanDerWaalsContact C-N 3.32Å; A64-S66 PolarHBondContact O-N 2.88Å; A64-I67 PolarHBondContact O-N 2.91Å; A64-V68 WeakPolarHBondContact O-CG2 3.4Å; A64-V68 PolarHBondContact O-N 2.88Å
65	L	84.8	Confident	85.3	Confident	121 Å²	121	61.9 Å²	61.9	63%	0.634	34%	0.335	S	S	*	.	H	α-helix	trans	-62.3	-41.2	176.8	-177	65	0	0	0	111.1	G62 Y63 V68 C69	G62-L65 PolarHBondContact O-N 3.43Å; Y63-L65 VanDerWaalsContact C-N 3.32Å; Y63-L65 PolarHBondContact O-N 2.83Å; L65-V68 PolarHBondContact O-N 3.4Å; L65-C69 VanDerWaalsContact O-CB 3.27Å; L65-C69 WeakPolarHBondContact O-CB 3.5Å; L65-C69 PolarHBondContact O-N 2.88Å; L65-C69 PolarHBondContact O-SG 3.41Å
66	S	84.7	Confident	85.5	Confident	35 Å²	35	61.8 Å²	61.8	25%	0.245	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-43.5	176.2	-174.6	0	0	0	0	112.3	G62 Y63 A64 S70 Y506	G62-S66 PolarHBondContact O-N 2.9Å; Y63-S66 WeakPolarHBondContact O-CB 3.31Å; Y63-S66 PolarHBondContact O-N 3.35Å; Y63-S66 VanDerWaalsContact O-N 3.14Å; A64-S66 VanDerWaalsContact C-N 3.32Å; A64-S66 PolarHBondContact O-N 2.88Å; S66-S70 WeakPolarHBondContact O-CB 3.13Å; S66-S70 PolarHBondContact O-N 2.79Å; S66-Y506 VanDerWaalsContact CB-CE1 3.42Å; S66-Y506 VanDerWaalsContact OG-CD1 3.26Å; S66-Y506 WeakPolarHBondContact OG-CD1 3.18Å; S66-Y506 WeakPolarHBondContact OG-CE1 3.42Å
67	I	87.4	Confident	85.8	Confident	54 Å²	54	60.4 Å²	60.4	28%	0.277	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-50.6	176.7	-66	165.7	0	0	0	110.6	Y63 A64 C69 S70 I71 L507	Y63-I67 WeakPolarHBondContact O-CG1 3.48Å; Y63-I67 PolarHBondContact O-N 3.22Å; A64-I67 PolarHBondContact O-N 2.91Å; I67-C69 PolarHBondContact O-N 3.24Å; I67-S70 PolarHBondContact O-N 3.27Å; I67-I71 HydrophobicContact CG2-CD1 3.74Å; I67-I71 HydrophobicContact CG2-CG1 4.48Å; I67-I71 VanDerWaalsContact O-CG1 3.31Å; I67-I71 WeakPolarHBondContact O-CG1 3.38Å; I67-I71 PolarHBondContact O-N 2.86Å; I67-L507 HydrophobicContact CD1-CD1 4.18Å; I67-L507 HydrophobicContact CD1-CD2 3.99Å; I67-L507 HydrophobicContact CG1-CD1 4.07Å; I67-L507 HydrophobicContact CG1-CD2 4.08Å
68	V	89.9	Confident	86.1	Confident	77 Å²	77	64.4 Å²	64.4	47%	0.467	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-47.9	-179.5	172.7	0	0	0	0	111	A64 L65 S70 I71 I72	A64-V68 WeakPolarHBondContact O-CG2 3.4Å; A64-V68 PolarHBondContact O-N 2.88Å; L65-V68 PolarHBondContact O-N 3.4Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-S70 PolarHBondContact O-N 3.44Å; V68-I71 PolarHBondContact O-N 3.09Å; V68-I72 HydrophobicContact CG1-CD1 3.7Å; V68-I72 HydrophobicContact CG1-CG1 4.44Å; V68-I72 VanDerWaalsContact O-CG1 3.28Å; V68-I72 WeakPolarHBondContact O-CG1 3.23Å; V68-I72 PolarHBondContact O-N 3.01Å
69	C	89	Confident	86.3	Confident	63 Å²	63	67.3 Å²	67.3	43%	0.426	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-41.5	177.5	-73.7	0	0	0	0	112	L65 I67 I72 W73	L65-C69 VanDerWaalsContact O-CB 3.27Å; L65-C69 WeakPolarHBondContact O-CB 3.5Å; L65-C69 PolarHBondContact O-N 2.88Å; L65-C69 PolarHBondContact O-SG 3.41Å; I67-C69 PolarHBondContact O-N 3.24Å; C69-I72 PolarHBondContact O-N 2.95Å; C69-W73 VanDerWaalsContact O-CB 3.29Å; C69-W73 WeakPolarHBondContact O-CB 3.38Å; C69-W73 PolarHBondContact O-N 3.4Å
70	S	89.5	Confident	86.4	Confident	12 Å²	12	65.7 Å²	65.7	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-63.3	-44.3	176.8	-180	0	0	0	0	112.2	S66 I67 V68 W73 T74 I499 C503	S66-S70 WeakPolarHBondContact O-CB 3.13Å; S66-S70 PolarHBondContact O-N 2.79Å; I67-S70 PolarHBondContact O-N 3.27Å; V68-S70 VanDerWaalsContact C-N 3.34Å; V68-S70 PolarHBondContact O-N 3.44Å; S70-W73 PolarHBondContact O-N 2.88Å; S70-T74 WeakPolarHBondContact O-CB 3.37Å; S70-T74 PolarHBondContact O-N 3.35Å; S70-T74 PolarHBondContact O-OG1 2.71Å; S70-I499 PolarHBondContact OG-O 3.49Å; S70-C503 WeakPolarHBondContact OG-CB 3.39Å
71	I	91.6	Very high	86.9	Confident	92 Å²	92	56.1 Å²	56.1	47%	0.472	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-47.7	177.4	-69.1	168.3	0	0	0	110.5	I67 V68 W73 T74 I75	I67-I71 HydrophobicContact CG2-CD1 3.74Å; I67-I71 HydrophobicContact CG2-CG1 4.48Å; I67-I71 VanDerWaalsContact O-CG1 3.31Å; I67-I71 WeakPolarHBondContact O-CG1 3.38Å; I67-I71 PolarHBondContact O-N 2.86Å; V68-I71 PolarHBondContact O-N 3.09Å; I71-W73 VanDerWaalsContact C-N 3.32Å; I71-W73 PolarHBondContact O-N 3.41Å; I71-T74 PolarHBondContact O-N 3.21Å; I71-I75 HydrophobicContact CG2-CD1 3.76Å; I71-I75 HydrophobicContact CG2-CG1 4.43Å; I71-I75 VanDerWaalsContact O-CG1 3.31Å; I71-I75 WeakPolarHBondContact O-CG1 3.16Å; I71-I75 PolarHBondContact O-N 3.44Å
72	I	92.5	Very high	87.1	Confident	90 Å²	90	61.8 Å²	61.8	46%	0.462	33%	0.333	S	S	.	.	H	α-helix	trans	-58.8	-46.5	177.4	-68.4	168.4	0	0	0	110.1	V68 C69 T74 I75 L76	V68-I72 HydrophobicContact CG1-CD1 3.7Å; V68-I72 HydrophobicContact CG1-CG1 4.44Å; V68-I72 VanDerWaalsContact O-CG1 3.28Å; V68-I72 WeakPolarHBondContact O-CG1 3.23Å; V68-I72 PolarHBondContact O-N 3.01Å; C69-I72 PolarHBondContact O-N 2.95Å; I72-T74 VanDerWaalsContact C-N 3.33Å; I72-T74 PolarHBondContact O-N 2.89Å; I72-I75 PolarHBondContact O-N 3.23Å; I72-L76 HydrophobicContact CG2-CD1 4.1Å; I72-L76 VanDerWaalsContact O-CG 3.32Å; I72-L76 WeakPolarHBondContact O-CG 3.28Å; I72-L76 PolarHBondContact O-N 2.97Å
73	W	91.2	Very high	87.2	Confident	86 Å²	86	63.2 Å²	63.2	33%	0.326	34%	0.338	S	S	.	.	H	α-helix	trans	-59.4	-45.2	177.9	-160.1	-57.9	0	0	0	111.6	C69 S70 I71 L76 L77 I499 F846	C69-W73 VanDerWaalsContact O-CB 3.29Å; C69-W73 WeakPolarHBondContact O-CB 3.38Å; C69-W73 PolarHBondContact O-N 3.4Å; S70-W73 PolarHBondContact O-N 2.88Å; I71-W73 VanDerWaalsContact C-N 3.32Å; I71-W73 PolarHBondContact O-N 3.41Å; W73-L76 PolarHBondContact O-N 3.48Å; W73-L77 VanDerWaalsContact CD1-CD1 3.48Å; W73-L77 WeakPolarHBondContact O-CG 3.24Å; W73-L77 PolarHBondContact O-N 3.17Å; W73-I499 HydrophobicContact CB-CG1 4.47Å; W73-I499 HydrophobicContact CG-CG1 4.47Å; W73-F846 AromaticContact CH2-CD2 3.56Å; W73-F846 HydrophobicContact CH2-CD2 3.56Å; W73-F846 HydrophobicContact CH2-CE2 4.1Å; W73-F846 HydrophobicContact CZ2-CD2 4.23Å; W73-F846 HydrophobicContact CZ3-CD2 4.42Å
74	T	90.6	Very high	86.8	Confident	17 Å²	17	64.1 Å²	64.1	10%	0.104	34%	0.343	C	S	.	.	H	α-helix	trans	-61.8	-46.4	178.8	-56.3	0	0	0	0	111.3	S70 I71 I72 L76 L77 I78 A496 I499 I500	S70-T74 WeakPolarHBondContact O-CB 3.37Å; S70-T74 PolarHBondContact O-N 3.35Å; S70-T74 PolarHBondContact O-OG1 2.71Å; I71-T74 PolarHBondContact O-N 3.21Å; I72-T74 VanDerWaalsContact C-N 3.33Å; I72-T74 PolarHBondContact O-N 2.89Å; T74-L76 VanDerWaalsContact C-N 3.33Å; T74-L76 PolarHBondContact O-N 3.5Å; T74-L77 PolarHBondContact O-N 3.49Å; T74-I78 HydrophobicContact CG2-CD1 3.95Å; T74-I78 WeakPolarHBondContact O-CG1 3.31Å; T74-I78 PolarHBondContact O-N 2.96Å; T74-A496 HydrophobicContact CG2-CB 4.26Å; T74-I499 VanDerWaalsContact OG1-CG2 3.3Å; T74-I499 WeakPolarHBondContact OG1-CG2 3.28Å; T74-I500 HydrophobicContact CG2-CD1 4.11Å; T74-I500 HydrophobicContact CG2-CG1 4.35Å
75	I	90.7	Very high	86.3	Confident	88 Å²	88	64.8 Å²	64.8	45%	0.451	35%	0.346	S	S	.	.	H	α-helix	trans	-59.4	-45.3	176.7	-68.8	166.8	0	0	0	110.3	I71 I72 L77 I78 I79	I71-I75 HydrophobicContact CG2-CD1 3.76Å; I71-I75 HydrophobicContact CG2-CG1 4.43Å; I71-I75 VanDerWaalsContact O-CG1 3.31Å; I71-I75 WeakPolarHBondContact O-CG1 3.16Å; I71-I75 PolarHBondContact O-N 3.44Å; I72-I75 PolarHBondContact O-N 3.23Å; I75-L77 VanDerWaalsContact C-N 3.35Å; I75-L77 PolarHBondContact O-N 2.92Å; I75-I78 PolarHBondContact O-N 3.15Å; I75-I79 HydrophobicContact CG2-CD1 3.63Å; I75-I79 HydrophobicContact CG2-CG1 4.3Å; I75-I79 WeakPolarHBondContact O-CB 3.3Å; I75-I79 VanDerWaalsContact O-CG1 3.24Å; I75-I79 WeakPolarHBondContact O-CG1 3.38Å; I75-I79 PolarHBondContact O-N 3.06Å
76	L	88.7	Confident	85.6	Confident	99 Å²	99	65 Å²	65	52%	0.518	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-44	176.8	-70.8	172.9	0	0	0	111.7	I72 W73 T74 I79 V80	I72-L76 HydrophobicContact CG2-CD1 4.1Å; I72-L76 VanDerWaalsContact O-CG 3.32Å; I72-L76 WeakPolarHBondContact O-CG 3.28Å; I72-L76 PolarHBondContact O-N 2.97Å; W73-L76 PolarHBondContact O-N 3.48Å; T74-L76 VanDerWaalsContact C-N 3.33Å; T74-L76 PolarHBondContact O-N 3.5Å; L76-I79 PolarHBondContact O-N 2.97Å; L76-V80 WeakPolarHBondContact O-CB 3.36Å; L76-V80 VanDerWaalsContact O-CG2 3.23Å; L76-V80 WeakPolarHBondContact O-CG2 3.21Å; L76-V80 PolarHBondContact O-N 3.44Å
77	L	87.6	Confident	84.6	Confident	10 Å²	10	67.7 Å²	67.7	5%	0.052	35%	0.347	C	S	.	.	H	α-helix	trans	-64.6	-40.2	177.3	-67.6	177.8	0	0	0	112.8	W73 T74 I75 V80 S81 F492 L495 A496 T845 T849	W73-L77 VanDerWaalsContact CD1-CD1 3.48Å; W73-L77 WeakPolarHBondContact O-CG 3.24Å; W73-L77 PolarHBondContact O-N 3.17Å; T74-L77 PolarHBondContact O-N 3.49Å; I75-L77 VanDerWaalsContact C-N 3.35Å; I75-L77 PolarHBondContact O-N 2.92Å; L77-V80 PolarHBondContact O-N 3.4Å; L77-S81 VanDerWaalsContact O-CB 3.28Å; L77-S81 WeakPolarHBondContact O-CB 3.32Å; L77-S81 PolarHBondContact O-N 3Å; L77-F492 HydrophobicContact CD2-CD1 3.89Å; L77-F492 HydrophobicContact CD2-CE1 4.43Å; L77-L495 HydrophobicContact CD1-CB 4.06Å; L77-A496 HydrophobicContact CB-CB 4.17Å; L77-A496 HydrophobicContact CD1-CB 4.25Å; L77-T845 HydrophobicContact CD1-CG2 4.45Å; L77-T849 HydrophobicContact CD1-CG2 4.11Å; L77-T849 HydrophobicContact CD2-CG2 3.42Å; L77-T849 VanDerWaalsContact CD2-CG2 3.42Å; L77-T849 HydrophobicContact CG-CG2 4.36Å
78	I	87.1	Confident	83.1	Confident	96 Å²	96	71 Å²	71	49%	0.492	36%	0.356	S	S	.	.	H	α-helix	trans	-65.6	-43.3	176.1	-67.5	168.9	0	0	0	110.5	T74 I75 V80 S81 Y82	T74-I78 HydrophobicContact CG2-CD1 3.95Å; T74-I78 WeakPolarHBondContact O-CG1 3.31Å; T74-I78 PolarHBondContact O-N 2.96Å; I75-I78 PolarHBondContact O-N 3.15Å; I78-V80 PolarHBondContact O-N 3.18Å; I78-S81 PolarHBondContact O-N 3.43Å; I78-Y82 WeakPolarHBondContact O-CB 3.5Å; I78-Y82 PolarHBondContact O-N 3.43Å
79	I	86.2	Confident	81.4	Confident	98 Å²	98	74.8 Å²	74.8	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-61.7	-44.7	176.5	-69.7	168.3	0	0	0	110.5	I75 L76 Y82 S83	I75-I79 HydrophobicContact CG2-CD1 3.63Å; I75-I79 HydrophobicContact CG2-CG1 4.3Å; I75-I79 WeakPolarHBondContact O-CB 3.3Å; I75-I79 VanDerWaalsContact O-CG1 3.24Å; I75-I79 WeakPolarHBondContact O-CG1 3.38Å; I75-I79 PolarHBondContact O-N 3.06Å; L76-I79 PolarHBondContact O-N 2.97Å; I79-Y82 PolarHBondContact O-N 3Å; I79-S83 WeakPolarHBondContact O-CB 3.41Å; I79-S83 PolarHBondContact O-N 2.84Å
80	V	83.9	Confident	79.4	Confident	48 Å²	48	80.2 Å²	80.2	29%	0.291	38%	0.377	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.4	171.8	0	0	0	0	110.8	L76 L77 I78 S83 T84 F492	L76-V80 WeakPolarHBondContact O-CB 3.36Å; L76-V80 VanDerWaalsContact O-CG2 3.23Å; L76-V80 WeakPolarHBondContact O-CG2 3.21Å; L76-V80 PolarHBondContact O-N 3.44Å; L77-V80 PolarHBondContact O-N 3.4Å; I78-V80 PolarHBondContact O-N 3.18Å; V80-S83 PolarHBondContact O-N 3.26Å; V80-T84 HydrophobicContact CG1-CG2 4.47Å; V80-T84 WeakPolarHBondContact O-CB 3.22Å; V80-T84 WeakPolarHBondContact O-CG2 3.36Å; V80-T84 PolarHBondContact O-N 2.68Å; V80-T84 PolarHBondContact O-OG1 3.43Å; V80-F492 HydrophobicContact CG1-CD2 3.88Å; V80-F492 HydrophobicContact CG1-CE1 4.18Å; V80-F492 HydrophobicContact CG1-CE2 3.47Å; V80-F492 VanDerWaalsContact CG1-CE2 3.47Å; V80-F492 HydrophobicContact CG1-CG 4.38Å; V80-F492 HydrophobicContact CG1-CZ 3.65Å
81	S	83.4	Confident	77.4	Confident	7 Å²	7	83.2 Å²	83.2	5%	0.049	39%	0.392	C	S	.	.	H	α-helix	trans	-61.5	-46.4	175	-174.2	0	0	0	0	111.9	L77 I78 S83 T84 C85 S489 C493	L77-S81 VanDerWaalsContact O-CB 3.28Å; L77-S81 WeakPolarHBondContact O-CB 3.32Å; L77-S81 PolarHBondContact O-N 3Å; I78-S81 PolarHBondContact O-N 3.43Å; S81-S83 PolarHBondContact O-N 3.41Å; S81-T84 WeakPolarHBondContact CA-OG1 3.24Å; S81-T84 PolarHBondContact O-N 2.79Å; S81-T84 PolarHBondContact O-OG1 3.48Å; S81-C85 VanDerWaalsContact O-CB 3.32Å; S81-C85 WeakPolarHBondContact O-CB 3.46Å; S81-C85 PolarHBondContact O-N 3.15Å; S81-S489 PolarHBondContact O-OG 2.93Å; S81-S489 PolarHBondContact OG-O 3.46Å; S81-S489 PolarHBondContact OG-OG 3.41Å; S81-C493 PolarHBondContact OG-SG 3.37Å; S81-C493 VanDerWaalsContact OG-SG 3.39Å
82	Y	83.7	Confident	74.9	Confident	143 Å²	143	84.8 Å²	84.8	56%	0.561	40%	0.395	S	S	*	.	H	α-helix	trans	-66	-40.6	177.3	-178.8	-107.4	0	0	0	112	I78 I79 C85 R86	I78-Y82 WeakPolarHBondContact O-CB 3.5Å; I78-Y82 PolarHBondContact O-N 3.43Å; I79-Y82 PolarHBondContact O-N 3Å; Y82-C85 CarbonylContact O-C 3.58Å; Y82-C85 PolarHBondContact O-N 3.15Å; Y82-R86 HydrophobicContact CE1-CB 4.42Å; Y82-R86 VanDerWaalsContact O-CB 3.24Å; Y82-R86 WeakPolarHBondContact O-CB 3.3Å; Y82-R86 PolarHBondContact O-N 3.31Å
83	S	80.4	Confident	72.4	Confident	58 Å²	58	88 Å²	88	41%	0.406	41%	0.405	S	S	.	.	H	α-helix	trans	-64.2	-46.1	177.6	-176.8	0	0	0	0	111.6	I79 V80 S81 C85 R86 Q87	I79-S83 WeakPolarHBondContact O-CB 3.41Å; I79-S83 PolarHBondContact O-N 2.84Å; V80-S83 PolarHBondContact O-N 3.26Å; S81-S83 PolarHBondContact O-N 3.41Å; S83-C85 VanDerWaalsContact C-N 3.29Å; S83-C85 PolarHBondContact O-N 3.2Å; S83-R86 PolarHBondContact O-N 3.5Å; S83-Q87 WeakPolarHBondContact O-CG 3.33Å; S83-Q87 PolarHBondContact O-N 3.13Å
84	T	74.9	Confident	69.8	Low	19 Å²	19	93.9 Å²	93.9	12%	0.117	43%	0.428	C	S	.	.	H	α-helix	trans	-62.3	-37.2	175.7	48.8	0	0	0	0	111.7	V80 S81 F492 L856	V80-T84 HydrophobicContact CG1-CG2 4.47Å; V80-T84 WeakPolarHBondContact O-CB 3.22Å; V80-T84 WeakPolarHBondContact O-CG2 3.36Å; V80-T84 PolarHBondContact O-N 2.68Å; V80-T84 PolarHBondContact O-OG1 3.43Å; S81-T84 WeakPolarHBondContact CA-OG1 3.24Å; S81-T84 PolarHBondContact O-N 2.79Å; S81-T84 PolarHBondContact O-OG1 3.48Å; T84-F492 HydrophobicContact CG2-CE2 4.46Å; T84-L856 HydrophobicContact CG2-CD1 4.23Å
85	C	74.5	Confident	67.2	Low	48 Å²	48	97 Å²	97	32%	0.324	45%	0.451	S	S	.	.	H	α-helix	trans	-70.7	-44.7	172.7	-171	0	0	0	0	112.8	S81 Y82 S83 Q87 R88	S81-C85 VanDerWaalsContact O-CB 3.32Å; S81-C85 WeakPolarHBondContact O-CB 3.46Å; S81-C85 PolarHBondContact O-N 3.15Å; Y82-C85 CarbonylContact O-C 3.58Å; Y82-C85 PolarHBondContact O-N 3.15Å; S83-C85 VanDerWaalsContact C-N 3.29Å; S83-C85 PolarHBondContact O-N 3.2Å; C85-Q87 VanDerWaalsContact C-N 3.32Å; C85-Q87 PolarHBondContact O-N 2.91Å; C85-R88 WeakPolarHBondContact O-CB 3.12Å; C85-R88 PolarHBondContact O-N 3.08Å
86	R	69.6	Low	64.5	Low	125 Å²	125	98.9 Å²	98.9	47%	0.472	46%	0.457	S	S	.	.	H	α-helix	trans	-67	-31.6	-177.1	-170	178.4	-176.8	179.5	4	112.5	Y82 S83 R88 K89 R90	Y82-R86 HydrophobicContact CE1-CB 4.42Å; Y82-R86 VanDerWaalsContact O-CB 3.24Å; Y82-R86 WeakPolarHBondContact O-CB 3.3Å; Y82-R86 PolarHBondContact O-N 3.31Å; S83-R86 PolarHBondContact O-N 3.5Å; R86-R88 PolarHBondContact O-N 3.34Å; R86-R88 VanDerWaalsContact O-N 3.13Å; R86-K89 PolarHBondContact O-N 3.03Å; R86-R90 PolarHBondContact O-N 3.01Å
87	Q	63.5	Low	61.7	Low	92 Å²	92	99.8 Å²	99.8	43%	0.43	47%	0.467	S	S	.	.	H	α-helix	trans	-58.4	-21.6	171.5	-76.1	-171.8	2.9	0	0	112.9	S83 C85	S83-Q87 WeakPolarHBondContact O-CG 3.33Å; S83-Q87 PolarHBondContact O-N 3.13Å; C85-Q87 VanDerWaalsContact C-N 3.32Å; C85-Q87 PolarHBondContact O-N 2.91Å
88	R	57.8	Low	59	Low	123 Å²	123	106.7 Å²	106.7	46%	0.464	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-47	168.4	-170.1	-175.5	173.6	-173.8	-0.9	112	C85 R86 K92	C85-R88 WeakPolarHBondContact O-CB 3.12Å; C85-R88 PolarHBondContact O-N 3.08Å; R86-R88 PolarHBondContact O-N 3.34Å; R86-R88 VanDerWaalsContact O-N 3.13Å; R88-K92 PolarHBondContact O-N 3.48Å
89	K	53.7	Low	56.3	Low	156 Å²	156	109.1 Å²	109.1	68%	0.678	52%	0.517	S	S	*	.	H	α-helix	trans	-70.8	-36.7	-174.4	-72.8	-170.6	178.5	-177.7	0	112.7	R86 I91 K92 K93	R86-K89 PolarHBondContact O-N 3.03Å; K89-I91 VanDerWaalsContact C-N 3.31Å; K89-I91 PolarHBondContact O-N 2.96Å; K89-K92 PolarHBondContact O-N 2.97Å; K89-K93 PolarHBondContact O-N 3.27Å
90	R	47.3	Very low	53.6	Low	178 Å²	178	115.3 Å²	115.3	67%	0.672	54%	0.535	S	S	*	.	H	α-helix	trans	-64.7	-33.9	179.4	-80.7	-168.6	-179.6	176.9	1.4	112.9	R86 R94	R86-R90 PolarHBondContact O-N 3.01Å; R90-R94 PolarHBondContact O-N 3.42Å
91	I	46.5	Very low	51.1	Low	74 Å²	74	122 Å²	122	38%	0.379	57%	0.568	S	S	.	*	H	α-helix	trans	-74.7	-41.4	177.8	-60.3	174	0	0	0	110.2	K89 R94 S95 L478	K89-I91 VanDerWaalsContact C-N 3.31Å; K89-I91 PolarHBondContact O-N 2.96Å; I91-R94 PolarHBondContact O-N 2.94Å; I91-S95 PolarHBondContact O-N 3.35Å; I91-L478 HydrophobicContact CG2-CD1 4.4Å
92	K	40.1	Very low	48.5	Very low	126 Å²	126	126 Å²	126	55%	0.548	60%	0.602	S	S	.	*	H	α-helix	trans	-66.4	-38.5	178.4	-142	-171.5	-177.8	-146.1	0	113.2	R88 K89 R94 S95 E96	R88-K92 PolarHBondContact O-N 3.48Å; K89-K92 PolarHBondContact O-N 2.97Å; K92-R94 VanDerWaalsContact C-N 3.29Å; K92-R94 PolarHBondContact O-N 2.87Å; K92-S95 PolarHBondContact O-N 3.43Å; K92-S95 PolarHBondContact O-OG 3.33Å; K92-E96 IonicContact NZ-OE1 2.78Å; K92-E96 PolarHBondContact O-N 3.02Å
93	K	38.3	Very low	46.5	Very low	156 Å²	156	125 Å²	125	68%	0.678	61%	0.613	S	S	*	*	H	α-helix	trans	-65.6	-31.2	173.8	-100.7	-169	173.3	-168.7	0	112.9	K89 S95 T97	K89-K93 PolarHBondContact O-N 3.27Å; K93-S95 VanDerWaalsContact C-N 3.3Å; K93-S95 PolarHBondContact O-N 2.73Å; K93-T97 PolarHBondContact O-N 3.28Å; K93-T97 PolarHBondContact O-OG1 3.22Å
94	R	36.7	Very low	44.2	Very low	210 Å²	210	129.2 Å²	129.2	79%	0.792	64%	0.637	S	S	*	*	H	α-helix	trans	-71.3	-24.4	175.9	-119	-176.7	-174.5	-178.8	0.6	113	R90 I91 K92	R90-R94 PolarHBondContact O-N 3.42Å; I91-R94 PolarHBondContact O-N 2.94Å; K92-R94 VanDerWaalsContact C-N 3.29Å; K92-R94 PolarHBondContact O-N 2.87Å
95	S	37.3	Very low	42.1	Very low	84 Å²	84	136.3 Å²	136.3	59%	0.587	67%	0.669	S	S	*	*	H	α-helix	trans	-85.1	-24.5	175.6	56.3	0	0	0	0	113.8	I91 K92 K93	I91-S95 PolarHBondContact O-N 3.35Å; K92-S95 PolarHBondContact O-N 3.43Å; K92-S95 PolarHBondContact O-OG 3.33Å; K93-S95 VanDerWaalsContact C-N 3.3Å; K93-S95 PolarHBondContact O-N 2.73Å
96	E	33.7	Very low	40	Very low	126 Å²	126	140.5 Å²	140.5	59%	0.589	69%	0.687	S	S	*	*	H	α-helix	trans	-92	-16.7	-176	-73.8	171.2	-169.3	0	0	114	K92 L98	K92-E96 IonicContact NZ-OE1 2.78Å; K92-E96 PolarHBondContact O-N 3.02Å; E96-L98 PolarHBondContact O-N 2.9Å
97	T	29.4	Very low	38.2	Very low	119 Å²	119	143.8 Å²	143.8	73%	0.73	71%	0.708	S	S	*	*	S	Bend	trans	-94.7	22.3	178.5	56.8	0	0	0	0	114.7	K93	K93-T97 PolarHBondContact O-N 3.28Å; K93-T97 PolarHBondContact O-OG1 3.22Å
98	L	31.3	Very low	36.5	Very low	154 Å²	154	145.2 Å²	145.2	81%	0.806	72%	0.723	S	S	*	*	S	Bend	trans	-119.5	35	178	-126.3	157	0	0	0	112	E96	E96-L98 PolarHBondContact O-N 2.9Å
99	L	29.3	Very low	35.2	Very low	148 Å²	148	144.7 Å²	144.7	78%	0.775	74%	0.739	S	S	*	*			trans	-135.3	62.9	177.3	-155.9	94.9	0	0	0	111.1
100	Y	29.9	Very low	33.9	Very low	228 Å²	228	147.6 Å²	147.6	89%	0.894	75%	0.745	S	S	*	*			trans	-160.4	85.4	158.1	-95.6	-75.9	0	0	0	107.5
101	L	31.7	Very low	33	Very low	187 Å²	187	146.4 Å²	146.4	98%	0.979	75%	0.747	S	S	*	*			trans	-171.8	66.8	156.5	-94.1	147.9	0	0	0	105.6
102	A	28.7	Very low	32.3	Very low	93 Å²	93	149.1 Å²	149.1	77%	0.769	77%	0.767	S	S	*	*			trans	-113.7	150.1	166.7	0	0	0	0	0	107.5
103	P	42	Very low	31.9	Very low	121 Å²	121	150.6 Å²	150.6	79%	0.786	78%	0.78	S	S	*	*	P	Polyproline II helix		-99.2	139.2	-126.9	34.8	-32.5	0	0	0	112.5
104	T	33.2	Very low	31.5	Very low	147 Å²	147	151.8 Å²	151.8	90%	0.902	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.7	127.3	160.7	47.4	0	0	0	0	109.4
105	E	29.2	Very low	31.4	Very low	168 Å²	168	148.5 Å²	148.5	79%	0.785	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-63.4	157.6	-169.3	-65.9	166.9	152.7	0	0	115.3
106	N	30.3	Very low	31.3	Very low	135 Å²	135	148 Å²	148	72%	0.722	79%	0.785	S	S	*	*			trans	58.8	101.7	146.9	-63.2	-20.4	0	0	0	117.7
107	H	31.8	Very low	31.2	Very low	194 Å²	194	149 Å²	149	90%	0.898	79%	0.793	S	S	*	*				-158.5	140.9	112.6	-97.6	-64.8	0	0	0	111.4
108	T	28	Very low	31.3	Very low	122 Å²	122	151.3 Å²	151.3	75%	0.748	80%	0.795	S	S	*	*			trans	-70.5	155.2	-174.8	29.3	0	0	0	0	113.5
109	S	30	Very low	31.7	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	79%	0.791	S	S	*	*			trans	91.1	116	153	76.3	0	0	0	0	119.6
110	R	26.6	Very low	31.9	Very low	217 Å²	217	152.2 Å²	152.2	82%	0.819	80%	0.797	S	S	*	*			trans	92	106.9	133.6	-120.1	179.1	173.9	149.8	2.2	120
111	E	29.3	Very low	32.3	Very low	153 Å²	153	150.4 Å²	150.4	72%	0.715	80%	0.797	S	S	*	*			trans	64.6	106.7	135.4	-75.6	171.5	153.4	0	0	120.5
112	T	30.6	Very low	32.8	Very low	130 Å²	130	146.2 Å²	146.2	80%	0.798	78%	0.783	S	S	*	*			trans	49.4	100.1	137.2	34.9	0	0	0	0	119.5
113	I	32.6	Very low	33.5	Very low	158 Å²	158	147.9 Å²	147.9	81%	0.81	79%	0.786	S	S	*	*			trans	-136.7	109.5	133	-59.3	-176.2	0	0	0	109	I115	I113-I115 HydrophobicContact CG2-CG1 4.11Å
114	E	29.9	Very low	33.6	Very low	181 Å²	181	151 Å²	151	85%	0.846	79%	0.787	S	S	*	*			trans	-68	114.1	168.3	-168.6	176.9	-159.5	0	0	109.1
115	I	35.3	Very low	34.4	Very low	140 Å²	140	147.5 Å²	147.5	72%	0.718	77%	0.769	S	S	*	*			trans	-122.4	82.8	159.5	-56.8	-179.6	0	0	0	106.8	I113 I117	I113-I115 HydrophobicContact CG2-CG1 4.11Å; I115-I117 HydrophobicContact CG2-CG1 4.06Å; I115-I117 PolarHBondContact O-N 2.92Å; I115-I117 VanDerWaalsContact O-N 3.12Å
116	A	33.5	Very low	35.4	Very low	73 Å²	73	145 Å²	145	60%	0.603	77%	0.766	S	S	*	*			trans	-67.9	97	168.7	0	0	0	0	0	109.8	H118	A116-H118 PolarHBondContact O-N 3.23Å
117	I	33.2	Very low	36.3	Very low	147 Å²	147	145.6 Å²	145.6	75%	0.754	76%	0.762	S	S	*	*			trans	-84.8	94.9	164.8	-59.4	178.9	0	0	0	107.3	I115 P119	I115-I117 HydrophobicContact CG2-CG1 4.06Å; I115-I117 PolarHBondContact O-N 2.92Å; I115-I117 VanDerWaalsContact O-N 3.12Å; I117-P119 WeakPolarHBondContact O-CD 3.3Å
118	H	31.1	Very low	37.1	Very low	169 Å²	169	142.9 Å²	142.9	78%	0.782	75%	0.745	S	S	*	*			trans	-61.4	119.6	169.6	-88.8	-62.4	0	0	0	111.2	A116 K120	A116-H118 PolarHBondContact O-N 3.23Å; H118-K120 PolarHBondContact O-N 3.48Å
119	P	39	Very low	38	Very low	110 Å²	110	146.2 Å²	146.2	71%	0.714	74%	0.744	S	S	*	*			trans	-78.2	111.5	171	29.5	-29.1	0	0	0	109.9	I117 H121	I117-P119 WeakPolarHBondContact O-CD 3.3Å; P119-H121 PolarHBondContact O-N 3.27Å; P119-H121 VanDerWaalsContact O-N 3.15Å
120	K	34.6	Very low	39	Very low	210 Å²	210	144.8 Å²	144.8	91%	0.913	73%	0.73	S	S	*	*			trans	-59.7	111.7	172.4	-81.4	178.2	174.9	175.2	0	110.6	H118 S122	H118-K120 PolarHBondContact O-N 3.48Å; K120-S122 PolarHBondContact O-N 3.39Å
121	H	37.7	Very low	39.9	Very low	190 Å²	190	140.6 Å²	140.6	88%	0.88	72%	0.715	S	S	*	*			trans	-65.7	114.4	165.1	-86.2	-68.8	0	0	0	110.3	P119	P119-H121 PolarHBondContact O-N 3.27Å; P119-H121 VanDerWaalsContact O-N 3.15Å
122	S	41.3	Very low	40.9	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-66.9	132.4	171.8	62.6	0	0	0	0	110.8	K120 K124	K120-S122 PolarHBondContact O-N 3.39Å; S122-K124 PolarHBondContact O-N 3.46Å
123	P	44.6	Very low	41.7	Very low	128 Å²	128	142.9 Å²	142.9	83%	0.831	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-68.2	117.9	179.5	26.9	-31.9	0	0	0	110.5	S125	P123-S125 PolarHBondContact O-N 3.28Å
124	K	44.7	Very low	42.3	Very low	185 Å²	185	141.7 Å²	141.7	80%	0.804	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-59	129.9	177.6	-70.2	176.3	176.6	176.4	0	110.1	S122	S122-K124 PolarHBondContact O-N 3.46Å
125	S	50.1	Low	43.1	Very low	75 Å²	75	137.3 Å²	137.3	52%	0.524	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-63.1	143.9	-173.8	82.6	0	0	0	0	112.4	P123 F127 Y128	P123-S125 PolarHBondContact O-N 3.28Å; S125-F127 PolarHBondContact O-N 2.91Å; S125-F127 VanDerWaalsContact O-N 3.13Å; S125-Y128 VanDerWaalsContact O-CB 3.28Å; S125-Y128 WeakPolarHBondContact O-CB 3.47Å; S125-Y128 PolarHBondContact O-N 3.04Å
126	T	49.6	Very low	43.8	Very low	116 Å²	116	135 Å²	135	71%	0.712	68%	0.678	S	S	*	*	H	α-helix	trans	-53	-31.2	178.5	42	0	0	0	0	113.1	Y128 R129 T130	T126-Y128 PolarHBondContact O-N 3.27Å; T126-R129 PolarHBondContact O-N 2.99Å; T126-R129 VanDerWaalsContact O-N 3.15Å; T126-T130 PolarHBondContact O-N 3.36Å; T126-T130 PolarHBondContact O-OG1 3.3Å
127	F	48.2	Very low	45	Very low	147 Å²	147	139.2 Å²	139.2	65%	0.645	68%	0.682	S	S	*	*	H	α-helix	trans	-56.2	-36.1	173	-171.7	-101	0	0	0	112.9	S125 R131	S125-F127 PolarHBondContact O-N 2.91Å; S125-F127 VanDerWaalsContact O-N 3.13Å; F127-R131 WeakPolarHBondContact O-CB 3.25Å; F127-R131 PolarHBondContact O-N 3.23Å
128	Y	49.5	Very low	46.2	Very low	136 Å²	136	142 Å²	142	53%	0.533	68%	0.683	S	S	.	*	H	α-helix	trans	-67.2	-42.6	177.9	-156.8	-83.9	0	0	0	111.6	S125 T126 E132	S125-Y128 VanDerWaalsContact O-CB 3.28Å; S125-Y128 WeakPolarHBondContact O-CB 3.47Å; S125-Y128 PolarHBondContact O-N 3.04Å; T126-Y128 PolarHBondContact O-N 3.27Å; Y128-E132 PolarHBondContact O-N 2.94Å
129	R	47	Very low	47.7	Very low	193 Å²	193	140.3 Å²	140.3	73%	0.728	68%	0.678	S	S	*	*	H	α-helix	trans	-70.7	-40	177.8	-90.5	-177.1	169.6	167.6	-2.9	112.8	T126 R131 E132 R133	T126-R129 PolarHBondContact O-N 2.99Å; T126-R129 VanDerWaalsContact O-N 3.15Å; R129-R131 VanDerWaalsContact C-N 3.29Å; R129-R131 PolarHBondContact O-N 2.91Å; R129-E132 PolarHBondContact O-N 3.44Å; R129-R133 PolarHBondContact O-N 3.44Å; R129-R133 VanDerWaalsContact O-N 3.07Å
130	T	50.3	Low	49	Very low	83 Å²	83	138.1 Å²	138.1	51%	0.509	67%	0.665	S	S	.	*	H	α-helix	trans	-65.8	-36.6	176.8	-43.1	0	0	0	0	111	T126 R133 L134	T126-T130 PolarHBondContact O-N 3.36Å; T126-T130 PolarHBondContact O-OG1 3.3Å; T130-R133 PolarHBondContact O-N 2.94Å; T130-L134 PolarHBondContact O-N 2.77Å
131	R	46.9	Very low	50.5	Low	129 Å²	129	131.2 Å²	131.2	49%	0.487	64%	0.638	S	S	.	*	H	α-helix	trans	-68.3	-34.3	173.7	-178.1	174	163.6	149.9	-3.3	113	F127 R129 R133 H861	F127-R131 WeakPolarHBondContact O-CB 3.25Å; F127-R131 PolarHBondContact O-N 3.23Å; R129-R131 VanDerWaalsContact C-N 3.29Å; R129-R131 PolarHBondContact O-N 2.91Å; R131-R133 VanDerWaalsContact C-N 3.33Å; R131-H861 PolarHBondContact NH2-CD2 3.28Å; R131-H861 VanDerWaalsContact NH2-CD2 3.27Å; R131-H861 PolarHBondContact NH2-NE2 2.91Å
132	E	49.4	Very low	52	Low	115 Å²	115	125.2 Å²	125.2	54%	0.537	62%	0.615	S	S	.	*	H	α-helix	trans	-67.2	-33.7	172.5	-138.9	173.9	-161	0	0	111.8	Y128 R129 Q135	Y128-E132 PolarHBondContact O-N 2.94Å; R129-E132 PolarHBondContact O-N 3.44Å; E132-Q135 WeakPolarHBondContact O-CB 3.46Å; E132-Q135 PolarHBondContact O-N 3.01Å
133	R	47.7	Very low	53.6	Low	216 Å²	216	125.5 Å²	125.5	82%	0.815	61%	0.607	S	S	*	*	H	α-helix	trans	-75.6	-33.4	176.6	-78.2	-176.7	179.4	164.6	-1.3	114.2	R129 T130 R131 Q135 S136	R129-R133 PolarHBondContact O-N 3.44Å; R129-R133 VanDerWaalsContact O-N 3.07Å; T130-R133 PolarHBondContact O-N 2.94Å; R131-R133 VanDerWaalsContact C-N 3.33Å; R133-Q135 PolarHBondContact O-N 3.42Å; R133-S136 PolarHBondContact O-N 3.35Å
134	L	44.7	Very low	55.1	Low	133 Å²	133	122.8 Å²	122.8	70%	0.696	58%	0.583	S	S	*	*	S	Bend	trans	-66	-13.3	172	-83.6	159.6	0	0	0	112.4	T130 S136	T130-L134 PolarHBondContact O-N 2.77Å; L134-S136 PolarHBondContact O-N 2.98Å
135	Q	47.2	Very low	56.5	Low	88 Å²	88	116.5 Å²	116.5	41%	0.411	56%	0.556	S	S	.	*			trans	-77.8	42	167.2	-60.6	178	-38.7	0	0	112.6	E132 R133 K137	E132-Q135 WeakPolarHBondContact O-CB 3.46Å; E132-Q135 PolarHBondContact O-N 3.01Å; R133-Q135 PolarHBondContact O-N 3.42Å; Q135-K137 WeakPolarHBondContact O-CA 3.24Å; Q135-K137 WeakPolarHBondContact O-CG 3.44Å; Q135-K137 PolarHBondContact O-N 2.83Å
136	S	48.7	Very low	57.9	Low	93 Å²	93	117.9 Å²	117.9	65%	0.65	56%	0.557	S	S	*	*			trans	-68.2	103	158.3	67.7	0	0	0	0	107.4	R133 L134 W138	R133-S136 PolarHBondContact O-N 3.35Å; L134-S136 PolarHBondContact O-N 2.98Å; S136-W138 PolarHBondContact O-N 3.45Å; S136-W138 VanDerWaalsContact O-N 3.14Å
137	K	59	Low	59.4	Low	160 Å²	160	116.4 Å²	116.4	70%	0.696	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn		-72.1	-17.2	-129.8	-65.8	-179.9	175.5	169.4	0	117.6	Q135 L141	Q135-K137 WeakPolarHBondContact O-CA 3.24Å; Q135-K137 WeakPolarHBondContact O-CG 3.44Å; Q135-K137 PolarHBondContact O-N 2.83Å; K137-L141 WeakPolarHBondContact O-CD1 3.22Å; K137-L141 WeakPolarHBondContact O-CG 3.17Å
138	W	58.3	Low	60.9	Low	207 Å²	207	109.6 Å²	109.6	78%	0.784	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-49.1	-162.3	-121	75.5	0	0	0	114.8	S136 C140 L141 V142	S136-W138 PolarHBondContact O-N 3.45Å; S136-W138 VanDerWaalsContact O-N 3.14Å; W138-C140 PolarHBondContact O-N 3.01Å; W138-L141 PolarHBondContact O-N 3.48Å; W138-V142 HydrophobicContact CD2-CG2 4.24Å; W138-V142 HydrophobicContact CE3-CG2 3.46Å; W138-V142 VanDerWaalsContact CE3-CG2 3.46Å; W138-V142 HydrophobicContact CZ3-CG2 3.65Å; W138-V142 VanDerWaalsContact O-CG2 3.27Å; W138-V142 WeakPolarHBondContact O-CG2 3.37Å; W138-V142 PolarHBondContact O-N 2.92Å
139	I	63.3	Low	62.5	Low	132 Å²	132	104.7 Å²	104.7	68%	0.677	50%	0.499	S	S	*	.	H	α-helix	trans	-64.1	-45.8	-173.2	-63.7	170.1	0	0	0	111.7	L141 V142 I143	I139-L141 VanDerWaalsContact C-N 3.33Å; I139-L141 PolarHBondContact O-N 3.47Å; I139-V142 PolarHBondContact O-N 3.39Å; I139-I143 HydrophobicContact CG2-CD1 3.81Å; I139-I143 HydrophobicContact CG2-CG1 4.44Å; I139-I143 VanDerWaalsContact O-CG1 3.3Å; I139-I143 WeakPolarHBondContact O-CG1 3.37Å; I139-I143 PolarHBondContact O-N 2.86Å
140	C	65.8	Low	64.3	Low	64 Å²	64	99.3 Å²	99.3	43%	0.432	48%	0.484	S	S	.	.	H	α-helix	trans	-64.3	-38.8	179.3	-170.8	0	0	0	0	111.9	W138 I143 Q144	W138-C140 PolarHBondContact O-N 3.01Å; C140-I143 PolarHBondContact O-N 3.35Å; C140-Q144 WeakPolarHBondContact O-CB 3.2Å; C140-Q144 VanDerWaalsContact O-CG 3.26Å; C140-Q144 WeakPolarHBondContact O-CG 3.11Å; C140-Q144 PolarHBondContact O-N 2.83Å
141	L	66.3	Low	66.1	Low	66 Å²	66	96.1 Å²	96.1	35%	0.346	46%	0.464	S	S	.	.	H	α-helix	trans	-67.4	-41.6	175.6	-72.6	-178.9	0	0	0	111.8	K137 W138 I139 Q144 F145	K137-L141 WeakPolarHBondContact O-CD1 3.22Å; K137-L141 WeakPolarHBondContact O-CG 3.17Å; W138-L141 PolarHBondContact O-N 3.48Å; I139-L141 VanDerWaalsContact C-N 3.33Å; I139-L141 PolarHBondContact O-N 3.47Å; L141-Q144 PolarHBondContact O-N 2.88Å; L141-F145 WeakPolarHBondContact O-CB 2.95Å; L141-F145 PolarHBondContact O-N 3.37Å
142	V	70	Confident	67.9	Low	64 Å²	64	90.5 Å²	90.5	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-44	175.2	170.6	0	0	0	0	110.8	W138 I139 F145 L146	W138-V142 HydrophobicContact CD2-CG2 4.24Å; W138-V142 HydrophobicContact CE3-CG2 3.46Å; W138-V142 VanDerWaalsContact CE3-CG2 3.46Å; W138-V142 HydrophobicContact CZ3-CG2 3.65Å; W138-V142 VanDerWaalsContact O-CG2 3.27Å; W138-V142 WeakPolarHBondContact O-CG2 3.37Å; W138-V142 PolarHBondContact O-N 2.92Å; I139-V142 PolarHBondContact O-N 3.39Å; V142-F145 PolarHBondContact O-N 2.81Å; V142-L146 VanDerWaalsContact O-CB 3.31Å; V142-L146 WeakPolarHBondContact O-CB 3.38Å; V142-L146 PolarHBondContact O-N 3.37Å
143	I	74.4	Confident	69.7	Low	105 Å²	105	90 Å²	90	54%	0.538	44%	0.443	S	S	.	.	H	α-helix	trans	-63	-44.8	176.9	-69	168.1	0	0	0	110.9	I139 C140 F145 L146 L147	I139-I143 HydrophobicContact CG2-CD1 3.81Å; I139-I143 HydrophobicContact CG2-CG1 4.44Å; I139-I143 VanDerWaalsContact O-CG1 3.3Å; I139-I143 WeakPolarHBondContact O-CG1 3.37Å; I139-I143 PolarHBondContact O-N 2.86Å; C140-I143 PolarHBondContact O-N 3.35Å; I143-F145 VanDerWaalsContact C-N 3.32Å; I143-F145 PolarHBondContact O-N 3.04Å; I143-L146 PolarHBondContact O-N 3.3Å; I143-L147 WeakPolarHBondContact O-CB 3.39Å; I143-L147 PolarHBondContact O-N 3.37Å
144	Q	75.5	Confident	71.7	Confident	71 Å²	71	82.7 Å²	82.7	33%	0.332	42%	0.42	S	S	.	.	H	α-helix	trans	-61.6	-41.4	176.5	-74.4	171.5	-2.9	0	0	111.7	C140 L141 L148	C140-Q144 WeakPolarHBondContact O-CB 3.2Å; C140-Q144 VanDerWaalsContact O-CG 3.26Å; C140-Q144 WeakPolarHBondContact O-CG 3.11Å; C140-Q144 PolarHBondContact O-N 2.83Å; L141-Q144 PolarHBondContact O-N 2.88Å; Q144-L148 VanDerWaalsContact O-CB 3.26Å; Q144-L148 WeakPolarHBondContact O-CB 3.24Å; Q144-L148 PolarHBondContact O-N 3.42Å
145	F	74.2	Confident	73.8	Confident	54 Å²	54	76.6 Å²	76.6	24%	0.237	39%	0.388	C	S	.	.	H	α-helix	trans	-66.4	-45.2	176.4	-179.9	-96.3	0	0	0	112.2	L141 V142 I143 L148 T149 I466 F471	L141-F145 WeakPolarHBondContact O-CB 2.95Å; L141-F145 PolarHBondContact O-N 3.37Å; V142-F145 PolarHBondContact O-N 2.81Å; I143-F145 VanDerWaalsContact C-N 3.32Å; I143-F145 PolarHBondContact O-N 3.04Å; F145-L148 PolarHBondContact O-N 2.86Å; F145-T149 WeakPolarHBondContact CE1-OG1 3.34Å; F145-T149 VanDerWaalsContact O-CB 3.32Å; F145-T149 WeakPolarHBondContact O-CB 3.44Å; F145-T149 PolarHBondContact O-N 2.98Å; F145-T149 PolarHBondContact O-OG1 3.35Å; F145-I466 HydrophobicContact CD2-CG2 3.93Å; F145-I466 HydrophobicContact CE2-CG2 3.89Å; F145-F471 HydrophobicContact CE1-CZ 4.39Å; F145-F471 AromaticContact CE2-CE2 3.74Å; F145-F471 HydrophobicContact CE2-CE2 3.74Å; F145-F471 HydrophobicContact CE2-CZ 4.17Å; F145-F471 AromaticContact CZ-CE2 3.82Å; F145-F471 HydrophobicContact CZ-CE2 3.82Å; F145-F471 AromaticContact CZ-CZ 3.98Å; F145-F471 HydrophobicContact CZ-CZ 3.98Å
146	L	79.7	Confident	75.7	Confident	103 Å²	103	73.3 Å²	73.3	54%	0.539	38%	0.378	S	S	.	.	H	α-helix	trans	-59.5	-48.3	176.9	-172.7	108.9	0	0	0	110.3	V142 I143 L148 T149 I150	V142-L146 VanDerWaalsContact O-CB 3.31Å; V142-L146 WeakPolarHBondContact O-CB 3.38Å; V142-L146 PolarHBondContact O-N 3.37Å; I143-L146 PolarHBondContact O-N 3.3Å; L146-L148 PolarHBondContact O-N 3.31Å; L146-T149 PolarHBondContact O-N 3.46Å; L146-I150 HydrophobicContact CD2-CD1 3.74Å; L146-I150 HydrophobicContact CG-CD1 3.91Å; L146-I150 WeakPolarHBondContact O-CB 3.46Å; L146-I150 VanDerWaalsContact O-CG1 3.24Å; L146-I150 WeakPolarHBondContact O-CG1 3.44Å; L146-I150 PolarHBondContact O-N 3.49Å
147	L	81.3	Confident	77.6	Confident	85 Å²	85	71.6 Å²	71.6	45%	0.445	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-46.8	177.2	-176.4	70	0	0	0	111.4	I143 T149 I150 L151	I143-L147 WeakPolarHBondContact O-CB 3.39Å; I143-L147 PolarHBondContact O-N 3.37Å; L147-T149 VanDerWaalsContact C-N 3.35Å; L147-T149 PolarHBondContact O-N 2.76Å; L147-I150 PolarHBondContact O-N 3.49Å; L147-L151 HydrophobicContact CG-CD1 4.19Å; L147-L151 WeakPolarHBondContact O-CB 3.06Å; L147-L151 VanDerWaalsContact O-CG 3.24Å; L147-L151 WeakPolarHBondContact O-CG 3.28Å; L147-L151 PolarHBondContact O-N 2.96Å
148	L	80.5	Confident	79	Confident	5 Å²	5	64 Å²	64	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-67.5	-36.4	-179.2	-159.8	72	0	0	0	112.1	Q144 F145 L146 T152 I466 I851 F854 L858	Q144-L148 VanDerWaalsContact O-CB 3.26Å; Q144-L148 WeakPolarHBondContact O-CB 3.24Å; Q144-L148 PolarHBondContact O-N 3.42Å; F145-L148 PolarHBondContact O-N 2.86Å; L146-L148 PolarHBondContact O-N 3.31Å; L148-T152 WeakPolarHBondContact O-CB 3.47Å; L148-T152 PolarHBondContact O-N 2.83Å; L148-T152 PolarHBondContact O-OG1 2.87Å; L148-I466 HydrophobicContact CD2-CB 4.33Å; L148-I466 HydrophobicContact CD2-CD1 3.16Å; L148-I466 HydrophobicContact CD2-CG1 3.47Å; L148-I466 VanDerWaalsContact CD2-CG1 3.47Å; L148-I466 HydrophobicContact CD2-CG2 3.88Å; L148-I466 HydrophobicContact CG-CD1 3.7Å; L148-I851 HydrophobicContact CD1-CG2 4.18Å; L148-F854 HydrophobicContact CD1-CB 4.01Å; L148-L858 HydrophobicContact CD2-CD1 4.18Å
149	T	81.8	Confident	80.5	Confident	33 Å²	33	54.1 Å²	54.1	20%	0.202	29%	0.293	C	S	.	.	H	α-helix	trans	-66.6	-46.4	175.2	-55.7	0	0	0	0	110.5	F145 L146 L147 L151 T152 I153 M463	F145-T149 WeakPolarHBondContact CE1-OG1 3.34Å; F145-T149 VanDerWaalsContact O-CB 3.32Å; F145-T149 WeakPolarHBondContact O-CB 3.44Å; F145-T149 PolarHBondContact O-N 2.98Å; F145-T149 PolarHBondContact O-OG1 3.35Å; L146-T149 PolarHBondContact O-N 3.46Å; L147-T149 VanDerWaalsContact C-N 3.35Å; L147-T149 PolarHBondContact O-N 2.76Å; T149-L151 PolarHBondContact O-N 2.81Å; T149-T152 PolarHBondContact O-N 3.37Å; T149-T152 VanDerWaalsContact O-N 3.17Å; T149-I153 HydrophobicContact CG2-CD1 4.12Å; T149-I153 WeakPolarHBondContact O-CG1 3.23Å; T149-I153 PolarHBondContact O-N 3.49Å; T149-M463 HydrophobicContact CG2-CE 4.38Å
150	I	86.3	Confident	81.8	Confident	79 Å²	79	53.1 Å²	53.1	41%	0.405	29%	0.288	S	S	.	.	H	α-helix	trans	-58.6	-48.9	174.9	-69.9	165.4	0	0	0	110.3	L146 L147 T152 I153 L154	L146-I150 HydrophobicContact CD2-CD1 3.74Å; L146-I150 HydrophobicContact CG-CD1 3.91Å; L146-I150 WeakPolarHBondContact O-CB 3.46Å; L146-I150 VanDerWaalsContact O-CG1 3.24Å; L146-I150 WeakPolarHBondContact O-CG1 3.44Å; L146-I150 PolarHBondContact O-N 3.49Å; L147-I150 PolarHBondContact O-N 3.49Å; I150-T152 VanDerWaalsContact C-N 3.26Å; I150-T152 PolarHBondContact O-N 2.82Å; I150-I153 PolarHBondContact O-N 3.42Å; I150-L154 HydrophobicContact CG2-CD1 4.05Å; I150-L154 HydrophobicContact CG2-CG 4.44Å; I150-L154 WeakPolarHBondContact O-CG 3.36Å; I150-L154 PolarHBondContact O-N 3.43Å
151	L	86.7	Confident	82.9	Confident	17 Å²	17	52.3 Å²	52.3	9%	0.089	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-41.2	177.2	-72.5	170.2	0	0	0	111.2	L147 T149 L154 L155 I847 I851 F854	L147-L151 HydrophobicContact CG-CD1 4.19Å; L147-L151 WeakPolarHBondContact O-CB 3.06Å; L147-L151 VanDerWaalsContact O-CG 3.24Å; L147-L151 WeakPolarHBondContact O-CG 3.28Å; L147-L151 PolarHBondContact O-N 2.96Å; T149-L151 PolarHBondContact O-N 2.81Å; L151-L154 WeakPolarHBondContact O-CB 3.45Å; L151-L154 PolarHBondContact O-N 3.26Å; L151-L155 WeakPolarHBondContact O-CB 3.04Å; L151-L155 PolarHBondContact O-N 2.87Å; L151-I847 HydrophobicContact CB-CG2 4.34Å; L151-I847 HydrophobicContact CD2-CD1 3.88Å; L151-I847 HydrophobicContact CD2-CG2 4.22Å; L151-I847 VanDerWaalsContact O-CG2 3.32Å; L151-I847 WeakPolarHBondContact O-CG2 3.5Å; L151-I851 HydrophobicContact CB-CD1 3.81Å; L151-I851 HydrophobicContact CB-CG1 3.52Å; L151-I851 HydrophobicContact CD1-CG1 4.2Å; L151-I851 HydrophobicContact CG-CG1 4.42Å; L151-I851 WeakPolarHBondContact O-CD1 3.26Å; L151-F854 HydrophobicContact CD1-CD2 4.35Å
152	T	85.3	Confident	84	Confident	11 Å²	11	49.1 Å²	49.1	7%	0.067	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-35.1	179.9	-48.7	0	0	0	0	112.4	L148 T149 I150 L155 G156 M463	L148-T152 WeakPolarHBondContact O-CB 3.47Å; L148-T152 PolarHBondContact O-N 2.83Å; L148-T152 PolarHBondContact O-OG1 2.87Å; T149-T152 PolarHBondContact O-N 3.37Å; T149-T152 VanDerWaalsContact O-N 3.17Å; I150-T152 VanDerWaalsContact C-N 3.26Å; I150-T152 PolarHBondContact O-N 2.82Å; T152-L155 PolarHBondContact O-N 3.22Å; T152-G156 PolarHBondContact O-N 3.15Å; T152-M463 VanDerWaalsContact CB-SD 3.51Å; T152-M463 HydrophobicContact CG2-CG 3.25Å; T152-M463 HydrophobicContact CG2-SD 3.5Å; T152-M463 WeakPolarHBondContact CG2-SD 3.15Å; T152-M463 PolarHBondContact OG1-SD 3.34Å
153	I	87.4	Confident	85	Confident	104 Å²	104	48.8 Å²	48.8	53%	0.533	26%	0.256	S	S	.	.	H	α-helix	trans	-61.2	-46.7	170.2	-68.4	166.1	0	0	0	109.7	T149 I150 L155 G156 T157	T149-I153 HydrophobicContact CG2-CD1 4.12Å; T149-I153 WeakPolarHBondContact O-CG1 3.23Å; T149-I153 PolarHBondContact O-N 3.49Å; I150-I153 PolarHBondContact O-N 3.42Å; I153-L155 VanDerWaalsContact C-N 3.3Å; I153-L155 PolarHBondContact O-N 2.85Å; I153-G156 PolarHBondContact O-N 2.91Å; I153-T157 HydrophobicContact CG2-CG2 4.48Å; I153-T157 WeakPolarHBondContact O-CG2 3.48Å; I153-T157 PolarHBondContact O-N 2.87Å; I153-T157 PolarHBondContact O-OG1 3.24Å
154	L	89.4	Confident	85.7	Confident	63 Å²	63	47.1 Å²	47.1	33%	0.33	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-37.2	176.8	-69.4	171.9	0	0	0	112.7	I150 L151 T157 A158 W843	I150-L154 HydrophobicContact CG2-CD1 4.05Å; I150-L154 HydrophobicContact CG2-CG 4.44Å; I150-L154 WeakPolarHBondContact O-CG 3.36Å; I150-L154 PolarHBondContact O-N 3.43Å; L151-L154 WeakPolarHBondContact O-CB 3.45Å; L151-L154 PolarHBondContact O-N 3.26Å; L154-T157 WeakPolarHBondContact CA-OG1 3.44Å; L154-T157 PolarHBondContact O-OG1 3.25Å; L154-A158 WeakPolarHBondContact O-CB 3.22Å; L154-A158 PolarHBondContact O-N 2.74Å; L154-A158 VanDerWaalsContact O-N 3.08Å; L154-W843 HydrophobicContact CD2-CZ2 4.37Å
155	L	88.9	Confident	86.3	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-69.4	-42.3	174.9	-171.5	54.8	0	0	0	110.9	L151 T152 I153 A158 V159 I455 T459 V844 I847 I851	L151-L155 WeakPolarHBondContact O-CB 3.04Å; L151-L155 PolarHBondContact O-N 2.87Å; T152-L155 PolarHBondContact O-N 3.22Å; I153-L155 VanDerWaalsContact C-N 3.3Å; I153-L155 PolarHBondContact O-N 2.85Å; L155-A158 PolarHBondContact O-N 2.94Å; L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.44Å; L155-V159 PolarHBondContact O-N 2.76Å; L155-I455 HydrophobicContact CD1-CG2 4.42Å; L155-T459 HydrophobicContact CB-CG2 4.19Å; L155-T459 HydrophobicContact CD2-CG2 3.29Å; L155-T459 HydrophobicContact CG-CG2 3.51Å; L155-V844 HydrophobicContact CD1-CB 4.2Å; L155-V844 HydrophobicContact CD1-CG1 3.9Å; L155-V844 HydrophobicContact CD1-CG2 4.23Å; L155-I847 HydrophobicContact CB-CG2 3.86Å; L155-I847 HydrophobicContact CD1-CG2 4.47Å; L155-I851 HydrophobicContact CB-CD1 3.9Å; L155-I851 HydrophobicContact CD2-CD1 3.62Å; L155-I851 HydrophobicContact CG-CD1 4.41Å
156	G	87.3	Confident	87.1	Confident	18 Å²	18	41.3 Å²	41.3	19%	0.186	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-44	175.9	0	0	0	0	0	112.6	T152 I153 V159 L160	T152-G156 PolarHBondContact O-N 3.15Å; I153-G156 PolarHBondContact O-N 2.91Å; G156-V159 PolarHBondContact O-N 2.83Å; G156-L160 WeakPolarHBondContact O-CG 3.35Å; G156-L160 PolarHBondContact O-N 2.94Å
157	T	88.8	Confident	87.6	Confident	57 Å²	57	37.8 Å²	37.8	35%	0.35	21%	0.213	S	C	.	.	H	α-helix	trans	-64.3	-42.1	175	55.5	0	0	0	0	111.5	I153 L154 V159 L160 L161	I153-T157 HydrophobicContact CG2-CG2 4.48Å; I153-T157 WeakPolarHBondContact O-CG2 3.48Å; I153-T157 PolarHBondContact O-N 2.87Å; I153-T157 PolarHBondContact O-OG1 3.24Å; L154-T157 WeakPolarHBondContact CA-OG1 3.44Å; L154-T157 PolarHBondContact O-OG1 3.25Å; T157-V159 VanDerWaalsContact C-N 3.31Å; T157-V159 PolarHBondContact O-N 2.75Å; T157-L160 PolarHBondContact O-N 2.94Å; T157-L161 WeakPolarHBondContact O-CB 3.28Å; T157-L161 WeakPolarHBondContact O-CD1 3.42Å; T157-L161 VanDerWaalsContact O-CG 3.24Å; T157-L161 WeakPolarHBondContact O-CG 3.48Å; T157-L161 PolarHBondContact O-N 3.22Å
158	A	88.6	Confident	88	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-36.1	176.5	0	0	0	0	0	112.6	L154 L155 L161 G162 W843 V844	L154-A158 WeakPolarHBondContact O-CB 3.22Å; L154-A158 PolarHBondContact O-N 2.74Å; L154-A158 VanDerWaalsContact O-N 3.08Å; L155-A158 PolarHBondContact O-N 2.94Å; A158-L161 PolarHBondContact O-N 2.87Å; A158-G162 PolarHBondContact O-N 3.28Å; A158-W843 HydrophobicContact CB-CD2 4.4Å; A158-W843 HydrophobicContact CB-CG 4.31Å; A158-V844 HydrophobicContact CB-CG2 3.61Å
159	V	89.7	Confident	88.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.2	-45.2	174.2	170.5	0	0	0	0	111.6	L155 G156 T157 L161 G162 F163 W452 I455 L456	L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.44Å; L155-V159 PolarHBondContact O-N 2.76Å; G156-V159 PolarHBondContact O-N 2.83Å; T157-V159 VanDerWaalsContact C-N 3.31Å; T157-V159 PolarHBondContact O-N 2.75Å; V159-L161 VanDerWaalsContact C-N 3.3Å; V159-L161 PolarHBondContact O-N 3.37Å; V159-G162 WeakPolarHBondContact O-CA 3.3Å; V159-G162 PolarHBondContact O-N 3.31Å; V159-G162 VanDerWaalsContact O-N 3.07Å; V159-F163 HydrophobicContact CG1-CD2 4.01Å; V159-F163 HydrophobicContact CG1-CE2 3.65Å; V159-F163 WeakPolarHBondContact O-CD2 3.39Å; V159-F163 PolarHBondContact O-N 3.45Å; V159-W452 HydrophobicContact CB-CE3 4.43Å; V159-W452 HydrophobicContact CG1-CB 4.44Å; V159-W452 HydrophobicContact CG1-CE3 4.37Å; V159-W452 HydrophobicContact CG2-CE3 4.23Å; V159-I455 HydrophobicContact CG2-CB 4.13Å; V159-I455 HydrophobicContact CG2-CG2 3.47Å; V159-I455 VanDerWaalsContact CG2-CG2 3.47Å; V159-L456 HydrophobicContact CG1-CB 4.16Å; V159-L456 HydrophobicContact CG1-CD1 4.28Å
160	L	89.2	Confident	88.9	Confident	112 Å²	112	37.7 Å²	37.7	59%	0.586	21%	0.208	S	C	*	.	H	α-helix	trans	-60.3	-41.9	175.3	-71.4	174.2	0	0	0	111.5	G156 T157 G162 F163 T164	G156-L160 WeakPolarHBondContact O-CG 3.35Å; G156-L160 PolarHBondContact O-N 2.94Å; T157-L160 PolarHBondContact O-N 2.94Å; L160-G162 VanDerWaalsContact C-N 3.32Å; L160-F163 WeakPolarHBondContact O-CB 3.18Å; L160-F163 PolarHBondContact O-N 2.89Å; L160-T164 PolarHBondContact O-N 2.93Å; L160-T164 VanDerWaalsContact O-N 3.11Å
161	L	89.8	Confident	89	Confident	46 Å²	46	37.6 Å²	37.6	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-38.6	172.9	-69.2	164.3	0	0	0	111.4	M1 I4 T157 A158 V159 F163 T164 V165 L840	M1-L161 HydrophobicContact SD-CD2 3.7Å; I4-L161 HydrophobicContact CD1-CD1 3.67Å; I4-L161 HydrophobicContact CD1-CD2 4.12Å; I4-L161 HydrophobicContact CD1-CG 4.36Å; T157-L161 WeakPolarHBondContact O-CB 3.28Å; T157-L161 WeakPolarHBondContact O-CD1 3.42Å; T157-L161 VanDerWaalsContact O-CG 3.24Å; T157-L161 WeakPolarHBondContact O-CG 3.48Å; T157-L161 PolarHBondContact O-N 3.22Å; A158-L161 PolarHBondContact O-N 2.87Å; V159-L161 VanDerWaalsContact C-N 3.3Å; V159-L161 PolarHBondContact O-N 3.37Å; L161-F163 VanDerWaalsContact C-N 3.32Å; L161-F163 PolarHBondContact O-N 3.36Å; L161-T164 WeakPolarHBondContact CA-OG1 3.36Å; L161-T164 PolarHBondContact O-N 3.45Å; L161-T164 VanDerWaalsContact O-N 3.1Å; L161-T164 PolarHBondContact O-OG1 2.96Å; L161-V165 WeakPolarHBondContact O-CG2 3.4Å; L161-V165 PolarHBondContact O-N 3.43Å; L161-L840 HydrophobicContact CB-CD1 4.17Å; L161-L840 HydrophobicContact CB-CD2 3.83Å; L161-L840 HydrophobicContact CD1-CD2 4.34Å
162	G	89.7	Confident	89.2	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-54.3	-47.2	172.4	0	0	0	0	0	112.4	A158 V159 L160 T164 V165 C166 W452	A158-G162 PolarHBondContact O-N 3.28Å; V159-G162 WeakPolarHBondContact O-CA 3.3Å; V159-G162 PolarHBondContact O-N 3.31Å; V159-G162 VanDerWaalsContact O-N 3.07Å; L160-G162 VanDerWaalsContact C-N 3.32Å; G162-T164 PolarHBondContact O-N 2.83Å; G162-V165 PolarHBondContact O-N 3.39Å; G162-C166 PolarHBondContact O-N 3.15Å; G162-C166 PolarHBondContact O-SG 2.89Å; G162-W452 VanDerWaalsContact CA-CE2 3.49Å; G162-W452 PolarHBondContact O-NE1 2.65Å
163	F	90.3	Very high	89.4	Confident	56 Å²	56	37.1 Å²	37.1	25%	0.246	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-44.4	173.5	-76.5	-70.1	0	0	0	112.4	V159 L160 L161 C166 G167 L449 W452	V159-F163 HydrophobicContact CG1-CD2 4.01Å; V159-F163 HydrophobicContact CG1-CE2 3.65Å; V159-F163 WeakPolarHBondContact O-CD2 3.39Å; V159-F163 PolarHBondContact O-N 3.45Å; L160-F163 WeakPolarHBondContact O-CB 3.18Å; L160-F163 PolarHBondContact O-N 2.89Å; L161-F163 VanDerWaalsContact C-N 3.32Å; L161-F163 PolarHBondContact O-N 3.36Å; F163-C166 PolarHBondContact O-N 3.26Å; F163-G167 PolarHBondContact O-N 2.99Å; F163-L449 HydrophobicContact CD1-CD2 3.4Å; F163-L449 HydrophobicContact CE1-CD2 3.52Å; F163-W452 HydrophobicContact CD1-CB 4.14Å; F163-W452 HydrophobicContact CD2-CB 4.14Å; F163-W452 HydrophobicContact CE1-CB 3.66Å; F163-W452 HydrophobicContact CE2-CB 3.68Å; F163-W452 HydrophobicContact CG-CB 4.35Å; F163-W452 HydrophobicContact CZ-CB 3.41Å; F163-W452 VanDerWaalsContact CZ-CB 3.41Å
164	T	88.8	Confident	89.4	Confident	71 Å²	71	34.3 Å²	34.3	44%	0.436	20%	0.196	S	C	.	.	H	α-helix	trans	-67.5	-37.6	-179.6	62.1	0	0	0	0	112.6	L160 L161 G162 G167 Q168	L160-T164 PolarHBondContact O-N 2.93Å; L160-T164 VanDerWaalsContact O-N 3.11Å; L161-T164 WeakPolarHBondContact CA-OG1 3.36Å; L161-T164 PolarHBondContact O-N 3.45Å; L161-T164 VanDerWaalsContact O-N 3.1Å; L161-T164 PolarHBondContact O-OG1 2.96Å; G162-T164 PolarHBondContact O-N 2.83Å; T164-G167 PolarHBondContact O-N 3.48Å; T164-Q168 VanDerWaalsContact O-CB 3.24Å; T164-Q168 WeakPolarHBondContact O-CB 3.13Å; T164-Q168 PolarHBondContact O-N 3.07Å
165	V	88.9	Confident	89.1	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.4	-40.6	176.1	-173.8	0	0	0	0	111.2	M1 L161 G162 Q168 F169 V833 F837 L840	M1-V165 HydrophobicContact CE-CB 4.4Å; M1-V165 HydrophobicContact CE-CG2 3.21Å; M1-V165 HydrophobicContact SD-CG2 4.08Å; L161-V165 WeakPolarHBondContact O-CG2 3.4Å; L161-V165 PolarHBondContact O-N 3.43Å; G162-V165 PolarHBondContact O-N 3.39Å; V165-Q168 PolarHBondContact O-N 2.95Å; V165-F169 WeakPolarHBondContact O-CB 3.43Å; V165-F169 PolarHBondContact O-N 2.95Å; V165-V833 HydrophobicContact CG1-CG1 3.64Å; V165-F837 HydrophobicContact CB-CE1 4.43Å; V165-F837 HydrophobicContact CG1-CD1 4.07Å; V165-F837 HydrophobicContact CG1-CD2 4.03Å; V165-F837 HydrophobicContact CG1-CE1 3.97Å; V165-F837 HydrophobicContact CG1-CE2 3.93Å; V165-F837 HydrophobicContact CG1-CG 4.1Å; V165-F837 HydrophobicContact CG1-CZ 3.9Å; V165-L840 HydrophobicContact CB-CD1 4.21Å; V165-L840 HydrophobicContact CG2-CD1 3.2Å
166	C	90.4	Very high	88.4	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-46.7	176.5	-62.9	0	0	0	0	111.5	G162 F163 F169 H170 L445 N448 W452 F837	G162-C166 PolarHBondContact O-N 3.15Å; G162-C166 PolarHBondContact O-SG 2.89Å; F163-C166 PolarHBondContact O-N 3.26Å; C166-F169 PolarHBondContact O-N 2.71Å; C166-H170 WeakPolarHBondContact O-CB 3.49Å; C166-H170 PolarHBondContact O-N 3.45Å; C166-L445 HydrophobicContact CB-CD1 3.82Å; C166-N448 HydrophobicContact CB-CB 4.32Å; C166-N448 WeakPolarHBondContact SG-CB 3.16Å; C166-W452 PolarHBondContact SG-NE1 2.87Å; C166-F837 VanDerWaalsContact SG-CE1 3.54Å
167	G	89.9	Confident	87.8	Confident	28 Å²	28	38.1 Å²	38.1	29%	0.289	22%	0.219	S	C	.	.	H	α-helix	trans	-59.3	-48.2	175	0	0	0	0	0	111.3	F163 T164 F169 H170 T171	F163-G167 PolarHBondContact O-N 2.99Å; T164-G167 PolarHBondContact O-N 3.48Å; G167-F169 PolarHBondContact O-N 3.01Å; G167-H170 PolarHBondContact O-N 3.29Å; G167-T171 WeakPolarHBondContact O-CB 3.36Å; G167-T171 PolarHBondContact O-N 3.07Å; G167-T171 PolarHBondContact O-OG1 3.3Å
168	Q	89.8	Confident	87.2	Confident	56 Å²	56	36.7 Å²	36.7	26%	0.262	21%	0.212	S	C	.	.	H	α-helix	trans	-60.8	-46.8	178.2	-174.7	177.8	4.3	0	0	111.9	Y5 T164 V165 H170 T171 N172	Y5-Q168 PolarHBondContact OH-OE1 3.32Å; T164-Q168 VanDerWaalsContact O-CB 3.24Å; T164-Q168 WeakPolarHBondContact O-CB 3.13Å; T164-Q168 PolarHBondContact O-N 3.07Å; V165-Q168 PolarHBondContact O-N 2.95Å; Q168-H170 VanDerWaalsContact C-N 3.32Å; Q168-H170 PolarHBondContact O-N 2.92Å; Q168-T171 PolarHBondContact O-N 3.26Å; Q168-N172 WeakPolarHBondContact O-CB 3.24Å; Q168-N172 PolarHBondContact O-N 3.12Å; Q168-N172 PolarHBondContact O-OD1 2.8Å; Q168-N172 VanDerWaalsContact O-OD1 3.12Å
169	F	89.6	Confident	86.1	Confident	24 Å²	24	43.3 Å²	43.3	11%	0.105	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-44.9	177.4	-171.4	-119.5	0	0	0	111.7	V165 C166 G167 N172 L173 F444 I830 V833 L834 F837	V165-F169 WeakPolarHBondContact O-CB 3.43Å; V165-F169 PolarHBondContact O-N 2.95Å; C166-F169 PolarHBondContact O-N 2.71Å; G167-F169 PolarHBondContact O-N 3.01Å; F169-N172 PolarHBondContact O-N 3.44Å; F169-L173 HydrophobicContact CD1-CD1 3.95Å; F169-L173 HydrophobicContact CD2-CD1 4.38Å; F169-L173 HydrophobicContact CE1-CD1 3.46Å; F169-L173 VanDerWaalsContact CE1-CD1 3.46Å; F169-L173 HydrophobicContact CE2-CD1 3.94Å; F169-L173 HydrophobicContact CE2-CG 4.37Å; F169-L173 HydrophobicContact CG-CD1 4.4Å; F169-L173 HydrophobicContact CZ-CD1 3.47Å; F169-L173 VanDerWaalsContact CZ-CD1 3.47Å; F169-L173 HydrophobicContact CZ-CG 4.36Å; F169-L173 WeakPolarHBondContact O-CG 3.38Å; F169-L173 PolarHBondContact O-N 3.43Å; F169-L173 VanDerWaalsContact O-N 3.17Å; F169-F444 AromaticContact CD1-CD1 3.86Å; F169-F444 HydrophobicContact CD1-CD1 3.86Å; F169-F444 AromaticContact CD1-CE1 3.83Å; F169-F444 HydrophobicContact CD1-CE1 3.83Å; F169-F444 AromaticContact CE1-CD1 3.94Å; F169-F444 HydrophobicContact CE1-CD1 3.94Å; F169-F444 AromaticContact CE1-CE1 3.95Å; F169-F444 HydrophobicContact CE1-CE1 3.95Å; F169-I830 HydrophobicContact CE2-CG2 4.39Å; F169-V833 HydrophobicContact CB-CG1 3.66Å; F169-V833 HydrophobicContact CD2-CB 4.05Å; F169-V833 HydrophobicContact CD2-CG1 3.78Å; F169-V833 HydrophobicContact CG-CG1 4.1Å; F169-L834 HydrophobicContact CE2-CD2 4.46Å; F169-L834 HydrophobicContact CZ-CD2 4.45Å; F169-F837 HydrophobicContact CB-CE2 3.82Å; F169-F837 HydrophobicContact CB-CZ 4.01Å; F169-F837 HydrophobicContact CD1-CE2 4.07Å; F169-F837 HydrophobicContact CD1-CZ 4.39Å; F169-F837 HydrophobicContact CD2-CE2 4.28Å; F169-F837 AromaticContact CG-CE2 3.8Å; F169-F837 HydrophobicContact CG-CE2 3.8Å; F169-F837 HydrophobicContact CG-CZ 4.31Å
170	H	91.4	Very high	85.2	Confident	41 Å²	41	46.5 Å²	46.5	19%	0.19	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-49.5	178.4	-177.8	72.5	0	0	0	111.5	C166 G167 Q168 N172 L173 V174 S441 L445	C166-H170 WeakPolarHBondContact O-CB 3.49Å; C166-H170 PolarHBondContact O-N 3.45Å; G167-H170 PolarHBondContact O-N 3.29Å; Q168-H170 VanDerWaalsContact C-N 3.32Å; Q168-H170 PolarHBondContact O-N 2.92Å; H170-N172 VanDerWaalsContact C-N 3.35Å; H170-N172 PolarHBondContact O-N 3.49Å; H170-L173 PolarHBondContact O-N 3.32Å; H170-L173 VanDerWaalsContact O-N 3.14Å; H170-V174 VanDerWaalsContact CE1-CG2 3.41Å; H170-V174 WeakPolarHBondContact CE1-CG2 3.38Å; H170-V174 WeakPolarHBondContact O-CB 3.31Å; H170-V174 WeakPolarHBondContact O-CG2 3.24Å; H170-V174 PolarHBondContact O-N 3.39Å; H170-S441 WeakPolarHBondContact CA-OG 3.31Å; H170-S441 PolarHBondContact ND1-O 2.94Å; H170-S441 PolarHBondContact ND1-OG 3.08Å; H170-L445 HydrophobicContact CB-CB 4.35Å; H170-L445 HydrophobicContact CB-CD1 4.33Å; H170-L445 HydrophobicContact CB-CD2 4.03Å; H170-L445 HydrophobicContact CB-CG 4.47Å
171	T	89.6	Confident	84.6	Confident	77 Å²	77	41.4 Å²	41.4	47%	0.472	23%	0.23	S	C	.	.	H	α-helix	trans	-59.9	-43.4	177.7	-57.4	0	0	0	0	111.8	G167 Q168 L173 V174 S175	G167-T171 WeakPolarHBondContact O-CB 3.36Å; G167-T171 PolarHBondContact O-N 3.07Å; G167-T171 PolarHBondContact O-OG1 3.3Å; Q168-T171 PolarHBondContact O-N 3.26Å; T171-L173 PolarHBondContact O-N 3.36Å; T171-V174 PolarHBondContact O-N 3.2Å; T171-S175 WeakPolarHBondContact O-CB 3.29Å; T171-S175 PolarHBondContact O-N 3.26Å
172	N	91.2	Very high	83.4	Confident	5 Å²	5	42 Å²	42	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-57.6	-37.4	176.9	-71.7	1	0	0	0	112.2	Q168 F169 H170 S175 T200 V202 G829	Q168-N172 WeakPolarHBondContact O-CB 3.24Å; Q168-N172 PolarHBondContact O-N 3.12Å; Q168-N172 PolarHBondContact O-OD1 2.8Å; Q168-N172 VanDerWaalsContact O-OD1 3.12Å; F169-N172 PolarHBondContact O-N 3.44Å; H170-N172 VanDerWaalsContact C-N 3.35Å; H170-N172 PolarHBondContact O-N 3.49Å; N172-S175 PolarHBondContact O-OG 2.74Å; N172-T200 WeakPolarHBondContact CB-O 3.45Å; N172-T200 VanDerWaalsContact CG-O 3.31Å; N172-T200 WeakPolarHBondContact OD1-CB 3.26Å; N172-V202 PolarHBondContact O-N 2.88Å; N172-G829 PolarHBondContact ND2-O 3.5Å
173	L	88.9	Confident	82.4	Confident	13 Å²	13	46.5 Å²	46.5	7%	0.068	26%	0.262	C	S	.	.	H	α-helix	trans	-87.2	-29.8	-178.2	-68.8	178.8	0	0	0	114.5	F169 H170 T171 V202 F203 V437 I830	F169-L173 HydrophobicContact CD1-CD1 3.95Å; F169-L173 HydrophobicContact CD2-CD1 4.38Å; F169-L173 HydrophobicContact CE1-CD1 3.46Å; F169-L173 VanDerWaalsContact CE1-CD1 3.46Å; F169-L173 HydrophobicContact CE2-CD1 3.94Å; F169-L173 HydrophobicContact CE2-CG 4.37Å; F169-L173 HydrophobicContact CG-CD1 4.4Å; F169-L173 HydrophobicContact CZ-CD1 3.47Å; F169-L173 VanDerWaalsContact CZ-CD1 3.47Å; F169-L173 HydrophobicContact CZ-CG 4.36Å; F169-L173 WeakPolarHBondContact O-CG 3.38Å; F169-L173 PolarHBondContact O-N 3.43Å; F169-L173 VanDerWaalsContact O-N 3.17Å; H170-L173 PolarHBondContact O-N 3.32Å; H170-L173 VanDerWaalsContact O-N 3.14Å; T171-L173 PolarHBondContact O-N 3.36Å; L173-V202 HydrophobicContact CD2-CB 4.34Å; L173-V202 HydrophobicContact CD2-CG2 3.98Å; L173-F203 VanDerWaalsContact O-CD2 3.26Å; L173-F203 WeakPolarHBondContact O-CD2 3.36Å; L173-F203 VanDerWaalsContact O-CE2 3.31Å; L173-F203 WeakPolarHBondContact O-CE2 3.44Å; L173-V437 HydrophobicContact CB-CG1 4.35Å; L173-V437 HydrophobicContact CD1-CG1 4.2Å; L173-V437 HydrophobicContact CD2-CG1 3.95Å; L173-V437 HydrophobicContact CG-CG1 4.42Å; L173-I830 HydrophobicContact CD2-CG1 4.48Å
174	V	87.4	Confident	81.5	Confident	46 Å²	46	44.2 Å²	44.2	28%	0.279	25%	0.254	S	S	.	.	H	α-helix	trans	-99.2	-9.6	-174.7	179.5	0	0	0	0	112.6	H170 T171 T176	H170-V174 VanDerWaalsContact CE1-CG2 3.41Å; H170-V174 WeakPolarHBondContact CE1-CG2 3.38Å; H170-V174 WeakPolarHBondContact O-CB 3.31Å; H170-V174 WeakPolarHBondContact O-CG2 3.24Å; H170-V174 PolarHBondContact O-N 3.39Å; T171-V174 PolarHBondContact O-N 3.2Å; V174-T176 PolarHBondContact O-N 2.84Å
175	S	83.1	Confident	81.1	Confident	16 Å²	16	46.1 Å²	46.1	11%	0.112	25%	0.253	C	S	.	.			trans	-43.9	116.2	173.6	54.6	0	0	0	0	111.3	T171 N172 H201	T171-S175 WeakPolarHBondContact O-CB 3.29Å; T171-S175 PolarHBondContact O-N 3.26Å; N172-S175 PolarHBondContact O-OG 2.74Å; S175-H201 VanDerWaalsContact OG-CB 3.31Å; S175-H201 WeakPolarHBondContact OG-CB 3.41Å
176	T	74.4	Confident	80.9	Confident	124 Å²	124	46.2 Å²	46.2	76%	0.761	25%	0.254	S	S	*	.			trans	-71.5	132.9	-177.7	49	0	0	0	0	108.9	V174	V174-T176 PolarHBondContact O-N 2.84Å
177	P	75.2	Confident	80.5	Confident	25 Å²	25	46.2 Å²	46.2	16%	0.162	25%	0.253	C	S	.	.			trans	-67.9	174.7	171.2	34.1	-37	0	0	0	110.3	E181 P204 L207	P177-E181 HydrophobicContact CB-CB 3.65Å; P177-E181 WeakPolarHBondContact CB-OE2 3.34Å; P177-E181 HydrophobicContact CG-CB 4.31Å; P177-P204 HydrophobicContact CB-CG 4.34Å; P177-L207 HydrophobicContact CB-CD1 3.86Å; P177-L207 HydrophobicContact CG-CD1 4.24Å
178	S	74.2	Confident	80.2	Confident	27 Å²	27	46.6 Å²	46.6	19%	0.189	25%	0.25	C	C	.	.			trans	-57.9	162.2	175.9	87	0	0	0	0	110.8	E180 E181 S182	S178-E180 WeakPolarHBondContact CB-OE2 3.39Å; S178-E180 PolarHBondContact O-N 3.45Å; S178-E180 PolarHBondContact OG-N 3.27Å; S178-E180 PolarHBondContact OG-OE2 3.26Å; S178-E181 PolarHBondContact N-OE2 2.86Å; S178-E181 PolarHBondContact O-N 3.28Å; S178-E181 WeakPolarHBondContact OG-CG 3.34Å; S178-E181 PolarHBondContact OG-N 3.13Å; S178-S182 WeakPolarHBondContact O-CB 3.48Å; S178-S182 PolarHBondContact O-N 3.4Å
179	H	66.2	Low	79.7	Confident	140 Å²	140	45.6 Å²	45.6	65%	0.648	25%	0.248	S	C	*	.	H	α-helix	trans	-54.4	-40.3	178.1	178.4	-85.4	0	0	0	111.3	S182 I183	H179-S182 PolarHBondContact O-N 2.85Å; H179-S182 PolarHBondContact O-OG 3.4Å; H179-I183 VanDerWaalsContact CE1-CD1 3.46Å; H179-I183 WeakPolarHBondContact CE1-CD1 3.33Å
180	E	71.8	Confident	79.3	Confident	67 Å²	67	49 Å²	49	31%	0.313	27%	0.272	S	S	.	.	H	α-helix	trans	-69.8	-44.2	-179.8	-51.6	100.8	166.9	0	0	112.6	S178 S182 I183 R185	S178-E180 WeakPolarHBondContact CB-OE2 3.39Å; S178-E180 PolarHBondContact O-N 3.45Å; S178-E180 PolarHBondContact OG-N 3.27Å; S178-E180 PolarHBondContact OG-OE2 3.26Å; E180-S182 VanDerWaalsContact C-N 3.26Å; E180-S182 PolarHBondContact O-N 3.25Å; E180-I183 PolarHBondContact O-N 3.34Å; E180-R185 CarbonylContact C-O 3.6Å; E180-R185 WeakPolarHBondContact O-CB 3.4Å; E180-R185 PolarHBondContact O-N 2.98Å; E180-R185 VanDerWaalsContact O-N 3.15Å
181	E	75.8	Confident	78.9	Confident	4 Å²	4	49 Å²	49	2%	0.019	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-34.5	176.5	-72.4	-179.5	146.1	0	0	112.1	P177 S178 I183 G184 R185 L187 L207 T430	P177-E181 HydrophobicContact CB-CB 3.65Å; P177-E181 WeakPolarHBondContact CB-OE2 3.34Å; P177-E181 HydrophobicContact CG-CB 4.31Å; S178-E181 PolarHBondContact N-OE2 2.86Å; S178-E181 PolarHBondContact O-N 3.28Å; S178-E181 WeakPolarHBondContact OG-CG 3.34Å; S178-E181 PolarHBondContact OG-N 3.13Å; E181-I183 PolarHBondContact O-N 2.91Å; E181-G184 WeakPolarHBondContact O-CA 3.45Å; E181-G184 PolarHBondContact O-N 3.28Å; E181-R185 VanDerWaalsContact CA-O 3.29Å; E181-R185 WeakPolarHBondContact CA-O 3.22Å; E181-R185 PolarHBondContact N-O 2.88Å; E181-L187 HydrophobicContact CG-CD1 4.34Å; E181-L187 HydrophobicContact CG-CD2 4.07Å; E181-L187 HydrophobicContact CG-CG 3.8Å; E181-L187 VanDerWaalsContact OE1-CD1 3.31Å; E181-L187 WeakPolarHBondContact OE1-CD1 3.29Å; E181-L207 HydrophobicContact CB-CD1 3.98Å; E181-L207 HydrophobicContact CG-CB 4.49Å; E181-T430 WeakPolarHBondContact O-CG2 3.04Å
182	S	64.6	Low	78.7	Confident	58 Å²	58	45.3 Å²	45.3	41%	0.406	25%	0.249	S	C	.	.	H	α-helix	trans	-64.8	-25.1	178.2	79.7	0	0	0	0	113.6	S178 H179 E180 G184 T430	S178-S182 WeakPolarHBondContact O-CB 3.48Å; S178-S182 PolarHBondContact O-N 3.4Å; H179-S182 PolarHBondContact O-N 2.85Å; H179-S182 PolarHBondContact O-OG 3.4Å; E180-S182 VanDerWaalsContact C-N 3.26Å; E180-S182 PolarHBondContact O-N 3.25Å; S182-G184 VanDerWaalsContact C-N 3.29Å; S182-T430 VanDerWaalsContact O-CG2 3.23Å; S182-T430 WeakPolarHBondContact O-CG2 3.38Å
183	I	68.2	Low	78.2	Confident	96 Å²	96	52.6 Å²	52.6	49%	0.492	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.2	175.5	-60.7	166.8	0	0	0	111.1	H179 E180 E181 R431	H179-I183 VanDerWaalsContact CE1-CD1 3.46Å; H179-I183 WeakPolarHBondContact CE1-CD1 3.33Å; E180-I183 PolarHBondContact O-N 3.34Å; E181-I183 PolarHBondContact O-N 2.91Å; I183-R431 PolarHBondContact O-NH2 3.3Å
184	G	70.9	Confident	77.9	Confident	8 Å²	8	60 Å²	60	8%	0.082	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	97	6.4	-175.9	0	0	0	0	0	113.7	E181 S182 S426	E181-G184 WeakPolarHBondContact O-CA 3.45Å; E181-G184 PolarHBondContact O-N 3.28Å; S182-G184 VanDerWaalsContact C-N 3.29Å; G184-S426 PolarHBondContact O-OG 2.78Å
185	R	80.4	Confident	77.7	Confident	110 Å²	110	59.9 Å²	59.9	42%	0.415	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-86.1	120.2	175.7	-169.5	-170.9	79.5	127.2	2.9	109.1	E180 E181 E191	E180-R185 CarbonylContact C-O 3.6Å; E180-R185 WeakPolarHBondContact O-CB 3.4Å; E180-R185 PolarHBondContact O-N 2.98Å; E180-R185 VanDerWaalsContact O-N 3.15Å; E181-R185 VanDerWaalsContact CA-O 3.29Å; E181-R185 WeakPolarHBondContact CA-O 3.22Å; E181-R185 PolarHBondContact N-O 2.88Å; R185-E191 IonicContact CZ-OE1 2.84Å; R185-E191 IonicContact CZ-OE2 2.67Å; R185-E191 IonicContact NH1-OE1 3.53Å; R185-E191 IonicContact NH2-OE1 2.74Å; R185-E191 PolarHBondContact NH2-OE1 3.07Å; R185-E191 IonicContact NH2-OE2 3.21Å; R185-E191 PolarHBondContact NH2-OE2 2.91Å
186	L	85.3	Confident	77.8	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-68.1	144.7	172.6	-69.7	174.1	0	0	0	110.9	L207 L210 A211 R214 I422 S426	L186-L207 HydrophobicContact CD2-CB 4.39Å; L186-L207 HydrophobicContact CD2-CD2 4.21Å; L186-L207 WeakPolarHBondContact CD2-O 3.46Å; L186-L210 HydrophobicContact CD1-CB 4.14Å; L186-L210 HydrophobicContact CD2-CB 4.02Å; L186-A211 HydrophobicContact CB-CB 4.05Å; L186-A211 HydrophobicContact CD2-CB 4.16Å; L186-R214 HydrophobicContact CD1-CB 4.31Å; L186-I422 HydrophobicContact CD1-CG2 3.62Å; L186-S426 WeakPolarHBondContact CD2-OG 3.41Å; L186-S426 WeakPolarHBondContact CG-OG 3.22Å
187	L	82.9	Confident	78.3	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-59.1	142	179.1	-64.8	173.2	0	0	0	111.1	E181 E191 L192 T195 A211	E181-L187 HydrophobicContact CG-CD1 4.34Å; E181-L187 HydrophobicContact CG-CD2 4.07Å; E181-L187 HydrophobicContact CG-CG 3.8Å; E181-L187 VanDerWaalsContact OE1-CD1 3.31Å; E181-L187 WeakPolarHBondContact OE1-CD1 3.29Å; L187-E191 WeakPolarHBondContact CA-OE2 3.38Å; L187-E191 HydrophobicContact CB-CB 4.14Å; L187-E191 HydrophobicContact CD2-CB 4.03Å; L187-L192 HydrophobicContact CB-CG 3.95Å; L187-T195 HydrophobicContact CD1-CG2 4.15Å; L187-A211 HydrophobicContact CB-CB 4.3Å
188	T	82.4	Confident	78.8	Confident	36 Å²	36	64.8 Å²	64.8	22%	0.221	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-73.2	161.1	171.4	64.3	0	0	0	0	110.8	T190 E191 L192	T188-T190 PolarHBondContact O-N 3.03Å; T188-T190 VanDerWaalsContact O-N 3.14Å; T188-T190 PolarHBondContact OG1-OG1 3.22Å; T188-T190 VanDerWaalsContact OG1-OG1 3.12Å; T188-E191 PolarHBondContact N-OE2 3.5Å; T188-E191 PolarHBondContact O-N 3.48Å; T188-E191 VanDerWaalsContact O-N 3.1Å; T188-E191 VanDerWaalsContact OG1-CG 3.24Å; T188-E191 WeakPolarHBondContact OG1-CG 2.93Å; T188-E191 PolarHBondContact OG1-OE1 3.24Å; T188-E191 VanDerWaalsContact OG1-OE1 3.11Å; T188-E191 PolarHBondContact OG1-OE2 3.39Å; T188-L192 WeakPolarHBondContact O-CB 3.37Å; T188-L192 PolarHBondContact O-N 2.87Å
189	P	80.1	Confident	79.3	Confident	35 Å²	35	68.5 Å²	68.5	23%	0.227	35%	0.347	C	S	.	.	H	α-helix	trans	-53.4	-34.2	178.9	-29.4	36.3	0	0	0	114.5	A215 E219	P189-A215 HydrophobicContact CG-CB 4Å; P189-E219 WeakPolarHBondContact CB-OE1 3.33Å; P189-E219 WeakPolarHBondContact CG-OE1 3.4Å
190	T	81.7	Confident	80.2	Confident	97 Å²	97	63.2 Å²	63.2	60%	0.595	33%	0.325	S	S	*	.	H	α-helix	trans	-73.9	-41	177.7	48.6	0	0	0	0	112.1	T188 L192 M193	T188-T190 PolarHBondContact O-N 3.03Å; T188-T190 VanDerWaalsContact O-N 3.14Å; T188-T190 PolarHBondContact OG1-OG1 3.22Å; T188-T190 VanDerWaalsContact OG1-OG1 3.12Å; T190-L192 VanDerWaalsContact C-N 3.33Å; T190-M193 PolarHBondContact O-N 2.82Å
191	E	83.3	Confident	81	Confident	39 Å²	39	61.8 Å²	61.8	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-33.6	176.3	-67.4	158.9	-162	0	0	112.3	R185 L187 T188 M193 Q194 T195	R185-E191 IonicContact CZ-OE1 2.84Å; R185-E191 IonicContact CZ-OE2 2.67Å; R185-E191 IonicContact NH1-OE1 3.53Å; R185-E191 IonicContact NH2-OE1 2.74Å; R185-E191 PolarHBondContact NH2-OE1 3.07Å; R185-E191 IonicContact NH2-OE2 3.21Å; R185-E191 PolarHBondContact NH2-OE2 2.91Å; L187-E191 WeakPolarHBondContact CA-OE2 3.38Å; L187-E191 HydrophobicContact CB-CB 4.14Å; L187-E191 HydrophobicContact CD2-CB 4.03Å; T188-E191 PolarHBondContact N-OE2 3.5Å; T188-E191 PolarHBondContact O-N 3.48Å; T188-E191 VanDerWaalsContact O-N 3.1Å; T188-E191 VanDerWaalsContact OG1-CG 3.24Å; T188-E191 WeakPolarHBondContact OG1-CG 2.93Å; T188-E191 PolarHBondContact OG1-OE1 3.24Å; T188-E191 VanDerWaalsContact OG1-OE1 3.11Å; T188-E191 PolarHBondContact OG1-OE2 3.39Å; E191-M193 PolarHBondContact O-N 2.88Å; E191-Q194 PolarHBondContact O-N 3.38Å; E191-Q194 VanDerWaalsContact O-N 3.12Å; E191-T195 WeakPolarHBondContact O-CB 3.37Å; E191-T195 PolarHBondContact O-N 2.88Å; E191-T195 PolarHBondContact O-OG1 2.89Å
192	L	84.6	Confident	81.7	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-58.7	-32.3	174.3	-91.2	154.8	0	0	0	113	L187 T188 T190 T195 R208 A211 Q212 A215	L187-L192 HydrophobicContact CB-CG 3.95Å; T188-L192 WeakPolarHBondContact O-CB 3.37Å; T188-L192 PolarHBondContact O-N 2.87Å; T190-L192 VanDerWaalsContact C-N 3.33Å; L192-T195 VanDerWaalsContact O-O 3.1Å; L192-R208 HydrophobicContact CD2-CG 3.71Å; L192-R208 PolarHBondContact O-NH1 2.8Å; L192-R208 PolarHBondContact O-NH2 2.91Å; L192-A211 HydrophobicContact CD1-CB 3.92Å; L192-A211 HydrophobicContact CD2-CB 4.08Å; L192-A211 HydrophobicContact CG-CB 4.26Å; L192-Q212 HydrophobicContact CD2-CG 3.97Å; L192-A215 HydrophobicContact CD1-CB 4.26Å
193	M	80.1	Confident	82.9	Confident	157 Å²	157	59.5 Å²	59.5	77%	0.773	30%	0.301	S	S	*	.	H	α-helix	trans	-74.9	-28.7	177.1	-66.7	-173.5	177.1	0	0	112.6	T190 E191	T190-M193 PolarHBondContact O-N 2.82Å; E191-M193 PolarHBondContact O-N 2.88Å
194	Q	83.1	Confident	83.9	Confident	169 Å²	169	55.1 Å²	55.1	79%	0.79	28%	0.279	S	S	*	.	H	α-helix	trans	-90.5	-32.4	-177.6	-64.2	-179.3	-2.9	0	0	112.6	E191	E191-Q194 PolarHBondContact O-N 3.38Å; E191-Q194 VanDerWaalsContact O-N 3.12Å
195	T	82.4	Confident	84.8	Confident	43 Å²	43	55.4 Å²	55.4	26%	0.264	28%	0.278	S	S	.	.			trans	-88.8	129.8	-179.3	-44.5	0	0	0	0	108.5	L187 E191 L192 R208	L187-T195 HydrophobicContact CD1-CG2 4.15Å; E191-T195 WeakPolarHBondContact O-CB 3.37Å; E191-T195 PolarHBondContact O-N 2.88Å; E191-T195 PolarHBondContact O-OG1 2.89Å; L192-T195 VanDerWaalsContact O-O 3.1Å; T195-R208 PolarHBondContact O-NH1 2.87Å
196	N	85.4	Confident	85.3	Confident	116 Å²	116	51.6 Å²	51.6	62%	0.62	27%	0.265	S	S	*	.			trans	-145.2	85.2	171.6	-171.8	14.1	0	0	0	109.4	R205	N196-R205 PolarHBondContact OD1-NH1 2.63Å; N196-R205 PolarHBondContact OD1-NH2 3.36Å
197	P	85.3	Confident	85.6	Confident	25 Å²	25	51.5 Å²	51.5	16%	0.162	27%	0.265	C	S	.	.			trans	-63.7	163.9	-178.7	27.1	-32.7	0	0	0	110.9	P204 R205	P197-P204 HydrophobicContact CB-CB 3.74Å; P197-P204 HydrophobicContact CG-CB 3.93Å; P197-R205 HydrophobicContact CG-CG 4.24Å; P197-R205 PolarHBondContact O-NE 2.88Å; P197-R205 PolarHBondContact O-NH2 2.91Å
198	E	85.9	Confident	86	Confident	127 Å²	127	52.8 Å²	52.8	59%	0.593	27%	0.269	S	S	*	.			trans	-62.2	148.6	175.9	-66.9	-171.2	177.8	0	0	112	T200 H201 R205	E198-T200 PolarHBondContact O-N 3.26Å; E198-T200 VanDerWaalsContact O-N 3.09Å; E198-H201 PolarHBondContact O-N 3.09Å; E198-H201 VanDerWaalsContact O-N 3.16Å; E198-H201 IonicContact OE2-NE2 3.61Å; E198-R205 WeakPolarHBondContact O-CG 3.46Å; E198-R205 PolarHBondContact O-NE 3.41Å; E198-R205 VanDerWaalsContact O-NE 3.15Å
199	K	83.9	Confident	86.4	Confident	106 Å²	106	51 Å²	51	46%	0.461	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.9	-179.1	-67.4	-166.7	-178.6	-164.2	0	113.4	E820 G824	K199-E820 IonicContact NZ-OE1 3.94Å; K199-E820 PolarHBondContact NZ-OE1 3.45Å; K199-G824 CarbonylContact O-C 3.38Å
200	T	85.2	Confident	87	Confident	29 Å²	29	50.3 Å²	50.3	18%	0.178	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-16.1	-179.6	46.2	0	0	0	0	113.7	N172 E198 V202 G829	N172-T200 WeakPolarHBondContact CB-O 3.45Å; N172-T200 VanDerWaalsContact CG-O 3.31Å; N172-T200 WeakPolarHBondContact OD1-CB 3.26Å; E198-T200 PolarHBondContact O-N 3.26Å; E198-T200 VanDerWaalsContact O-N 3.09Å; T200-V202 PolarHBondContact O-N 3.49Å; T200-G829 VanDerWaalsContact O-CA 3.29Å; T200-G829 WeakPolarHBondContact O-CA 3.48Å
201	H	89.9	Confident	87.5	Confident	36 Å²	36	45.7 Å²	45.7	17%	0.167	22%	0.224	C	C	.	.			trans	-77.7	111	-178.5	-71.5	-176.3	0	0	0	111	S175 E198 P204 R205	S175-H201 VanDerWaalsContact OG-CB 3.31Å; S175-H201 WeakPolarHBondContact OG-CB 3.41Å; E198-H201 PolarHBondContact O-N 3.09Å; E198-H201 VanDerWaalsContact O-N 3.16Å; E198-H201 IonicContact OE2-NE2 3.61Å; H201-P204 HydrophobicContact CB-CB 4.38Å; H201-P204 HydrophobicContact CB-CG 4.08Å; H201-R205 WeakPolarHBondContact O-CB 3.47Å; H201-R205 WeakPolarHBondContact O-CG 3.26Å; H201-R205 PolarHBondContact O-N 3.43Å
202	V	89.5	Confident	88	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.024	22%	0.219	C	C	.	.	H	α-helix	trans	-67.8	-59.8	-165.8	177	0	0	0	0	112	N172 L173 T200 R205 I206 I830	N172-V202 PolarHBondContact O-N 2.88Å; L173-V202 HydrophobicContact CD2-CB 4.34Å; L173-V202 HydrophobicContact CD2-CG2 3.98Å; T200-V202 PolarHBondContact O-N 3.49Å; V202-R205 PolarHBondContact O-N 2.95Å; V202-I206 HydrophobicContact CG1-CD1 3.69Å; V202-I206 VanDerWaalsContact O-CG1 3.24Å; V202-I206 WeakPolarHBondContact O-CG1 3.39Å; V202-I206 PolarHBondContact O-N 3.48Å; V202-I830 HydrophobicContact CG1-CD1 4.01Å; V202-I830 HydrophobicContact CG1-CG1 4.47Å; V202-I830 HydrophobicContact CG2-CD1 4.14Å; V202-I830 HydrophobicContact CG2-CG1 3.68Å
203	F	90.1	Very high	88.5	Confident	10 Å²	10	46.5 Å²	46.5	4%	0.044	23%	0.229	C	C	.	.	H	α-helix	trans	-69.2	-46.3	-175	-64.7	-70.6	0	0	0	113.5	L173 R205 I206 L207 I429 I433 V437	L173-F203 VanDerWaalsContact O-CD2 3.26Å; L173-F203 WeakPolarHBondContact O-CD2 3.36Å; L173-F203 VanDerWaalsContact O-CE2 3.31Å; L173-F203 WeakPolarHBondContact O-CE2 3.44Å; F203-R205 VanDerWaalsContact C-N 3.26Å; F203-R205 PolarHBondContact O-N 3.3Å; F203-I206 PolarHBondContact O-N 2.94Å; F203-L207 WeakPolarHBondContact O-CB 3.49Å; F203-L207 WeakPolarHBondContact O-CG 3.14Å; F203-L207 PolarHBondContact O-N 3.46Å; F203-I429 HydrophobicContact CD1-CG2 3.88Å; F203-I429 HydrophobicContact CE1-CG2 4.27Å; F203-I433 HydrophobicContact CE1-CG2 4.02Å; F203-I433 HydrophobicContact CZ-CG2 4.29Å; F203-V437 HydrophobicContact CE2-CB 4.01Å; F203-V437 HydrophobicContact CE2-CG1 3.82Å; F203-V437 HydrophobicContact CZ-CB 3.69Å; F203-V437 HydrophobicContact CZ-CG1 3.79Å; F203-V437 HydrophobicContact CZ-CG2 3.98Å
204	P	89.7	Confident	89.1	Confident	4 Å²	4	42.2 Å²	42.2	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-57.7	-38.1	176	-25.2	35.3	0	0	0	112.7	P177 P197 H201 R208	P177-P204 HydrophobicContact CB-CG 4.34Å; P197-P204 HydrophobicContact CB-CB 3.74Å; P197-P204 HydrophobicContact CG-CB 3.93Å; H201-P204 HydrophobicContact CB-CB 4.38Å; H201-P204 HydrophobicContact CB-CG 4.08Å; P204-R208 VanDerWaalsContact O-CB 3.23Å; P204-R208 WeakPolarHBondContact O-CB 3Å; P204-R208 PolarHBondContact O-N 3.41Å
205	R	90.2	Very high	89.5	Confident	15 Å²	15	34.2 Å²	34.2	6%	0.057	17%	0.167	C	C	.	.	H	α-helix	trans	-74.3	-36.6	177.2	-72.9	-73.5	-175.9	175.5	3.3	113.2	N196 P197 E198 H201 V202 F203 R208 G209 D821 A825	N196-R205 PolarHBondContact OD1-NH1 2.63Å; N196-R205 PolarHBondContact OD1-NH2 3.36Å; P197-R205 HydrophobicContact CG-CG 4.24Å; P197-R205 PolarHBondContact O-NE 2.88Å; P197-R205 PolarHBondContact O-NH2 2.91Å; E198-R205 WeakPolarHBondContact O-CG 3.46Å; E198-R205 PolarHBondContact O-NE 3.41Å; E198-R205 VanDerWaalsContact O-NE 3.15Å; H201-R205 WeakPolarHBondContact O-CB 3.47Å; H201-R205 WeakPolarHBondContact O-CG 3.26Å; H201-R205 PolarHBondContact O-N 3.43Å; V202-R205 PolarHBondContact O-N 2.95Å; F203-R205 VanDerWaalsContact C-N 3.26Å; F203-R205 PolarHBondContact O-N 3.3Å; R205-R208 PolarHBondContact O-N 2.85Å; R205-G209 PolarHBondContact O-N 2.88Å; R205-D821 WeakPolarHBondContact CD-OD1 3.37Å; R205-D821 IonicContact CZ-OD1 3.62Å; R205-D821 IonicContact NE-OD1 2.72Å; R205-D821 IonicContact NH1-OD1 3.69Å; R205-D821 PolarHBondContact NH1-OD1 3.03Å; R205-A825 HydrophobicContact CB-CB 3.74Å
206	I	91.3	Very high	90	Very high	30 Å²	30	33.3 Å²	33.3	15%	0.154	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-45.6	173.3	-70.1	167.7	0	0	0	110.6	V202 F203 G209 L210 I429 L822 A825	V202-I206 HydrophobicContact CG1-CD1 3.69Å; V202-I206 VanDerWaalsContact O-CG1 3.24Å; V202-I206 WeakPolarHBondContact O-CG1 3.39Å; V202-I206 PolarHBondContact O-N 3.48Å; F203-I206 PolarHBondContact O-N 2.94Å; I206-G209 PolarHBondContact O-N 3.34Å; I206-L210 HydrophobicContact CG2-CD1 4.31Å; I206-L210 WeakPolarHBondContact O-CG 3.19Å; I206-L210 PolarHBondContact O-N 2.71Å; I206-I429 HydrophobicContact CG2-CD1 3.95Å; I206-L822 HydrophobicContact CB-CD2 4.3Å; I206-L822 HydrophobicContact CG1-CD2 4.15Å; I206-L822 HydrophobicContact CG2-CD2 4.14Å; I206-A825 HydrophobicContact CG1-CB 3.93Å
207	L	91.3	Very high	90.4	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-41.4	177.6	-67.8	174.8	0	0	0	111.4	P177 E181 L186 F203 G209 L210 A211 I429	P177-L207 HydrophobicContact CB-CD1 3.86Å; P177-L207 HydrophobicContact CG-CD1 4.24Å; E181-L207 HydrophobicContact CB-CD1 3.98Å; E181-L207 HydrophobicContact CG-CB 4.49Å; L186-L207 HydrophobicContact CD2-CB 4.39Å; L186-L207 HydrophobicContact CD2-CD2 4.21Å; L186-L207 WeakPolarHBondContact CD2-O 3.46Å; F203-L207 WeakPolarHBondContact O-CB 3.49Å; F203-L207 WeakPolarHBondContact O-CG 3.14Å; F203-L207 PolarHBondContact O-N 3.46Å; L207-G209 VanDerWaalsContact C-N 3.35Å; L207-G209 PolarHBondContact O-N 2.83Å; L207-L210 PolarHBondContact O-N 2.89Å; L207-A211 WeakPolarHBondContact O-CB 2.98Å; L207-A211 PolarHBondContact O-N 3.34Å; L207-I429 HydrophobicContact CD2-CG2 4.36Å
208	R	90.1	Very high	90.6	Very high	28 Å²	28	30.3 Å²	30.3	11%	0.106	15%	0.146	C	C	.	.	H	α-helix	trans	-57.6	-46	170.5	-173.8	-175.1	177.3	78	-4.9	112.1	L192 T195 P204 R205 L210 A211 Q212 D821	L192-R208 HydrophobicContact CD2-CG 3.71Å; L192-R208 PolarHBondContact O-NH1 2.8Å; L192-R208 PolarHBondContact O-NH2 2.91Å; T195-R208 PolarHBondContact O-NH1 2.87Å; P204-R208 VanDerWaalsContact O-CB 3.23Å; P204-R208 WeakPolarHBondContact O-CB 3Å; P204-R208 PolarHBondContact O-N 3.41Å; R205-R208 PolarHBondContact O-N 2.85Å; R208-L210 PolarHBondContact O-N 3.29Å; R208-A211 CarbonylContact O-C 3.59Å; R208-A211 WeakPolarHBondContact O-CB 3.33Å; R208-A211 PolarHBondContact O-N 3.47Å; R208-Q212 WeakPolarHBondContact O-CG 3.31Å; R208-Q212 PolarHBondContact O-N 3.15Å; R208-D821 WeakPolarHBondContact CD-OD2 3.35Å; R208-D821 VanDerWaalsContact CG-OD2 3.26Å; R208-D821 WeakPolarHBondContact CG-OD2 3.3Å; R208-D821 IonicContact NE-OD1 2.7Å; R208-D821 IonicContact NE-OD2 3.33Å; R208-D821 PolarHBondContact NE-OD2 3Å
209	G	92.2	Very high	90.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-44	177.1	0	0	0	0	0	112.3	R205 I206 L207 Q212 I213 A818	R205-G209 PolarHBondContact O-N 2.88Å; I206-G209 PolarHBondContact O-N 3.34Å; L207-G209 VanDerWaalsContact C-N 3.35Å; L207-G209 PolarHBondContact O-N 2.83Å; G209-Q212 WeakPolarHBondContact O-CB 3.12Å; G209-Q212 PolarHBondContact O-N 3.49Å; G209-I213 WeakPolarHBondContact O-CG1 3.3Å; G209-I213 PolarHBondContact O-N 3.39Å; G209-A818 WeakPolarHBondContact O-CB 3.43Å
210	L	93	Very high	91.3	Very high	19 Å²	19	23.1 Å²	23.1	10%	0.099	11%	0.113	C	C	.	.	H	α-helix	trans	-63.9	-39.6	173.3	-69.9	173.5	0	0	0	112.4	L186 I206 L207 R208 Q212 I213 R214 I422 I425 I429	L186-L210 HydrophobicContact CD1-CB 4.14Å; L186-L210 HydrophobicContact CD2-CB 4.02Å; I206-L210 HydrophobicContact CG2-CD1 4.31Å; I206-L210 WeakPolarHBondContact O-CG 3.19Å; I206-L210 PolarHBondContact O-N 2.71Å; L207-L210 PolarHBondContact O-N 2.89Å; R208-L210 PolarHBondContact O-N 3.29Å; L210-Q212 VanDerWaalsContact C-N 3.32Å; L210-Q212 PolarHBondContact O-N 2.92Å; L210-I213 PolarHBondContact O-N 2.82Å; L210-R214 WeakPolarHBondContact O-CB 3.44Å; L210-R214 PolarHBondContact O-N 3.18Å; L210-I422 HydrophobicContact CB-CG2 4.26Å; L210-I422 HydrophobicContact CD2-CG2 4.38Å; L210-I425 HydrophobicContact CD1-CG2 4.08Å; L210-I425 HydrophobicContact CD2-CG2 4.47Å; L210-I429 HydrophobicContact CD1-CD1 3.61Å
211	A	91.9	Very high	91.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.8	-36.3	175.8	0	0	0	0	0	111.7	L186 L187 L192 L207 R208 R214 A215	L186-A211 HydrophobicContact CB-CB 4.05Å; L186-A211 HydrophobicContact CD2-CB 4.16Å; L187-A211 HydrophobicContact CB-CB 4.3Å; L192-A211 HydrophobicContact CD1-CB 3.92Å; L192-A211 HydrophobicContact CD2-CB 4.08Å; L192-A211 HydrophobicContact CG-CB 4.26Å; L207-A211 WeakPolarHBondContact O-CB 2.98Å; L207-A211 PolarHBondContact O-N 3.34Å; R208-A211 CarbonylContact O-C 3.59Å; R208-A211 WeakPolarHBondContact O-CB 3.33Å; R208-A211 PolarHBondContact O-N 3.47Å; A211-R214 PolarHBondContact O-N 2.99Å; A211-A215 VanDerWaalsContact O-CB 3.25Å; A211-A215 WeakPolarHBondContact O-CB 3.35Å; A211-A215 PolarHBondContact O-N 3.07Å
212	Q	93.8	Very high	91.6	Very high	15 Å²	15	25 Å²	25	7%	0.07	13%	0.127	C	C	.	.	H	α-helix	trans	-65.8	-41.8	172.8	-69.6	-70.7	8	0	0	112.2	L192 R208 G209 L210 A215 Y216 R814 A817 A818	L192-Q212 HydrophobicContact CD2-CG 3.97Å; R208-Q212 WeakPolarHBondContact O-CG 3.31Å; R208-Q212 PolarHBondContact O-N 3.15Å; G209-Q212 WeakPolarHBondContact O-CB 3.12Å; G209-Q212 PolarHBondContact O-N 3.49Å; L210-Q212 VanDerWaalsContact C-N 3.32Å; L210-Q212 PolarHBondContact O-N 2.92Å; Q212-A215 PolarHBondContact O-N 3.06Å; Q212-Y216 WeakPolarHBondContact O-CB 3.33Å; Q212-Y216 PolarHBondContact O-N 3.07Å; Q212-R814 VanDerWaalsContact OE1-NH1 3.12Å; Q212-A817 HydrophobicContact CG-CB 4.35Å; Q212-A818 HydrophobicContact CB-CB 3.79Å
213	I	94	Very high	91.6	Very high	43 Å²	43	28.6 Å²	28.6	22%	0.221	14%	0.144	C	C	.	.	H	α-helix	trans	-64.3	-44.8	174.7	-62.5	167	0	0	0	110	G209 L210 A215 Y216 I217 I422 L815 A818 L822	G209-I213 WeakPolarHBondContact O-CG1 3.3Å; G209-I213 PolarHBondContact O-N 3.39Å; L210-I213 PolarHBondContact O-N 2.82Å; I213-A215 PolarHBondContact O-N 3.4Å; I213-Y216 WeakPolarHBondContact O-CB 3.47Å; I213-Y216 PolarHBondContact O-N 3.47Å; I213-I217 HydrophobicContact CG2-CD1 3.94Å; I213-I217 WeakPolarHBondContact O-CG1 3.16Å; I213-I217 PolarHBondContact O-N 3.32Å; I213-I422 HydrophobicContact CB-CD1 4.4Å; I213-I422 HydrophobicContact CG2-CD1 3.61Å; I213-L815 HydrophobicContact CG1-CD2 4.39Å; I213-A818 HydrophobicContact CD1-CB 4.24Å; I213-A818 HydrophobicContact CG1-CB 3.64Å; I213-L822 HydrophobicContact CD1-CD1 4.46Å
214	R	92.6	Very high	91.7	Very high	67 Å²	67	28.1 Å²	28.1	25%	0.253	14%	0.142	S	C	.	.	H	α-helix	trans	-58.7	-47.2	175.7	-179.8	174.8	-177.4	-82.5	-5.1	111.4	L186 L210 A211 Y216 I217 S218 I419 I422 D423	L186-R214 HydrophobicContact CD1-CB 4.31Å; L210-R214 WeakPolarHBondContact O-CB 3.44Å; L210-R214 PolarHBondContact O-N 3.18Å; A211-R214 PolarHBondContact O-N 2.99Å; R214-Y216 VanDerWaalsContact C-N 3.35Å; R214-Y216 PolarHBondContact O-N 3.4Å; R214-I217 PolarHBondContact O-N 2.92Å; R214-S218 WeakPolarHBondContact O-CB 3.26Å; R214-S218 PolarHBondContact O-N 3.29Å; R214-S218 PolarHBondContact O-OG 3.29Å; R214-S218 VanDerWaalsContact O-OG 3.12Å; R214-I419 HydrophobicContact CG-CG2 4.16Å; R214-I422 HydrophobicContact CB-CG2 4.21Å; R214-D423 WeakPolarHBondContact CD-OD1 3.4Å; R214-D423 IonicContact NE-OD1 3.92Å; R214-D423 PolarHBondContact NE-OD1 2.74Å; R214-D423 VanDerWaalsContact NE-OD1 3.13Å; R214-D423 IonicContact NE-OD2 2.86Å
215	A	91.6	Very high	91.7	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-60.3	-44.2	177.1	0	0	0	0	0	111.4	P189 L192 A211 Q212 I213 I217 S218 E219	P189-A215 HydrophobicContact CG-CB 4Å; L192-A215 HydrophobicContact CD1-CB 4.26Å; A211-A215 VanDerWaalsContact O-CB 3.25Å; A211-A215 WeakPolarHBondContact O-CB 3.35Å; A211-A215 PolarHBondContact O-N 3.07Å; Q212-A215 PolarHBondContact O-N 3.06Å; I213-A215 PolarHBondContact O-N 3.4Å; A215-I217 PolarHBondContact O-N 2.96Å; A215-S218 WeakPolarHBondContact CA-OG 3.31Å; A215-S218 PolarHBondContact O-N 3.44Å; A215-S218 PolarHBondContact O-OG 2.95Å; A215-E219 VanDerWaalsContact O-CB 3.28Å; A215-E219 WeakPolarHBondContact O-CB 3.26Å; A215-E219 VanDerWaalsContact O-CG 3.31Å; A215-E219 WeakPolarHBondContact O-CG 3.5Å; A215-E219 PolarHBondContact O-N 3.44Å
216	Y	93.9	Very high	91.8	Very high	23 Å²	23	36.2 Å²	36.2	9%	0.09	18%	0.179	C	C	.	.	H	α-helix	trans	-56.4	-50.2	174.3	176.1	-105.2	0	0	0	111.7	Q212 I213 R214 E219 F220 G810 Q811 C812 R814 L815	Q212-Y216 WeakPolarHBondContact O-CB 3.33Å; Q212-Y216 PolarHBondContact O-N 3.07Å; I213-Y216 WeakPolarHBondContact O-CB 3.47Å; I213-Y216 PolarHBondContact O-N 3.47Å; R214-Y216 VanDerWaalsContact C-N 3.35Å; R214-Y216 PolarHBondContact O-N 3.4Å; Y216-E219 PolarHBondContact O-N 3.44Å; Y216-F220 AromaticContact CE1-CD2 3.92Å; Y216-F220 HydrophobicContact CE1-CD2 3.92Å; Y216-F220 HydrophobicContact CE1-CE2 4.32Å; Y216-F220 HydrophobicContact CE2-CD2 4.24Å; Y216-F220 AromaticContact CZ-CD2 3.68Å; Y216-F220 AromaticContact CZ-CE2 3.93Å; Y216-F220 WeakPolarHBondContact O-CA 3.22Å; Y216-F220 WeakPolarHBondContact O-CB 3.41Å; Y216-F220 PolarHBondContact O-N 3.36Å; Y216-F220 WeakPolarHBondContact OH-CE2 3.31Å; Y216-G810 PolarHBondContact OH-O 3.42Å; Y216-G810 VanDerWaalsContact OH-O 3.05Å; Y216-Q811 WeakPolarHBondContact CE2-O 3.49Å; Y216-C812 HydrophobicContact CE2-CB 4.28Å; Y216-R814 HydrophobicContact CD2-CB 4.38Å; Y216-L815 HydrophobicContact CD1-CD1 4.03Å; Y216-L815 HydrophobicContact CD1-CD2 3.7Å; Y216-L815 HydrophobicContact CD1-CG 3.84Å; Y216-L815 HydrophobicContact CD2-CG 4.16Å; Y216-L815 HydrophobicContact CE1-CD1 3.63Å; Y216-L815 HydrophobicContact CE1-CD2 4.15Å; Y216-L815 HydrophobicContact CE1-CG 3.96Å; Y216-L815 HydrophobicContact CE2-CD1 4.24Å; Y216-L815 HydrophobicContact CE2-CG 4.27Å; Y216-L815 HydrophobicContact CG-CD1 4.49Å; Y216-L815 HydrophobicContact CG-CD2 4.01Å; Y216-L815 HydrophobicContact CG-CG 3.93Å
217	I	93.2	Very high	91.7	Very high	24 Å²	24	36 Å²	36	12%	0.123	18%	0.178	C	C	.	.	H	α-helix	trans	-66.2	-41.4	-178.7	-65.4	172.7	0	0	0	111.2	I213 R214 A215 F220 L415 A418 I419 I422	I213-I217 HydrophobicContact CG2-CD1 3.94Å; I213-I217 WeakPolarHBondContact O-CG1 3.16Å; I213-I217 PolarHBondContact O-N 3.32Å; R214-I217 PolarHBondContact O-N 2.92Å; A215-I217 PolarHBondContact O-N 2.96Å; I217-F220 WeakPolarHBondContact O-CB 3.11Å; I217-F220 PolarHBondContact O-N 3.43Å; I217-L415 HydrophobicContact CG2-CB 3.71Å; I217-L415 HydrophobicContact CG2-CD2 3.98Å; I217-L415 HydrophobicContact CG2-CG 4.33Å; I217-L415 WeakPolarHBondContact CG2-O 3.49Å; I217-A418 HydrophobicContact CD1-CB 4.09Å; I217-I419 HydrophobicContact CB-CG1 4.12Å; I217-I419 HydrophobicContact CG2-CD1 3.92Å; I217-I419 HydrophobicContact CG2-CG1 3.6Å; I217-I422 HydrophobicContact CD1-CD1 3.48Å; I217-I422 VanDerWaalsContact CD1-CD1 3.48Å
218	S	89.9	Confident	91.7	Very high	54 Å²	54	36.2 Å²	36.2	38%	0.378	18%	0.179	S	C	.	.	H	α-helix	trans	-68.2	-34.3	179.3	61.7	0	0	0	0	113.3	R214 A215	R214-S218 WeakPolarHBondContact O-CB 3.26Å; R214-S218 PolarHBondContact O-N 3.29Å; R214-S218 PolarHBondContact O-OG 3.29Å; R214-S218 VanDerWaalsContact O-OG 3.12Å; A215-S218 WeakPolarHBondContact CA-OG 3.31Å; A215-S218 PolarHBondContact O-N 3.44Å; A215-S218 PolarHBondContact O-OG 2.95Å
219	E	90.8	Very high	91.7	Very high	56 Å²	56	40.1 Å²	40.1	26%	0.262	20%	0.199	S	C	.	.	H	α-helix	trans	-89.6	-9.7	-179.9	-66.3	170.7	-174.8	0	0	112.2	P189 A215 Y216 I221 P222 Q223 R814	P189-E219 WeakPolarHBondContact CB-OE1 3.33Å; P189-E219 WeakPolarHBondContact CG-OE1 3.4Å; A215-E219 VanDerWaalsContact O-CB 3.28Å; A215-E219 WeakPolarHBondContact O-CB 3.26Å; A215-E219 VanDerWaalsContact O-CG 3.31Å; A215-E219 WeakPolarHBondContact O-CG 3.5Å; A215-E219 PolarHBondContact O-N 3.44Å; Y216-E219 PolarHBondContact O-N 3.44Å; E219-I221 PolarHBondContact O-N 3.23Å; E219-P222 VanDerWaalsContact O-CD 3.26Å; E219-P222 WeakPolarHBondContact O-CD 3.37Å; E219-P222 WeakPolarHBondContact O-CG 3.49Å; E219-Q223 WeakPolarHBondContact O-CB 3.48Å; E219-Q223 PolarHBondContact O-N 2.91Å; E219-R814 VanDerWaalsContact CD-NH2 3.3Å; E219-R814 IonicContact OE1-CZ 3.36Å; E219-R814 IonicContact OE1-NE 3.62Å; E219-R814 IonicContact OE1-NH2 3.75Å; E219-R814 PolarHBondContact OE1-NH2 2.84Å; E219-R814 IonicContact OE2-CZ 3.13Å; E219-R814 IonicContact OE2-NE 2.79Å; E219-R814 PolarHBondContact OE2-NE 3.25Å; E219-R814 IonicContact OE2-NH2 3.88Å; E219-R814 PolarHBondContact OE2-NH2 3.45Å
220	F	92.4	Very high	91.7	Very high	27 Å²	27	44 Å²	44	12%	0.118	22%	0.224	C	C	.	.	H	α-helix	trans	-53.3	-54.1	-170.3	-174.8	-92.4	0	0	0	113	Y216 I217 T224 W408 L411 L415 V809 G810	Y216-F220 AromaticContact CE1-CD2 3.92Å; Y216-F220 HydrophobicContact CE1-CD2 3.92Å; Y216-F220 HydrophobicContact CE1-CE2 4.32Å; Y216-F220 HydrophobicContact CE2-CD2 4.24Å; Y216-F220 AromaticContact CZ-CD2 3.68Å; Y216-F220 AromaticContact CZ-CE2 3.93Å; Y216-F220 WeakPolarHBondContact O-CA 3.22Å; Y216-F220 WeakPolarHBondContact O-CB 3.41Å; Y216-F220 PolarHBondContact O-N 3.36Å; Y216-F220 WeakPolarHBondContact OH-CE2 3.31Å; I217-F220 WeakPolarHBondContact O-CB 3.11Å; I217-F220 PolarHBondContact O-N 3.43Å; F220-T224 WeakPolarHBondContact O-CB 3.35Å; F220-T224 PolarHBondContact O-N 2.86Å; F220-T224 PolarHBondContact O-OG1 3.21Å; F220-W408 AromaticContact CE1-CZ3 3.85Å; F220-W408 HydrophobicContact CE1-CZ3 3.85Å; F220-L411 HydrophobicContact CD1-CD2 4.11Å; F220-L411 HydrophobicContact CE1-CD2 3.67Å; F220-L415 HydrophobicContact CB-CD1 4.2Å; F220-L415 HydrophobicContact CD1-CD1 3.9Å; F220-L415 HydrophobicContact CG-CD1 4.36Å; F220-V809 HydrophobicContact CZ-CG1 3.99Å; F220-G810 VanDerWaalsContact CE2-CA 3.47Å
221	I	91	Very high	91.6	Very high	22 Å²	22	44.2 Å²	44.2	11%	0.113	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-57.3	-178.8	-65.4	176	0	0	0	111.8	E219 Q223 T224 K225 W408 E412 L415	E219-I221 PolarHBondContact O-N 3.23Å; I221-Q223 VanDerWaalsContact C-N 3.31Å; I221-Q223 PolarHBondContact O-N 3.38Å; I221-T224 PolarHBondContact O-N 3.21Å; I221-K225 HydrophobicContact CG2-CD 4.15Å; I221-K225 HydrophobicContact CG2-CG 4.4Å; I221-K225 WeakPolarHBondContact O-CG 3.45Å; I221-K225 PolarHBondContact O-N 2.87Å; I221-W408 WeakPolarHBondContact CD1-O 3.25Å; I221-W408 HydrophobicContact CG1-CE3 4.29Å; I221-W408 HydrophobicContact CG2-CB 4Å; I221-W408 HydrophobicContact CG2-CG 4.28Å; I221-E412 HydrophobicContact CD1-CB 3.67Å; I221-E412 HydrophobicContact CD1-CG 4.29Å; I221-L415 HydrophobicContact CD1-CD1 3.79Å; I221-L415 HydrophobicContact CG1-CD1 3.73Å
222	P	90.5	Very high	91.4	Very high	81 Å²	81	45 Å²	45	53%	0.526	23%	0.231	S	C	.	.	H	α-helix	trans	-61.6	-40.1	-176.1	22.5	-33	0	0	0	112.1	E219 K225 H226	E219-P222 VanDerWaalsContact O-CD 3.26Å; E219-P222 WeakPolarHBondContact O-CD 3.37Å; E219-P222 WeakPolarHBondContact O-CG 3.49Å; P222-K225 PolarHBondContact O-N 2.84Å; P222-H226 PolarHBondContact O-N 2.94Å
223	Q	90.7	Very high	91.3	Very high	80 Å²	80	50.4 Å²	50.4	37%	0.374	25%	0.254	S	S	.	.	H	α-helix	trans	-68.5	-44.7	178.7	-170.2	58.7	36.7	0	0	111.4	E219 I221 K225 H226 D227	E219-Q223 WeakPolarHBondContact O-CB 3.48Å; E219-Q223 PolarHBondContact O-N 2.91Å; I221-Q223 VanDerWaalsContact C-N 3.31Å; I221-Q223 PolarHBondContact O-N 3.38Å; Q223-K225 VanDerWaalsContact C-N 3.32Å; Q223-K225 PolarHBondContact O-N 2.86Å; Q223-H226 WeakPolarHBondContact O-CB 3.32Å; Q223-H226 PolarHBondContact O-N 3.43Å; Q223-H226 VanDerWaalsContact O-N 3.14Å; Q223-D227 PolarHBondContact NE2-OD1 3.2Å; Q223-D227 VanDerWaalsContact NE2-OD1 3.07Å; Q223-D227 PolarHBondContact NE2-OD2 2.68Å; Q223-D227 PolarHBondContact O-N 3.03Å
224	T	91.4	Very high	91.2	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-40.9	177.3	-60.9	0	0	0	0	111.5	F220 I221 H226 D227 I228 W408 V809 G810	F220-T224 WeakPolarHBondContact O-CB 3.35Å; F220-T224 PolarHBondContact O-N 2.86Å; F220-T224 PolarHBondContact O-OG1 3.21Å; I221-T224 PolarHBondContact O-N 3.21Å; T224-H226 VanDerWaalsContact C-N 3.28Å; T224-H226 PolarHBondContact O-N 3.48Å; T224-D227 PolarHBondContact O-N 2.89Å; T224-I228 HydrophobicContact CG2-CG2 4Å; T224-I228 VanDerWaalsContact O-CG1 3.28Å; T224-I228 WeakPolarHBondContact O-CG1 3.41Å; T224-I228 WeakPolarHBondContact O-CG2 3.42Å; T224-I228 PolarHBondContact O-N 3.34Å; T224-W408 HydrophobicContact CG2-CH2 3.46Å; T224-W408 VanDerWaalsContact CG2-CH2 3.46Å; T224-W408 HydrophobicContact CG2-CZ2 3.5Å; T224-W408 HydrophobicContact CG2-CZ3 4.39Å; T224-V809 HydrophobicContact CG2-CB 4.31Å; T224-V809 HydrophobicContact CG2-CG1 4.28Å; T224-V809 HydrophobicContact CG2-CG2 4.18Å; T224-G810 PolarHBondContact OG1-N 3.42Å
225	K	90.3	Very high	91	Very high	70 Å²	70	49.2 Å²	49.2	30%	0.304	26%	0.257	S	S	.	.	H	α-helix	trans	-57.2	-43	175.2	-76.4	-174.9	-177.7	-168.6	0	111.4	I221 P222 Q223 E229 N405 W408	I221-K225 HydrophobicContact CG2-CD 4.15Å; I221-K225 HydrophobicContact CG2-CG 4.4Å; I221-K225 WeakPolarHBondContact O-CG 3.45Å; I221-K225 PolarHBondContact O-N 2.87Å; P222-K225 PolarHBondContact O-N 2.84Å; Q223-K225 VanDerWaalsContact C-N 3.32Å; Q223-K225 PolarHBondContact O-N 2.86Å; K225-E229 PolarHBondContact O-N 3.39Å; K225-N405 PolarHBondContact NZ-OD1 3.12Å; K225-W408 HydrophobicContact CG-CG 4.41Å
226	H	91.1	Very high	90.8	Very high	118 Å²	118	49.8 Å²	49.8	55%	0.546	26%	0.26	S	S	.	.	H	α-helix	trans	-66.3	-44.9	176.4	-175.5	60.5	0	0	0	112.3	P222 Q223 T224 I228 E229	P222-H226 PolarHBondContact O-N 2.94Å; Q223-H226 WeakPolarHBondContact O-CB 3.32Å; Q223-H226 PolarHBondContact O-N 3.43Å; Q223-H226 VanDerWaalsContact O-N 3.14Å; T224-H226 VanDerWaalsContact C-N 3.28Å; T224-H226 PolarHBondContact O-N 3.48Å; H226-I228 PolarHBondContact O-N 3.09Å; H226-E229 WeakPolarHBondContact O-CB 3.44Å; H226-E229 PolarHBondContact O-N 2.97Å
227	D	90.9	Very high	90.7	Very high	26 Å²	26	53.3 Å²	53.3	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-69.4	-32.4	-175.4	-66.3	-33.2	0	0	0	113.5	Q223 T224 K808 Q811	Q223-D227 PolarHBondContact NE2-OD1 3.2Å; Q223-D227 VanDerWaalsContact NE2-OD1 3.07Å; Q223-D227 PolarHBondContact NE2-OD2 2.68Å; Q223-D227 PolarHBondContact O-N 3.03Å; T224-D227 PolarHBondContact O-N 2.89Å; D227-K808 HydrophobicContact CB-CB 4.4Å; D227-Q811 PolarHBondContact OD1-NE2 3.49Å; D227-Q811 VanDerWaalsContact OD1-NE2 3.1Å; D227-Q811 WeakPolarHBondContact OD2-CG 3.26Å; D227-Q811 PolarHBondContact OD2-NE2 2.83Å
228	I	90.7	Very high	90.5	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-85.8	-17.4	178.4	72.1	-176.9	0	0	0	113	T224 H226 P230 V231 V232 T404 W408 I805 K808	T224-I228 HydrophobicContact CG2-CG2 4Å; T224-I228 VanDerWaalsContact O-CG1 3.28Å; T224-I228 WeakPolarHBondContact O-CG1 3.41Å; T224-I228 WeakPolarHBondContact O-CG2 3.42Å; T224-I228 PolarHBondContact O-N 3.34Å; H226-I228 PolarHBondContact O-N 3.09Å; I228-P230 VanDerWaalsContact C-CD 3.45Å; I228-V231 WeakPolarHBondContact O-CA 3.23Å; I228-V231 WeakPolarHBondContact O-CB 3.41Å; I228-V231 PolarHBondContact O-N 3.03Å; I228-V232 HydrophobicContact CB-CG2 4.32Å; I228-V232 HydrophobicContact CD1-CG2 4.2Å; I228-V232 HydrophobicContact CG1-CG2 3.97Å; I228-V232 WeakPolarHBondContact O-CG2 3.46Å; I228-V232 PolarHBondContact O-N 2.73Å; I228-T404 HydrophobicContact CD1-CG2 4.16Å; I228-W408 HydrophobicContact CD1-CZ2 4.02Å; I228-I805 HydrophobicContact CB-CG2 4.5Å; I228-I805 HydrophobicContact CG2-CG2 4.16Å; I228-K808 HydrophobicContact CG2-CB 4.06Å
229	E	90.1	Very high	90.4	Very high	110 Å²	110	52 Å²	52	51%	0.514	27%	0.271	S	S	.	.	H	α-helix	trans	-50.3	-45.5	-173.6	178	176.9	-162.9	0	0	113.5	K225 H226 V231 V232 K233	K225-E229 PolarHBondContact O-N 3.39Å; H226-E229 WeakPolarHBondContact O-CB 3.44Å; H226-E229 PolarHBondContact O-N 2.97Å; E229-V231 VanDerWaalsContact C-N 3.3Å; E229-V231 PolarHBondContact O-N 3.46Å; E229-V232 PolarHBondContact O-N 3.11Å; E229-K233 WeakPolarHBondContact O-CB 3.46Å; E229-K233 PolarHBondContact O-N 3.45Å
230	P	91.8	Very high	90.3	Very high	82 Å²	82	53.1 Å²	53.1	53%	0.532	28%	0.276	S	S	.	.	H	α-helix	trans	-61.9	-37.8	177.7	-22.6	34.5	0	0	0	112.8	I228 K233 S234	I228-P230 VanDerWaalsContact C-CD 3.45Å; P230-K233 PolarHBondContact O-N 3.23Å; P230-S234 PolarHBondContact O-N 3.27Å; P230-S234 VanDerWaalsContact O-N 3.11Å; P230-S234 PolarHBondContact O-OG 3Å
231	V	90.5	Very high	90.2	Very high	24 Å²	24	55.4 Å²	55.4	15%	0.145	30%	0.295	C	S	.	.	H	α-helix	trans	-72.6	-40.7	180	-172	0	0	0	0	110.5	I228 E229 K233 S234 L235 F801 K804 I805	I228-V231 WeakPolarHBondContact O-CA 3.23Å; I228-V231 WeakPolarHBondContact O-CB 3.41Å; I228-V231 PolarHBondContact O-N 3.03Å; E229-V231 VanDerWaalsContact C-N 3.3Å; E229-V231 PolarHBondContact O-N 3.46Å; V231-K233 VanDerWaalsContact C-N 3.31Å; V231-K233 PolarHBondContact O-N 3Å; V231-S234 PolarHBondContact O-N 3.39Å; V231-L235 PolarHBondContact O-N 3.25Å; V231-F801 HydrophobicContact CG1-CD1 4.14Å; V231-K804 HydrophobicContact CG1-CB 3.77Å; V231-I805 HydrophobicContact CB-CG1 4.16Å; V231-I805 HydrophobicContact CG1-CD1 4.45Å; V231-I805 HydrophobicContact CG1-CG1 3.55Å
232	V	89	Confident	90	Very high	16 Å²	16	55.5 Å²	55.5	10%	0.097	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-39.9	174.6	173.9	0	0	0	0	110.6	I228 E229 L235 I236 I400	I228-V232 HydrophobicContact CB-CG2 4.32Å; I228-V232 HydrophobicContact CD1-CG2 4.2Å; I228-V232 HydrophobicContact CG1-CG2 3.97Å; I228-V232 WeakPolarHBondContact O-CG2 3.46Å; I228-V232 PolarHBondContact O-N 2.73Å; E229-V232 PolarHBondContact O-N 3.11Å; V232-L235 WeakPolarHBondContact O-CB 3.41Å; V232-L235 PolarHBondContact O-N 3.4Å; V232-I236 HydrophobicContact CG1-CD1 4.06Å; V232-I236 VanDerWaalsContact O-CG1 3.31Å; V232-I236 WeakPolarHBondContact O-CG1 3.27Å; V232-I236 PolarHBondContact O-N 2.92Å; V232-I400 HydrophobicContact CG1-CG2 4.02Å
233	K	90.5	Very high	89.8	Confident	129 Å²	129	53 Å²	53	56%	0.561	28%	0.277	S	S	*	.	H	α-helix	trans	-61.1	-46.5	174.5	-172.6	-178.4	176.6	-172.7	0	111.8	E229 P230 V231 L235 I236 E237	E229-K233 WeakPolarHBondContact O-CB 3.46Å; E229-K233 PolarHBondContact O-N 3.45Å; P230-K233 PolarHBondContact O-N 3.23Å; V231-K233 VanDerWaalsContact C-N 3.31Å; V231-K233 PolarHBondContact O-N 3Å; K233-L235 VanDerWaalsContact C-N 3.29Å; K233-L235 PolarHBondContact O-N 3Å; K233-I236 WeakPolarHBondContact O-CB 3.14Å; K233-I236 PolarHBondContact O-N 3.28Å; K233-E237 VanDerWaalsContact CE-OE1 3.26Å; K233-E237 WeakPolarHBondContact CE-OE1 3.43Å; K233-E237 WeakPolarHBondContact O-CG 3.47Å; K233-E237 PolarHBondContact O-N 3.33Å
234	S	91.8	Very high	89.6	Confident	53 Å²	53	52.5 Å²	52.5	37%	0.371	28%	0.277	S	S	.	.	H	α-helix	trans	-64.6	-32.9	175.4	-61.9	0	0	0	0	113.1	P230 V231 A238	P230-S234 PolarHBondContact O-N 3.27Å; P230-S234 VanDerWaalsContact O-N 3.11Å; P230-S234 PolarHBondContact O-OG 3Å; V231-S234 PolarHBondContact O-N 3.39Å; S234-A238 VanDerWaalsContact O-CB 3.32Å; S234-A238 WeakPolarHBondContact O-CB 3.42Å; S234-A238 PolarHBondContact O-N 3.38Å
235	L	89.3	Confident	89.5	Confident	31 Å²	31	57.6 Å²	57.6	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-42.1	172.7	175.2	63.2	0	0	0	111.3	V231 V232 K233 A238 T239 I400 L797 F801 I805	V231-L235 PolarHBondContact O-N 3.25Å; V232-L235 WeakPolarHBondContact O-CB 3.41Å; V232-L235 PolarHBondContact O-N 3.4Å; K233-L235 VanDerWaalsContact C-N 3.29Å; K233-L235 PolarHBondContact O-N 3Å; L235-A238 PolarHBondContact O-N 2.81Å; L235-T239 WeakPolarHBondContact O-CB 3.4Å; L235-T239 PolarHBondContact O-N 3.05Å; L235-T239 PolarHBondContact O-OG1 3.49Å; L235-I400 HydrophobicContact CD2-CG2 4.49Å; L235-I400 HydrophobicContact CG-CD1 4.34Å; L235-L797 HydrophobicContact CD1-CB 4.13Å; L235-F801 HydrophobicContact CB-CB 4.48Å; L235-F801 HydrophobicContact CB-CD1 4.35Å; L235-F801 HydrophobicContact CB-CG 4.21Å; L235-F801 HydrophobicContact CD1-CB 4.14Å; L235-F801 HydrophobicContact CD1-CD2 3.76Å; L235-F801 HydrophobicContact CD1-CE2 4.44Å; L235-F801 HydrophobicContact CD1-CG 4.05Å; L235-I805 HydrophobicContact CD2-CD1 4.25Å
236	I	87.5	Confident	89.3	Confident	13 Å²	13	54.8 Å²	54.8	7%	0.067	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-52.5	175	-70	163.1	0	0	0	109.9	V232 K233 A238 T239 E240 I396 P397 I400	V232-I236 HydrophobicContact CG1-CD1 4.06Å; V232-I236 VanDerWaalsContact O-CG1 3.31Å; V232-I236 WeakPolarHBondContact O-CG1 3.27Å; V232-I236 PolarHBondContact O-N 2.92Å; K233-I236 WeakPolarHBondContact O-CB 3.14Å; K233-I236 PolarHBondContact O-N 3.28Å; I236-A238 VanDerWaalsContact C-N 3.3Å; I236-A238 PolarHBondContact O-N 2.91Å; I236-T239 PolarHBondContact O-N 3.49Å; I236-E240 HydrophobicContact CG2-CG 4.45Å; I236-E240 WeakPolarHBondContact O-CG 3.36Å; I236-E240 PolarHBondContact O-N 2.63Å; I236-I396 HydrophobicContact CG2-CG2 4.41Å; I236-P397 HydrophobicContact CD1-CB 4.24Å; I236-P397 HydrophobicContact CG2-CB 4.13Å; I236-P397 HydrophobicContact CG2-CG 3.78Å; I236-I400 HydrophobicContact CG1-CB 4.37Å; I236-I400 HydrophobicContact CG1-CD1 3.95Å; I236-I400 HydrophobicContact CG1-CG2 4.39Å
237	E	90.8	Very high	89.1	Confident	97 Å²	97	49.9 Å²	49.9	45%	0.453	26%	0.262	S	S	.	.	H	α-helix	trans	-58.1	-41.2	179.2	-70.1	168.9	-175.7	0	0	111.9	K233 S241	K233-E237 VanDerWaalsContact CE-OE1 3.26Å; K233-E237 WeakPolarHBondContact CE-OE1 3.43Å; K233-E237 WeakPolarHBondContact O-CG 3.47Å; K233-E237 PolarHBondContact O-N 3.33Å; E237-S241 WeakPolarHBondContact O-CB 3.23Å; E237-S241 PolarHBondContact O-N 3.14Å
238	A	90.1	Very high	89	Confident	25 Å²	25	51.8 Å²	51.8	21%	0.207	27%	0.273	C	S	.	.	H	α-helix	trans	-68.6	-35.1	177	0	0	0	0	0	112.7	S234 L235 I236 M242 L797 F801	S234-A238 VanDerWaalsContact O-CB 3.32Å; S234-A238 WeakPolarHBondContact O-CB 3.42Å; S234-A238 PolarHBondContact O-N 3.38Å; L235-A238 PolarHBondContact O-N 2.81Å; I236-A238 VanDerWaalsContact C-N 3.3Å; I236-A238 PolarHBondContact O-N 2.91Å; A238-M242 WeakPolarHBondContact O-CB 3.4Å; A238-M242 PolarHBondContact O-N 3.21Å; A238-L797 HydrophobicContact CB-CD2 3.71Å; A238-F801 HydrophobicContact CB-CE2 3.73Å; A238-F801 HydrophobicContact CB-CZ 3.9Å
239	T	87.6	Confident	88.8	Confident	27 Å²	27	54.4 Å²	54.4	17%	0.166	29%	0.285	C	S	.	.	H	α-helix	trans	-72	-39.9	177.5	-52.3	0	0	0	0	111	L235 I236 M242 Q243 I396	L235-T239 WeakPolarHBondContact O-CB 3.4Å; L235-T239 PolarHBondContact O-N 3.05Å; L235-T239 PolarHBondContact O-OG1 3.49Å; I236-T239 PolarHBondContact O-N 3.49Å; T239-M242 WeakPolarHBondContact O-CB 3.47Å; T239-M242 PolarHBondContact O-N 3.14Å; T239-Q243 PolarHBondContact O-N 3.12Å; T239-I396 HydrophobicContact CG2-CD1 3.87Å; T239-I396 HydrophobicContact CG2-CG1 4.26Å; T239-I396 HydrophobicContact CG2-CG2 3.7Å
240	E	88	Confident	88.8	Confident	78 Å²	78	50 Å²	50	36%	0.364	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-45.8	172.1	-72.3	174.6	165.5	0	0	110.9	I236 M242 Q243 D244 I396	I236-E240 HydrophobicContact CG2-CG 4.45Å; I236-E240 WeakPolarHBondContact O-CG 3.36Å; I236-E240 PolarHBondContact O-N 2.63Å; E240-M242 VanDerWaalsContact C-N 3.31Å; E240-M242 PolarHBondContact O-N 3.09Å; E240-Q243 WeakPolarHBondContact O-CB 3.4Å; E240-Q243 PolarHBondContact O-N 3.31Å; E240-Q243 VanDerWaalsContact O-N 3.13Å; E240-D244 PolarHBondContact O-N 3.33Å; E240-I396 HydrophobicContact CB-CD1 4.47Å; E240-I396 HydrophobicContact CG-CB 4.41Å; E240-I396 HydrophobicContact CG-CD1 3.88Å
241	S	90.1	Very high	88.6	Confident	76 Å²	76	47.6 Å²	47.6	53%	0.531	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-38.4	175.4	-175.2	0	0	0	0	112.8	E237 R245	E237-S241 WeakPolarHBondContact O-CB 3.23Å; E237-S241 PolarHBondContact O-N 3.14Å; S241-R245 VanDerWaalsContact O-CB 3.31Å; S241-R245 WeakPolarHBondContact O-CB 3.4Å; S241-R245 PolarHBondContact O-N 2.97Å
242	M	87	Confident	88.4	Confident	23 Å²	23	49.3 Å²	49.3	11%	0.113	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-48.1	172.5	172.9	-174.8	159.7	0	0	111.1	A238 T239 E240 D244 R245 M246 T790 E793 L797	A238-M242 WeakPolarHBondContact O-CB 3.4Å; A238-M242 PolarHBondContact O-N 3.21Å; T239-M242 WeakPolarHBondContact O-CB 3.47Å; T239-M242 PolarHBondContact O-N 3.14Å; E240-M242 VanDerWaalsContact C-N 3.31Å; E240-M242 PolarHBondContact O-N 3.09Å; M242-D244 PolarHBondContact O-N 3.11Å; M242-R245 PolarHBondContact O-N 2.93Å; M242-M246 HydrophobicContact CG-CG 4.31Å; M242-M246 WeakPolarHBondContact O-CB 2.98Å; M242-M246 WeakPolarHBondContact O-CG 3.39Å; M242-M246 PolarHBondContact O-N 3.33Å; M242-T790 HydrophobicContact CE-CG2 3.96Å; M242-E793 HydrophobicContact CE-CB 3.4Å; M242-E793 HydrophobicContact CE-CG 4.39Å; M242-E793 HydrophobicContact CG-CB 4.37Å; M242-E793 HydrophobicContact SD-CB 3.61Å; M242-L797 HydrophobicContact SD-CD1 3.85Å
243	Q	86.5	Confident	88.5	Confident	29 Å²	29	50.3 Å²	50.3	14%	0.136	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-47.6	178.3	-176.9	-172	-60.3	0	0	111.2	T239 E240 M246 T247 I394 I396	T239-Q243 PolarHBondContact O-N 3.12Å; E240-Q243 WeakPolarHBondContact O-CB 3.4Å; E240-Q243 PolarHBondContact O-N 3.31Å; E240-Q243 VanDerWaalsContact O-N 3.13Å; Q243-M246 PolarHBondContact O-N 3.38Å; Q243-T247 WeakPolarHBondContact O-CB 3.48Å; Q243-T247 PolarHBondContact O-N 3.45Å; Q243-T247 PolarHBondContact O-OG1 3.27Å; Q243-I394 HydrophobicContact CG-CD1 4.48Å; Q243-I396 HydrophobicContact CB-CD1 4.16Å
244	D	87	Confident	88.4	Confident	70 Å²	70	44.3 Å²	44.3	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-62.2	-45.8	179.5	-78.5	-16.3	0	0	0	111.9	E240 M242 M246 T247 N248	E240-D244 PolarHBondContact O-N 3.33Å; M242-D244 PolarHBondContact O-N 3.11Å; D244-M246 PolarHBondContact O-N 3.46Å; D244-T247 PolarHBondContact O-N 2.91Å; D244-N248 WeakPolarHBondContact O-CB 3.21Å; D244-N248 VanDerWaalsContact O-CG 3.24Å; D244-N248 PolarHBondContact O-N 3.29Å; D244-N248 PolarHBondContact O-ND2 3.44Å; D244-N248 VanDerWaalsContact O-ND2 3.08Å
245	R	88.4	Confident	88.2	Confident	108 Å²	108	43.3 Å²	43.3	41%	0.408	23%	0.227	S	C	.	.	H	α-helix	trans	-59.4	-48.3	176.7	179	175.7	57.6	108.6	-6.2	111.3	S241 M242 T247 N248 E249 E793	S241-R245 VanDerWaalsContact O-CB 3.31Å; S241-R245 WeakPolarHBondContact O-CB 3.4Å; S241-R245 PolarHBondContact O-N 2.97Å; M242-R245 PolarHBondContact O-N 2.93Å; R245-T247 VanDerWaalsContact C-N 3.33Å; R245-T247 PolarHBondContact O-N 3.43Å; R245-N248 PolarHBondContact O-N 2.89Å; R245-E249 WeakPolarHBondContact O-CB 3.39Å; R245-E249 PolarHBondContact O-N 2.98Å; R245-E793 IonicContact CZ-OE2 2.69Å; R245-E793 IonicContact NH1-OE2 2.95Å; R245-E793 IonicContact NH2-OE2 3.82Å; R245-E793 PolarHBondContact NH2-OE2 2.9Å
246	M	86.6	Confident	88.2	Confident	10 Å²	10	46 Å²	46	5%	0.049	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-37.6	-179.4	-69.6	-63	-74.7	0	0	111.8	M242 Q243 D244 E249 F250 I786 K789	M242-M246 HydrophobicContact CG-CG 4.31Å; M242-M246 WeakPolarHBondContact O-CB 2.98Å; M242-M246 WeakPolarHBondContact O-CG 3.39Å; M242-M246 PolarHBondContact O-N 3.33Å; Q243-M246 PolarHBondContact O-N 3.38Å; D244-M246 PolarHBondContact O-N 3.46Å; M246-E249 PolarHBondContact O-N 3.46Å; M246-F250 WeakPolarHBondContact O-CB 3.38Å; M246-F250 PolarHBondContact O-N 2.79Å; M246-I786 HydrophobicContact CB-CD1 4.3Å; M246-I786 HydrophobicContact CE-CB 4.31Å; M246-I786 HydrophobicContact CE-CD1 3.5Å; M246-I786 VanDerWaalsContact CE-CD1 3.5Å; M246-I786 HydrophobicContact CE-CG1 4.48Å; M246-I786 HydrophobicContact CE-CG2 4.08Å; M246-I786 HydrophobicContact SD-CD1 4.45Å; M246-K789 HydrophobicContact CE-CB 3.8Å; M246-K789 HydrophobicContact CE-CD 4.38Å
247	T	87.3	Confident	88.2	Confident	15 Å²	15	49 Å²	49	9%	0.092	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-44.7	176.2	-55.4	0	0	0	0	111.5	Q243 D244 R245 F250 N251 L383 K387 M390	Q243-T247 WeakPolarHBondContact O-CB 3.48Å; Q243-T247 PolarHBondContact O-N 3.45Å; Q243-T247 PolarHBondContact O-OG1 3.27Å; D244-T247 PolarHBondContact O-N 2.91Å; R245-T247 VanDerWaalsContact C-N 3.33Å; R245-T247 PolarHBondContact O-N 3.43Å; T247-F250 PolarHBondContact O-N 3.2Å; T247-N251 WeakPolarHBondContact O-CB 3.46Å; T247-N251 PolarHBondContact O-N 3.48Å; T247-L383 HydrophobicContact CG2-CD1 3.97Å; T247-K387 HydrophobicContact CG2-CG 4.17Å; T247-M390 HydrophobicContact CG2-CE 4.44Å; T247-M390 HydrophobicContact CG2-SD 4.04Å; T247-M390 PolarHBondContact OG1-SD 3.14Å
248	N	87.9	Confident	88	Confident	67 Å²	67	44.6 Å²	44.6	36%	0.358	24%	0.238	S	C	.	.	H	α-helix	trans	-65.1	-42.6	176.1	-68.5	-35.5	0	0	0	111.9	D244 R245 N251 S252 K387	D244-N248 WeakPolarHBondContact O-CB 3.21Å; D244-N248 VanDerWaalsContact O-CG 3.24Å; D244-N248 PolarHBondContact O-N 3.29Å; D244-N248 PolarHBondContact O-ND2 3.44Å; D244-N248 VanDerWaalsContact O-ND2 3.08Å; R245-N248 PolarHBondContact O-N 2.89Å; N248-N251 PolarHBondContact O-N 3.46Å; N248-S252 WeakPolarHBondContact O-CB 3.32Å; N248-S252 PolarHBondContact O-N 3.29Å; N248-K387 WeakPolarHBondContact OD1-CE 3.26Å; N248-K387 PolarHBondContact OD1-NZ 2.87Å
249	E	87.4	Confident	87.7	Confident	59 Å²	59	43.5 Å²	43.5	28%	0.276	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-46.1	177.3	-168.2	-179.2	160.3	0	0	110.6	R245 M246 N251 S252 I253 K789	R245-E249 WeakPolarHBondContact O-CB 3.39Å; R245-E249 PolarHBondContact O-N 2.98Å; M246-E249 PolarHBondContact O-N 3.46Å; E249-N251 PolarHBondContact O-N 2.88Å; E249-S252 PolarHBondContact O-N 3.47Å; E249-I253 HydrophobicContact CG-CD1 4.07Å; E249-I253 VanDerWaalsContact O-CG1 3.28Å; E249-I253 WeakPolarHBondContact O-CG1 3.3Å; E249-I253 PolarHBondContact O-N 2.84Å; E249-K789 IonicContact OE1-NZ 2.65Å; E249-K789 PolarHBondContact OE1-NZ 3.03Å; E249-K789 IonicContact OE2-NZ 3.21Å
250	F	89.3	Confident	87.6	Confident	18 Å²	18	42.5 Å²	42.5	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-47.8	175.7	-177.8	-105.6	0	0	0	112.1	M246 T247 S252 I253 L254 M626 A778 L781 F782 I786	M246-F250 WeakPolarHBondContact O-CB 3.38Å; M246-F250 PolarHBondContact O-N 2.79Å; T247-F250 PolarHBondContact O-N 3.2Å; F250-S252 VanDerWaalsContact C-N 3.27Å; F250-S252 PolarHBondContact O-N 3.16Å; F250-I253 PolarHBondContact O-N 3.32Å; F250-I253 VanDerWaalsContact O-N 3.17Å; F250-L254 HydrophobicContact CE1-CB 4.36Å; F250-L254 HydrophobicContact CE1-CD2 4.03Å; F250-L254 HydrophobicContact CZ-CB 4.37Å; F250-L254 HydrophobicContact CZ-CD2 4.34Å; F250-L254 WeakPolarHBondContact O-CB 3.27Å; F250-L254 PolarHBondContact O-N 3.41Å; F250-M626 HydrophobicContact CD1-SD 4.31Å; F250-M626 HydrophobicContact CE1-CG 3.7Å; F250-M626 HydrophobicContact CE1-SD 3.3Å; F250-M626 WeakPolarHBondContact CE1-SD 3.28Å; F250-M626 HydrophobicContact CE2-SD 4.19Å; F250-M626 HydrophobicContact CZ-CG 4.24Å; F250-M626 HydrophobicContact CZ-SD 3.22Å; F250-M626 WeakPolarHBondContact CZ-SD 3.42Å; F250-A778 HydrophobicContact CZ-CB 4.23Å; F250-L781 HydrophobicContact CE2-CB 3.97Å; F250-F782 HydrophobicContact CD2-CB 4.38Å; F250-F782 HydrophobicContact CD2-CD2 4.27Å; F250-F782 HydrophobicContact CE2-CB 3.73Å; F250-F782 HydrophobicContact CE2-CD2 4.24Å; F250-F782 HydrophobicContact CZ-CB 4.14Å; F250-F782 HydrophobicContact CZ-CD2 4.47Å; F250-I786 HydrophobicContact CB-CD1 3.84Å; F250-I786 HydrophobicContact CB-CG1 3.97Å; F250-I786 HydrophobicContact CD2-CD1 4.45Å; F250-I786 HydrophobicContact CD2-CG1 3.81Å; F250-I786 HydrophobicContact CG-CG1 4.15Å
251	N	87.5	Confident	87.5	Confident	32 Å²	32	40.7 Å²	40.7	17%	0.171	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-39.9	179.9	-167.6	65.3	0	0	0	111.3	T247 N248 E249 F255 L383	T247-N251 WeakPolarHBondContact O-CB 3.46Å; T247-N251 PolarHBondContact O-N 3.48Å; N248-N251 PolarHBondContact O-N 3.46Å; E249-N251 PolarHBondContact O-N 2.88Å; N251-F255 WeakPolarHBondContact ND2-CE2 3.42Å; N251-F255 VanDerWaalsContact ND2-CZ 3.29Å; N251-F255 WeakPolarHBondContact ND2-CZ 3.09Å; N251-F255 VanDerWaalsContact O-CB 3.24Å; N251-F255 WeakPolarHBondContact O-CB 3.27Å; N251-F255 VanDerWaalsContact O-CD1 3.3Å; N251-F255 WeakPolarHBondContact O-CD1 3.29Å; N251-F255 WeakPolarHBondContact O-CG 2.97Å; N251-F255 PolarHBondContact O-N 3.3Å; N251-F255 WeakPolarHBondContact OD1-CE1 3.45Å; N251-F255 VanDerWaalsContact OD1-CZ 3.23Å; N251-F255 WeakPolarHBondContact OD1-CZ 3.38Å; N251-L383 HydrophobicContact CB-CD1 3.99Å
252	S	87.3	Confident	87.2	Confident	60 Å²	60	40.1 Å²	40.1	42%	0.42	21%	0.205	S	C	.	.	H	α-helix	trans	-64.2	-44.2	174.5	-174.8	0	0	0	0	112.5	N248 E249 F250 F255 N256	N248-S252 WeakPolarHBondContact O-CB 3.32Å; N248-S252 PolarHBondContact O-N 3.29Å; E249-S252 PolarHBondContact O-N 3.47Å; F250-S252 VanDerWaalsContact C-N 3.27Å; F250-S252 PolarHBondContact O-N 3.16Å; S252-F255 PolarHBondContact O-N 2.82Å; S252-N256 WeakPolarHBondContact O-CB 3.32Å; S252-N256 PolarHBondContact O-N 3.44Å; S252-N256 PolarHBondContact O-ND2 2.98Å
253	I	89.7	Confident	87.1	Confident	36 Å²	36	39.1 Å²	39.1	19%	0.185	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-49.6	177.1	-69.8	165.2	0	0	0	110.3	E249 F250 F255 N256 D257 L781 H785	E249-I253 HydrophobicContact CG-CD1 4.07Å; E249-I253 VanDerWaalsContact O-CG1 3.28Å; E249-I253 WeakPolarHBondContact O-CG1 3.3Å; E249-I253 PolarHBondContact O-N 2.84Å; F250-I253 PolarHBondContact O-N 3.32Å; F250-I253 VanDerWaalsContact O-N 3.17Å; I253-F255 VanDerWaalsContact C-N 3.35Å; I253-F255 PolarHBondContact O-N 2.89Å; I253-N256 PolarHBondContact O-N 3.48Å; I253-D257 PolarHBondContact O-N 3.39Å; I253-L781 HydrophobicContact CG2-CB 4.49Å; I253-L781 HydrophobicContact CG2-CD1 4.3Å; I253-L781 HydrophobicContact CG2-CD2 4Å; I253-L781 HydrophobicContact CG2-CG 4.5Å; I253-H785 HydrophobicContact CD1-CB 3.9Å
254	L	89.1	Confident	87	Confident	4 Å²	4	39 Å²	39	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-45.9	179.1	-178.7	62.5	0	0	0	110.9	F250 N256 D257 I258 L630 A778 L781	F250-L254 HydrophobicContact CE1-CB 4.36Å; F250-L254 HydrophobicContact CE1-CD2 4.03Å; F250-L254 HydrophobicContact CZ-CB 4.37Å; F250-L254 HydrophobicContact CZ-CD2 4.34Å; F250-L254 WeakPolarHBondContact O-CB 3.27Å; F250-L254 PolarHBondContact O-N 3.41Å; L254-N256 VanDerWaalsContact C-N 3.32Å; L254-N256 PolarHBondContact O-N 3.5Å; L254-D257 PolarHBondContact O-N 2.87Å; L254-I258 HydrophobicContact CD1-CG2 4.03Å; L254-I258 HydrophobicContact CG-CD1 4.42Å; L254-I258 VanDerWaalsContact O-CG1 3.29Å; L254-I258 WeakPolarHBondContact O-CG1 3.32Å; L254-I258 PolarHBondContact O-N 2.73Å; L254-L630 HydrophobicContact CD2-CD2 3.92Å; L254-A778 HydrophobicContact CD1-CB 3.98Å; L254-A778 HydrophobicContact CD2-CB 4.37Å; L254-L781 HydrophobicContact CD1-CD1 4.06Å
255	F	88.1	Confident	86.9	Confident	31 Å²	31	41.1 Å²	41.1	14%	0.136	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-34.3	-178.9	-77.6	13.8	0	0	0	113	N251 S252 I253 I258 G259 V260 T261 S379	N251-F255 WeakPolarHBondContact ND2-CE2 3.42Å; N251-F255 VanDerWaalsContact ND2-CZ 3.29Å; N251-F255 WeakPolarHBondContact ND2-CZ 3.09Å; N251-F255 VanDerWaalsContact O-CB 3.24Å; N251-F255 WeakPolarHBondContact O-CB 3.27Å; N251-F255 VanDerWaalsContact O-CD1 3.3Å; N251-F255 WeakPolarHBondContact O-CD1 3.29Å; N251-F255 WeakPolarHBondContact O-CG 2.97Å; N251-F255 PolarHBondContact O-N 3.3Å; N251-F255 WeakPolarHBondContact OD1-CE1 3.45Å; N251-F255 VanDerWaalsContact OD1-CZ 3.23Å; N251-F255 WeakPolarHBondContact OD1-CZ 3.38Å; S252-F255 PolarHBondContact O-N 2.82Å; I253-F255 VanDerWaalsContact C-N 3.35Å; I253-F255 PolarHBondContact O-N 2.89Å; F255-I258 HydrophobicContact CD1-CD1 4.46Å; F255-G259 CarbonylContact O-C 3.57Å; F255-G259 PolarHBondContact O-N 3.31Å; F255-V260 HydrophobicContact CB-CB 3.97Å; F255-V260 HydrophobicContact CB-CG1 4.26Å; F255-V260 HydrophobicContact CD1-CB 4.35Å; F255-V260 HydrophobicContact CD1-CG1 4.41Å; F255-V260 HydrophobicContact CD2-CB 4.25Å; F255-V260 HydrophobicContact CD2-CG1 3.65Å; F255-V260 HydrophobicContact CE2-CG1 4.03Å; F255-V260 HydrophobicContact CG-CB 3.95Å; F255-V260 HydrophobicContact CG-CG1 3.86Å; F255-V260 PolarHBondContact O-N 3.05Å; F255-T261 PolarHBondContact O-N 3.35Å; F255-S379 WeakPolarHBondContact CE2-OG 3.38Å; F255-S379 WeakPolarHBondContact CZ-OG 3.49Å
256	N	88	Confident	86.7	Confident	89 Å²	89	36.5 Å²	36.5	48%	0.476	19%	0.191	S	C	.	.	H	α-helix	trans	-68.9	-43.6	173.4	-70.2	-20.9	0	0	0	111.3	S252 I253 L254 G259 T261	S252-N256 WeakPolarHBondContact O-CB 3.32Å; S252-N256 PolarHBondContact O-N 3.44Å; S252-N256 PolarHBondContact O-ND2 2.98Å; I253-N256 PolarHBondContact O-N 3.48Å; L254-N256 VanDerWaalsContact C-N 3.32Å; L254-N256 PolarHBondContact O-N 3.5Å; N256-G259 PolarHBondContact O-N 3.31Å; N256-T261 WeakPolarHBondContact OD1-CB 3.24Å; N256-T261 WeakPolarHBondContact OD1-CG2 3.24Å; N256-T261 PolarHBondContact OD1-OG1 3.47Å
257	D	87.9	Confident	86.5	Confident	74 Å²	74	36.3 Å²	36.3	40%	0.396	19%	0.191	S	C	.	.	H	α-helix	trans	-62.7	-48.5	179.6	-173.5	72.2	0	0	0	112.1	I253 L254 G259 R777 L781	I253-D257 PolarHBondContact O-N 3.39Å; L254-D257 PolarHBondContact O-N 2.87Å; D257-G259 VanDerWaalsContact C-N 3.32Å; D257-G259 PolarHBondContact O-N 2.8Å; D257-R777 IonicContact OD2-NH1 2.98Å; D257-L781 HydrophobicContact CB-CD1 3.84Å
258	I	86.3	Confident	86.2	Confident	6 Å²	6	38.4 Å²	38.4	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-81.3	-11.9	-178.3	72.7	-175.5	0	0	0	113.3	L254 F255 V260 L764 I767 L774	L254-I258 HydrophobicContact CD1-CG2 4.03Å; L254-I258 HydrophobicContact CG-CD1 4.42Å; L254-I258 VanDerWaalsContact O-CG1 3.29Å; L254-I258 WeakPolarHBondContact O-CG1 3.32Å; L254-I258 PolarHBondContact O-N 2.73Å; F255-I258 HydrophobicContact CD1-CD1 4.46Å; I258-V260 HydrophobicContact CD1-CG2 3.63Å; I258-V260 HydrophobicContact CG1-CB 4.35Å; I258-V260 HydrophobicContact CG1-CG2 3.73Å; I258-L764 HydrophobicContact CB-CD1 4.28Å; I258-L764 HydrophobicContact CD1-CD1 4.16Å; I258-L764 HydrophobicContact CG1-CD1 3.98Å; I258-I767 HydrophobicContact CG2-CG2 4.38Å; I258-L774 HydrophobicContact CD1-CD1 4.48Å; I258-L774 HydrophobicContact CG2-CD1 4.1Å
259	G	84.9	Confident	85.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.01	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	9.2	175.8	0	0	0	0	0	117.6	F255 N256 D257 T261 E262 A263	F255-G259 CarbonylContact O-C 3.57Å; F255-G259 PolarHBondContact O-N 3.31Å; N256-G259 PolarHBondContact O-N 3.31Å; D257-G259 VanDerWaalsContact C-N 3.32Å; D257-G259 PolarHBondContact O-N 2.8Å; G259-T261 VanDerWaalsContact C-N 3.29Å; G259-T261 PolarHBondContact O-N 3.01Å; G259-E262 PolarHBondContact O-N 2.86Å; G259-A263 PolarHBondContact O-N 2.99Å
260	V	84.8	Confident	85.5	Confident	6 Å²	6	35.6 Å²	35.6	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-58	-43.2	176	166.8	0	0	0	0	110.9	F255 I258 E262 A263 F264 L764	F255-V260 HydrophobicContact CB-CB 3.97Å; F255-V260 HydrophobicContact CB-CG1 4.26Å; F255-V260 HydrophobicContact CD1-CB 4.35Å; F255-V260 HydrophobicContact CD1-CG1 4.41Å; F255-V260 HydrophobicContact CD2-CB 4.25Å; F255-V260 HydrophobicContact CD2-CG1 3.65Å; F255-V260 HydrophobicContact CE2-CG1 4.03Å; F255-V260 HydrophobicContact CG-CB 3.95Å; F255-V260 HydrophobicContact CG-CG1 3.86Å; F255-V260 PolarHBondContact O-N 3.05Å; I258-V260 HydrophobicContact CD1-CG2 3.63Å; I258-V260 HydrophobicContact CG1-CB 4.35Å; I258-V260 HydrophobicContact CG1-CG2 3.73Å; V260-E262 PolarHBondContact O-N 2.93Å; V260-A263 PolarHBondContact O-N 3.3Å; V260-F264 HydrophobicContact CG1-CD2 3.66Å; V260-F264 HydrophobicContact CG1-CE1 4.44Å; V260-F264 HydrophobicContact CG1-CE2 3.18Å; V260-F264 HydrophobicContact CG1-CG 4.46Å; V260-F264 HydrophobicContact CG1-CZ 3.63Å; V260-F264 WeakPolarHBondContact O-CG 3.43Å; V260-F264 PolarHBondContact O-N 3.34Å; V260-L764 HydrophobicContact CG2-CD1 3.67Å; V260-L764 HydrophobicContact CG2-CD2 3.83Å; V260-L764 HydrophobicContact CG2-CG 4.4Å
261	T	85.7	Confident	85	Confident	40 Å²	40	34.7 Å²	34.7	25%	0.245	19%	0.185	C	C	.	.	H	α-helix	trans	-60.7	-44.4	-179.8	-52.9	0	0	0	0	112.1	F255 N256 G259 F264 Q265	F255-T261 PolarHBondContact O-N 3.35Å; N256-T261 WeakPolarHBondContact OD1-CB 3.24Å; N256-T261 WeakPolarHBondContact OD1-CG2 3.24Å; N256-T261 PolarHBondContact OD1-OG1 3.47Å; G259-T261 VanDerWaalsContact C-N 3.29Å; G259-T261 PolarHBondContact O-N 3.01Å; T261-F264 PolarHBondContact O-N 3.31Å; T261-Q265 WeakPolarHBondContact O-CG 3.33Å; T261-Q265 PolarHBondContact O-N 3.27Å
262	E	84.6	Confident	84.7	Confident	64 Å²	64	39.1 Å²	39.1	30%	0.299	20%	0.204	S	C	.	.	H	α-helix	trans	-67.9	-39.2	178.4	-173.1	-178.2	-168.2	0	0	111.3	G259 V260 F264 Q265 L266 K756 R760	G259-E262 PolarHBondContact O-N 2.86Å; V260-E262 PolarHBondContact O-N 2.93Å; E262-F264 VanDerWaalsContact C-N 3.35Å; E262-F264 PolarHBondContact O-N 2.95Å; E262-Q265 PolarHBondContact O-N 3.23Å; E262-L266 HydrophobicContact CG-CD1 4.15Å; E262-L266 WeakPolarHBondContact O-CB 3.46Å; E262-L266 WeakPolarHBondContact O-CG 3.31Å; E262-L266 PolarHBondContact O-N 3.01Å; E262-K756 WeakPolarHBondContact OE1-CE 3.32Å; E262-K756 IonicContact OE1-NZ 2.87Å; E262-K756 PolarHBondContact OE1-NZ 3.08Å; E262-R760 IonicContact OE2-CZ 3.54Å; E262-R760 IonicContact OE2-NE 3.26Å; E262-R760 PolarHBondContact OE2-NE 2.91Å; E262-R760 IonicContact OE2-NH2 3.72Å
263	A	84.7	Confident	84.4	Confident	3 Å²	3	37.9 Å²	37.9	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-43.9	175.2	0	0	0	0	0	111.5	G259 V260 L266 G267 L757 R760 L761	G259-A263 PolarHBondContact O-N 2.99Å; V260-A263 PolarHBondContact O-N 3.3Å; A263-L266 PolarHBondContact O-N 3.4Å; A263-G267 PolarHBondContact O-N 2.85Å; A263-L757 HydrophobicContact CB-CD1 4.15Å; A263-L757 WeakPolarHBondContact O-CD1 3.5Å; A263-R760 HydrophobicContact CB-CG 4.25Å; A263-L761 HydrophobicContact CB-CD2 4.37Å
264	F	85.1	Confident	83.9	Confident	27 Å²	27	36.3 Å²	36.3	12%	0.118	18%	0.184	C	C	.	.	H	α-helix	trans	-66	-41.2	175.3	-67.3	-27.9	0	0	0	112.7	V260 T261 E262 L266 G267 D268 K376 F639	V260-F264 HydrophobicContact CG1-CD2 3.66Å; V260-F264 HydrophobicContact CG1-CE1 4.44Å; V260-F264 HydrophobicContact CG1-CE2 3.18Å; V260-F264 HydrophobicContact CG1-CG 4.46Å; V260-F264 HydrophobicContact CG1-CZ 3.63Å; V260-F264 WeakPolarHBondContact O-CG 3.43Å; V260-F264 PolarHBondContact O-N 3.34Å; T261-F264 PolarHBondContact O-N 3.31Å; E262-F264 VanDerWaalsContact C-N 3.35Å; E262-F264 PolarHBondContact O-N 2.95Å; F264-L266 PolarHBondContact O-N 3.28Å; F264-G267 CarbonylContact O-C 3.37Å; F264-G267 WeakPolarHBondContact O-CA 3.41Å; F264-G267 PolarHBondContact O-N 2.9Å; F264-D268 PolarHBondContact O-N 2.84Å; F264-K376 HydrophobicContact CD1-CB 4.37Å; F264-K376 HydrophobicContact CD2-CB 4.46Å; F264-K376 HydrophobicContact CD2-CG 4.32Å; F264-K376 HydrophobicContact CE1-CB 4.15Å; F264-K376 HydrophobicContact CE2-CB 4.21Å; F264-K376 HydrophobicContact CE2-CG 4.28Å; F264-K376 HydrophobicContact CZ-CB 4.07Å; F264-F639 HydrophobicContact CE1-CE1 4.2Å; F264-F639 HydrophobicContact CE1-CZ 4.14Å
265	Q	85.2	Confident	83.5	Confident	113 Å²	113	38 Å²	38	53%	0.528	19%	0.194	S	C	.	.	H	α-helix	trans	-62.1	-41.7	175.6	-74.4	174.3	-3.6	0	0	112.5	T261 E262 G267 D268 I269	T261-Q265 WeakPolarHBondContact O-CG 3.33Å; T261-Q265 PolarHBondContact O-N 3.27Å; E262-Q265 PolarHBondContact O-N 3.23Å; Q265-G267 VanDerWaalsContact C-N 3.33Å; Q265-D268 PolarHBondContact O-N 3.34Å; Q265-I269 WeakPolarHBondContact O-CG1 3.41Å; Q265-I269 PolarHBondContact O-N 3.01Å; Q265-I269 VanDerWaalsContact O-N 3.09Å
266	L	82.9	Confident	83.3	Confident	11 Å²	11	38.1 Å²	38.1	6%	0.058	20%	0.198	C	C	.	.	H	α-helix	trans	-66.8	-37.4	174.7	-72.5	170.1	0	0	0	111.6	E262 A263 F264 L270 K756 L757	E262-L266 HydrophobicContact CG-CD1 4.15Å; E262-L266 WeakPolarHBondContact O-CB 3.46Å; E262-L266 WeakPolarHBondContact O-CG 3.31Å; E262-L266 PolarHBondContact O-N 3.01Å; A263-L266 PolarHBondContact O-N 3.4Å; F264-L266 PolarHBondContact O-N 3.28Å; L266-L270 WeakPolarHBondContact O-CB 3.4Å; L266-L270 PolarHBondContact O-N 3.22Å; L266-K756 HydrophobicContact CD1-CB 4.31Å; L266-K756 HydrophobicContact CD1-CD 4.01Å; L266-K756 HydrophobicContact CD1-CG 3.91Å; L266-K756 HydrophobicContact CD2-CD 4.14Å; L266-L757 HydrophobicContact CB-CB 4.13Å; L266-L757 HydrophobicContact CB-CD1 4.02Å; L266-L757 HydrophobicContact CB-CG 4.47Å; L266-L757 HydrophobicContact CD1-CB 4.41Å
267	G	82.2	Confident	83.1	Confident	6 Å²	6	34 Å²	34	6%	0.062	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-44.7	172.1	0	0	0	0	0	112.6	A263 F264 Q265 L270 G271	A263-G267 PolarHBondContact O-N 2.85Å; F264-G267 CarbonylContact O-C 3.37Å; F264-G267 WeakPolarHBondContact O-CA 3.41Å; F264-G267 PolarHBondContact O-N 2.9Å; Q265-G267 VanDerWaalsContact C-N 3.33Å; G267-L270 PolarHBondContact O-N 2.9Å; G267-G271 PolarHBondContact O-N 2.87Å
268	D	81.7	Confident	82.7	Confident	59 Å²	59	31 Å²	31	32%	0.316	16%	0.159	S	C	.	.	H	α-helix	trans	-63.2	-46.8	178.3	-72.6	-21.4	0	0	0	111.2	F264 Q265 L270 G271 E272 K376	F264-D268 PolarHBondContact O-N 2.84Å; Q265-D268 PolarHBondContact O-N 3.34Å; D268-L270 VanDerWaalsContact C-N 3.34Å; D268-L270 PolarHBondContact O-N 2.83Å; D268-G271 PolarHBondContact O-N 3.17Å; D268-E272 PolarHBondContact O-N 3.12Å; D268-K376 IonicContact OD2-NZ 2.64Å
269	I	81.7	Confident	82.5	Confident	63 Å²	63	34.2 Å²	34.2	32%	0.323	18%	0.179	S	C	.	.	H	α-helix	trans	-61.1	-44.3	176.6	-66.8	166.1	0	0	0	110.8	Q265 H273	Q265-I269 WeakPolarHBondContact O-CG1 3.41Å; Q265-I269 PolarHBondContact O-N 3.01Å; Q265-I269 VanDerWaalsContact O-N 3.09Å; I269-H273 PolarHBondContact O-N 2.83Å; I269-H273 PolarHBondContact O-ND1 3.41Å
270	L	78	Confident	82.6	Confident	4 Å²	4	37 Å²	37	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-48.1	178.1	174.7	61.7	0	0	0	111.2	L266 G267 D268 E272 H273 V274 L647 A650 I750 V754 L757	L266-L270 WeakPolarHBondContact O-CB 3.4Å; L266-L270 PolarHBondContact O-N 3.22Å; G267-L270 PolarHBondContact O-N 2.9Å; D268-L270 VanDerWaalsContact C-N 3.34Å; D268-L270 PolarHBondContact O-N 2.83Å; L270-E272 PolarHBondContact O-N 2.82Å; L270-H273 PolarHBondContact O-N 3.1Å; L270-V274 HydrophobicContact CD1-CG2 3.92Å; L270-V274 HydrophobicContact CG-CG2 4.41Å; L270-V274 WeakPolarHBondContact O-CG2 3.48Å; L270-V274 PolarHBondContact O-N 3.49Å; L270-L647 HydrophobicContact CD2-CD2 3.14Å; L270-A650 HydrophobicContact CD1-CB 4.29Å; L270-I750 HydrophobicContact CD1-CB 4.48Å; L270-I750 HydrophobicContact CD1-CG2 3.03Å; L270-I750 HydrophobicContact CG-CG2 4.45Å; L270-V754 HydrophobicContact CD1-CG2 3.66Å; L270-V754 HydrophobicContact CD2-CG2 4.13Å; L270-L757 HydrophobicContact CD2-CD2 3.81Å
271	G	79.5	Confident	82.6	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-55.8	-49.1	177.5	0	0	0	0	0	111.3	G267 D268 H273 V274 V275	G267-G271 PolarHBondContact O-N 2.87Å; D268-G271 PolarHBondContact O-N 3.17Å; G271-H273 PolarHBondContact O-N 2.91Å; G271-V274 PolarHBondContact O-N 3.31Å; G271-V275 WeakPolarHBondContact O-CB 3.48Å; G271-V275 WeakPolarHBondContact O-CG2 3.38Å; G271-V275 PolarHBondContact O-N 2.98Å
272	E	81.9	Confident	82.4	Confident	124 Å²	124	38.6 Å²	38.6	58%	0.579	20%	0.197	S	C	*	.	H	α-helix	trans	-56.2	-46.3	177.8	-173.5	-174.8	174.1	0	0	112.5	D268 L270 T276	D268-E272 PolarHBondContact O-N 3.12Å; L270-E272 PolarHBondContact O-N 2.82Å; E272-T276 VanDerWaalsContact O-CB 3.24Å; E272-T276 WeakPolarHBondContact O-CB 3.43Å; E272-T276 PolarHBondContact O-N 2.95Å; E272-T276 PolarHBondContact O-OG1 3.34Å
273	H	80.7	Confident	82.5	Confident	35 Å²	35	36.7 Å²	36.7	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-68.2	-43.7	-179.4	-75	80	0	0	0	112	I269 L270 G271 T276 L277 I750	I269-H273 PolarHBondContact O-N 2.83Å; I269-H273 PolarHBondContact O-ND1 3.41Å; L270-H273 PolarHBondContact O-N 3.1Å; G271-H273 PolarHBondContact O-N 2.91Å; H273-T276 PolarHBondContact O-N 2.74Å; H273-L277 VanDerWaalsContact O-CB 3.31Å; H273-L277 WeakPolarHBondContact O-CB 3.44Å; H273-L277 PolarHBondContact O-N 3.47Å; H273-I750 HydrophobicContact CB-CD1 3.6Å; H273-I750 HydrophobicContact CB-CG1 3.98Å
274	V	79	Confident	82.7	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.018	19%	0.191	C	C	.	.	H	α-helix	trans	-66.9	-44.9	179.5	175	0	0	0	0	111	L270 G271 L277 M278 V368 A650 L653 I750	L270-V274 HydrophobicContact CD1-CG2 3.92Å; L270-V274 HydrophobicContact CG-CG2 4.41Å; L270-V274 WeakPolarHBondContact O-CG2 3.48Å; L270-V274 PolarHBondContact O-N 3.49Å; G271-V274 PolarHBondContact O-N 3.31Å; V274-L277 PolarHBondContact O-N 2.96Å; V274-M278 HydrophobicContact CG1-CE 3.89Å; V274-M278 HydrophobicContact CG1-CG 4.48Å; V274-M278 HydrophobicContact CG1-SD 4.21Å; V274-M278 WeakPolarHBondContact O-CB 3.33Å; V274-M278 WeakPolarHBondContact O-CG 3.44Å; V274-M278 PolarHBondContact O-N 2.98Å; V274-V368 HydrophobicContact CG1-CG1 4.09Å; V274-A650 HydrophobicContact CG2-CB 4.39Å; V274-L653 HydrophobicContact CB-CD1 4.38Å; V274-L653 HydrophobicContact CG1-CD1 3.84Å; V274-L653 HydrophobicContact CG2-CD1 3.81Å; V274-I750 HydrophobicContact CG2-CD1 4.24Å
275	V	79.9	Confident	82.6	Confident	39 Å²	39	36.9 Å²	36.9	24%	0.236	20%	0.195	C	C	.	.	H	α-helix	trans	-58.8	-49.9	175.4	166.9	0	0	0	0	109.9	G271 L277 M278 T279 A365 Q369	G271-V275 WeakPolarHBondContact O-CB 3.48Å; G271-V275 WeakPolarHBondContact O-CG2 3.38Å; G271-V275 PolarHBondContact O-N 2.98Å; V275-L277 VanDerWaalsContact C-N 3.35Å; V275-L277 PolarHBondContact O-N 3.35Å; V275-M278 PolarHBondContact O-N 3.17Å; V275-T279 WeakPolarHBondContact O-CB 3.36Å; V275-T279 PolarHBondContact O-N 3.49Å; V275-T279 PolarHBondContact O-OG1 3.38Å; V275-A365 HydrophobicContact CB-CB 4.18Å; V275-A365 HydrophobicContact CG1-CB 4.04Å; V275-A365 HydrophobicContact CG2-CB 4.01Å; V275-Q369 HydrophobicContact CG2-CB 4.21Å
276	T	84.3	Confident	82.6	Confident	34 Å²	34	37.6 Å²	37.6	21%	0.209	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-45.2	179.4	-60.1	0	0	0	0	111.5	E272 H273 M278 K280 V743 L747	E272-T276 VanDerWaalsContact O-CB 3.24Å; E272-T276 WeakPolarHBondContact O-CB 3.43Å; E272-T276 PolarHBondContact O-N 2.95Å; E272-T276 PolarHBondContact O-OG1 3.34Å; H273-T276 PolarHBondContact O-N 2.74Å; T276-M278 PolarHBondContact O-N 3.25Å; T276-K280 HydrophobicContact CG2-CG 4.09Å; T276-K280 VanDerWaalsContact O-CB 3.27Å; T276-K280 WeakPolarHBondContact O-CB 3.34Å; T276-K280 WeakPolarHBondContact O-CG 3.12Å; T276-K280 PolarHBondContact O-N 2.87Å; T276-V743 HydrophobicContact CG2-CG1 3.84Å; T276-L747 HydrophobicContact CG2-CD1 4.35Å; T276-L747 HydrophobicContact CG2-CD2 4Å
277	L	84.1	Confident	83	Confident	2 Å²	2	38 Å²	38	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-50.4	177.1	-177.5	65	0	0	0	111.1	H273 V274 V275 Y281 L354 L653 L744 L747	H273-L277 VanDerWaalsContact O-CB 3.31Å; H273-L277 WeakPolarHBondContact O-CB 3.44Å; H273-L277 PolarHBondContact O-N 3.47Å; V274-L277 PolarHBondContact O-N 2.96Å; V275-L277 VanDerWaalsContact C-N 3.35Å; V275-L277 PolarHBondContact O-N 3.35Å; L277-Y281 WeakPolarHBondContact O-CB 3.44Å; L277-Y281 PolarHBondContact O-N 3.11Å; L277-L354 HydrophobicContact CD2-CD1 4.26Å; L277-L354 HydrophobicContact CG-CD2 4.17Å; L277-L653 HydrophobicContact CD2-CB 3.86Å; L277-L653 HydrophobicContact CD2-CD1 4.43Å; L277-L653 HydrophobicContact CD2-CD2 4.24Å; L277-L653 HydrophobicContact CD2-CG 4.41Å; L277-L744 HydrophobicContact CD1-CD2 3.76Å; L277-L747 HydrophobicContact CB-CD1 4.06Å; L277-L747 HydrophobicContact CD1-CD1 4.18Å
278	M	78.6	Confident	83.2	Confident	12 Å²	12	40.1 Å²	40.1	6%	0.059	21%	0.211	C	C	.	.	H	α-helix	trans	-64.8	-48.4	-179.3	-73.2	-174.7	176.8	0	0	112.6	V274 V275 T276 K280 Y281 I282 T358 A365 V368	V274-M278 HydrophobicContact CG1-CE 3.89Å; V274-M278 HydrophobicContact CG1-CG 4.48Å; V274-M278 HydrophobicContact CG1-SD 4.21Å; V274-M278 WeakPolarHBondContact O-CB 3.33Å; V274-M278 WeakPolarHBondContact O-CG 3.44Å; V274-M278 PolarHBondContact O-N 2.98Å; V275-M278 PolarHBondContact O-N 3.17Å; T276-M278 PolarHBondContact O-N 3.25Å; M278-K280 PolarHBondContact O-N 3.14Å; M278-Y281 PolarHBondContact O-N 3.16Å; M278-I282 WeakPolarHBondContact O-CG1 3.33Å; M278-I282 PolarHBondContact O-N 3.45Å; M278-T358 HydrophobicContact CE-CG2 4.12Å; M278-T358 HydrophobicContact CG-CG2 4.13Å; M278-T358 HydrophobicContact SD-CG2 4.19Å; M278-A365 HydrophobicContact CB-CB 4.22Å; M278-A365 HydrophobicContact SD-CB 4.39Å; M278-V368 HydrophobicContact CE-CG2 4.29Å
279	T	83.2	Confident	83.4	Confident	72 Å²	72	40.7 Å²	40.7	44%	0.442	22%	0.217	S	C	.	.	H	α-helix	trans	-62.8	-45	-178.3	-59.8	0	0	0	0	111.3	V275 I282 A283	V275-T279 WeakPolarHBondContact O-CB 3.36Å; V275-T279 PolarHBondContact O-N 3.49Å; V275-T279 PolarHBondContact O-OG1 3.38Å; T279-I282 PolarHBondContact O-N 3.39Å; T279-A283 PolarHBondContact O-N 3.12Å; T279-A283 VanDerWaalsContact O-N 3.15Å
280	K	86.5	Confident	83.8	Confident	60 Å²	60	39.4 Å²	39.4	26%	0.261	22%	0.216	S	C	.	.	H	α-helix	trans	-71.9	-34.2	-179.2	-62.1	-65.2	169.3	-168.3	0	112.1	T276 M278 A283 I284 N740 V743 L744	T276-K280 HydrophobicContact CG2-CG 4.09Å; T276-K280 VanDerWaalsContact O-CB 3.27Å; T276-K280 WeakPolarHBondContact O-CB 3.34Å; T276-K280 WeakPolarHBondContact O-CG 3.12Å; T276-K280 PolarHBondContact O-N 2.87Å; M278-K280 PolarHBondContact O-N 3.14Å; K280-A283 PolarHBondContact O-N 2.96Å; K280-I284 VanDerWaalsContact O-CG1 3.3Å; K280-I284 WeakPolarHBondContact O-CG1 3.27Å; K280-I284 PolarHBondContact O-N 2.87Å; K280-N740 HydrophobicContact CD-CB 4.35Å; K280-N740 WeakPolarHBondContact CD-OD1 3.24Å; K280-N740 PolarHBondContact NZ-OD1 2.81Å; K280-V743 HydrophobicContact CD-CB 4.4Å; K280-V743 HydrophobicContact CD-CG1 4.31Å; K280-V743 HydrophobicContact CG-CB 4.48Å; K280-V743 HydrophobicContact CG-CG1 4.12Å; K280-L744 HydrophobicContact CB-CD1 4.28Å; K280-L744 HydrophobicContact CB-CD2 3.77Å; K280-L744 HydrophobicContact CB-CG 3.9Å; K280-L744 HydrophobicContact CG-CD2 4.48Å
281	Y	84.7	Confident	84.4	Confident	7 Å²	7	39.5 Å²	39.5	3%	0.027	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-49.7	169.8	153	-102.2	0	0	0	112.5	L277 M278 A283 I284 V285 A351 L354 K355	L277-Y281 WeakPolarHBondContact O-CB 3.44Å; L277-Y281 PolarHBondContact O-N 3.11Å; M278-Y281 PolarHBondContact O-N 3.16Å; Y281-A283 VanDerWaalsContact C-N 3.27Å; Y281-A283 PolarHBondContact O-N 3.06Å; Y281-I284 PolarHBondContact O-N 3.38Å; Y281-I284 VanDerWaalsContact O-N 3.11Å; Y281-V285 HydrophobicContact CD2-CG2 3.89Å; Y281-V285 HydrophobicContact CE2-CB 4.37Å; Y281-V285 HydrophobicContact CE2-CG2 3.16Å; Y281-V285 PolarHBondContact O-N 3.49Å; Y281-A351 HydrophobicContact CD2-CB 3.68Å; Y281-A351 VanDerWaalsContact CE2-CA 3.43Å; Y281-A351 HydrophobicContact CE2-CB 3.56Å; Y281-A351 WeakPolarHBondContact CE2-O 3.46Å; Y281-L354 HydrophobicContact CD1-CB 4.27Å; Y281-L354 HydrophobicContact CD1-CD2 3.58Å; Y281-L354 HydrophobicContact CD1-CG 4.42Å; Y281-L354 HydrophobicContact CD2-CB 3.91Å; Y281-L354 HydrophobicContact CD2-CD2 4.09Å; Y281-L354 HydrophobicContact CE1-CB 4.39Å; Y281-L354 HydrophobicContact CE1-CD2 4.41Å; Y281-L354 HydrophobicContact CE2-CB 4.04Å; Y281-L354 HydrophobicContact CG-CB 4.05Å; Y281-L354 HydrophobicContact CG-CD2 3.41Å; Y281-L354 VanDerWaalsContact CG-CD2 3.41Å; Y281-L354 HydrophobicContact CG-CG 4.33Å; Y281-K355 WeakPolarHBondContact OH-CA 3.33Å; Y281-K355 WeakPolarHBondContact OH-CB 3.38Å; Y281-K355 WeakPolarHBondContact OH-CG 3.41Å; Y281-K355 PolarHBondContact OH-N 3.3Å
282	I	82.2	Confident	84.8	Confident	73 Å²	73	46 Å²	46	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-58.8	-43.5	-179.5	-71.3	166.9	0	0	0	110.1	M278 T279 I284 V285 Q286	M278-I282 WeakPolarHBondContact O-CG1 3.33Å; M278-I282 PolarHBondContact O-N 3.45Å; T279-I282 PolarHBondContact O-N 3.39Å; I282-I284 PolarHBondContact O-N 2.86Å; I282-V285 PolarHBondContact O-N 2.89Å; I282-Q286 HydrophobicContact CG2-CG 4.46Å; I282-Q286 WeakPolarHBondContact O-CG 3.47Å; I282-Q286 PolarHBondContact O-N 3.11Å
283	A	86.6	Confident	85.2	Confident	24 Å²	24	46.3 Å²	46.3	20%	0.198	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-47.2	175.4	0	0	0	0	0	111.7	T279 K280 Y281 V285 Q286 S287	T279-A283 PolarHBondContact O-N 3.12Å; T279-A283 VanDerWaalsContact O-N 3.15Å; K280-A283 PolarHBondContact O-N 2.96Å; Y281-A283 VanDerWaalsContact C-N 3.27Å; Y281-A283 PolarHBondContact O-N 3.06Å; A283-V285 VanDerWaalsContact C-N 3.35Å; A283-V285 PolarHBondContact O-N 3.46Å; A283-Q286 PolarHBondContact O-N 2.95Å; A283-S287 WeakPolarHBondContact O-CB 3.41Å; A283-S287 PolarHBondContact O-N 3.39Å; A283-S287 PolarHBondContact O-OG 3.35Å
284	I	87.9	Confident	85.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-41.3	177.9	-70.3	167.1	0	0	0	111.9	K280 Y281 I282 S287 N288 I348 I737 N740 L741 L744	K280-I284 VanDerWaalsContact O-CG1 3.3Å; K280-I284 WeakPolarHBondContact O-CG1 3.27Å; K280-I284 PolarHBondContact O-N 2.87Å; Y281-I284 PolarHBondContact O-N 3.38Å; Y281-I284 VanDerWaalsContact O-N 3.11Å; I282-I284 PolarHBondContact O-N 2.86Å; I284-S287 PolarHBondContact O-N 3.25Å; I284-N288 VanDerWaalsContact O-CB 3.26Å; I284-N288 WeakPolarHBondContact O-CB 3.24Å; I284-N288 PolarHBondContact O-N 2.95Å; I284-I348 HydrophobicContact CG2-CD1 3.43Å; I284-I348 VanDerWaalsContact CG2-CD1 3.43Å; I284-I348 HydrophobicContact CG2-CG2 4.25Å; I284-I737 HydrophobicContact CG2-CG2 4.47Å; I284-N740 HydrophobicContact CD1-CB 3.92Å; I284-N740 HydrophobicContact CG1-CB 3.68Å; I284-L741 HydrophobicContact CD1-CD2 3.92Å; I284-L741 HydrophobicContact CD1-CG 4.12Å; I284-L744 HydrophobicContact CD1-CD1 3.54Å
285	V	84.2	Confident	86.3	Confident	34 Å²	34	45.7 Å²	45.7	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-67.2	-42	178.4	170.5	0	0	0	0	112	Y281 I282 A283 N288 T289 A351	Y281-V285 HydrophobicContact CD2-CG2 3.89Å; Y281-V285 HydrophobicContact CE2-CB 4.37Å; Y281-V285 HydrophobicContact CE2-CG2 3.16Å; Y281-V285 PolarHBondContact O-N 3.49Å; I282-V285 PolarHBondContact O-N 2.89Å; A283-V285 VanDerWaalsContact C-N 3.35Å; A283-V285 PolarHBondContact O-N 3.46Å; V285-N288 PolarHBondContact O-N 3.13Å; V285-T289 PolarHBondContact O-N 2.9Å; V285-T289 PolarHBondContact O-OG1 3.22Å; V285-A351 HydrophobicContact CG2-CB 3.88Å
286	Q	85.3	Confident	86.8	Confident	128 Å²	128	47.1 Å²	47.1	60%	0.598	25%	0.25	S	S	*	.	H	α-helix	trans	-62.3	-47.2	175.4	-72.9	176.5	-10.5	0	0	110.5	I282 A283 N288 T289 A290	I282-Q286 HydrophobicContact CG2-CG 4.46Å; I282-Q286 WeakPolarHBondContact O-CG 3.47Å; I282-Q286 PolarHBondContact O-N 3.11Å; A283-Q286 PolarHBondContact O-N 2.95Å; Q286-N288 PolarHBondContact O-N 3.39Å; Q286-T289 PolarHBondContact O-N 2.87Å; Q286-A290 WeakPolarHBondContact O-CB 3.33Å; Q286-A290 PolarHBondContact O-N 3.29Å
287	S	89.9	Confident	87.2	Confident	18 Å²	18	51.1 Å²	51.1	13%	0.126	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-37.1	178.1	-66.4	0	0	0	0	112.4	A283 I284 A290 F291 I733 D736	A283-S287 WeakPolarHBondContact O-CB 3.41Å; A283-S287 PolarHBondContact O-N 3.39Å; A283-S287 PolarHBondContact O-OG 3.35Å; I284-S287 PolarHBondContact O-N 3.25Å; S287-A290 PolarHBondContact O-N 3.2Å; S287-F291 WeakPolarHBondContact O-CB 3.29Å; S287-F291 PolarHBondContact O-N 3.29Å; S287-I733 WeakPolarHBondContact O-CG2 3.31Å; S287-D736 PolarHBondContact OG-OD2 3.19Å
288	N	87.3	Confident	87.6	Confident	51 Å²	51	51 Å²	51	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-65.3	-41.4	172.9	-175.8	29.4	0	0	0	112.4	I284 V285 Q286 F291 K292 M345 I348	I284-N288 VanDerWaalsContact O-CB 3.26Å; I284-N288 WeakPolarHBondContact O-CB 3.24Å; I284-N288 PolarHBondContact O-N 2.95Å; V285-N288 PolarHBondContact O-N 3.13Å; Q286-N288 PolarHBondContact O-N 3.39Å; N288-F291 WeakPolarHBondContact O-CB 3.34Å; N288-F291 PolarHBondContact O-N 3.15Å; N288-K292 PolarHBondContact O-N 3.45Å; N288-K292 VanDerWaalsContact O-N 3.12Å; N288-M345 VanDerWaalsContact OD1-CB 3.23Å; N288-M345 WeakPolarHBondContact OD1-CB 3.26Å; N288-M345 VanDerWaalsContact OD1-CG 3.25Å; N288-M345 WeakPolarHBondContact OD1-CG 3.32Å; N288-I348 HydrophobicContact CB-CD1 4.38Å
289	T	85.6	Confident	88.2	Confident	71 Å²	71	53.9 Å²	53.9	44%	0.436	27%	0.273	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175.9	-52.8	0	0	0	0	110.6	V285 Q286 F291 K292 H293	V285-T289 PolarHBondContact O-N 2.9Å; V285-T289 PolarHBondContact O-OG1 3.22Å; Q286-T289 PolarHBondContact O-N 2.87Å; T289-F291 VanDerWaalsContact C-N 3.34Å; T289-F291 PolarHBondContact O-N 3.37Å; T289-K292 PolarHBondContact O-N 3.3Å; T289-H293 PolarHBondContact O-CD2 3.21Å; T289-H293 PolarHBondContact O-N 3.03Å
290	A	89.5	Confident	88.5	Confident	37 Å²	37	55 Å²	55	31%	0.306	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-42.1	174.1	0	0	0	0	0	111.6	Q286 S287 K292 H293 T294 I733	Q286-A290 WeakPolarHBondContact O-CB 3.33Å; Q286-A290 PolarHBondContact O-N 3.29Å; S287-A290 PolarHBondContact O-N 3.2Å; A290-K292 VanDerWaalsContact C-N 3.35Å; A290-K292 PolarHBondContact O-N 2.99Å; A290-H293 PolarHBondContact O-N 3.39Å; A290-T294 WeakPolarHBondContact O-CB 3.27Å; A290-T294 PolarHBondContact O-N 2.88Å; A290-T294 PolarHBondContact O-OG1 3.29Å; A290-I733 HydrophobicContact CB-CD1 4.03Å
291	F	91.4	Very high	88.9	Confident	5 Å²	5	53.3 Å²	53.3	2%	0.022	27%	0.273	C	S	.	.	H	α-helix	trans	-55.8	-49.1	176.3	-176.7	-92.2	0	0	0	111.3	S287 N288 T289 H293 T294 F295 T343 M345 P668 Y671 L730 I733 I734	S287-F291 WeakPolarHBondContact O-CB 3.29Å; S287-F291 PolarHBondContact O-N 3.29Å; N288-F291 WeakPolarHBondContact O-CB 3.34Å; N288-F291 PolarHBondContact O-N 3.15Å; T289-F291 VanDerWaalsContact C-N 3.34Å; T289-F291 PolarHBondContact O-N 3.37Å; F291-H293 PolarHBondContact O-N 3.44Å; F291-T294 PolarHBondContact O-N 2.86Å; F291-F295 HydrophobicContact CE1-CB 4.28Å; F291-F295 HydrophobicContact CE1-CG 4.43Å; F291-F295 HydrophobicContact CZ-CD2 4.47Å; F291-F295 WeakPolarHBondContact O-CB 3.24Å; F291-F295 PolarHBondContact O-N 2.99Å; F291-T343 HydrophobicContact CZ-CG2 4.3Å; F291-M345 HydrophobicContact CB-CE 3.72Å; F291-M345 HydrophobicContact CD1-CB 4.4Å; F291-M345 HydrophobicContact CD1-CE 3.94Å; F291-M345 HydrophobicContact CD2-CE 3.86Å; F291-M345 HydrophobicContact CE2-CE 4.48Å; F291-M345 HydrophobicContact CG-CE 3.55Å; F291-P668 HydrophobicContact CE2-CG 4.1Å; F291-P668 HydrophobicContact CZ-CG 3.79Å; F291-Y671 HydrophobicContact CE2-CE1 4.01Å; F291-Y671 HydrophobicContact CZ-CE1 4.12Å; F291-L730 HydrophobicContact CD2-CD2 3.61Å; F291-L730 HydrophobicContact CE2-CB 4.39Å; F291-L730 HydrophobicContact CE2-CD2 3.61Å; F291-L730 HydrophobicContact CG-CD2 4.25Å; F291-L730 HydrophobicContact CZ-CD2 4.24Å; F291-I733 HydrophobicContact CB-CG2 3.83Å; F291-I733 HydrophobicContact CD2-CG2 4.26Å; F291-I734 HydrophobicContact CD2-CD1 3.73Å; F291-I734 HydrophobicContact CD2-CG1 4.2Å; F291-I734 HydrophobicContact CE2-CD1 3.6Å; F291-I734 HydrophobicContact CE2-CG1 3.9Å; F291-I734 HydrophobicContact CZ-CD1 4.44Å
292	K	87.9	Confident	89.2	Confident	138 Å²	138	53.1 Å²	53.1	60%	0.6	27%	0.272	S	S	*	.	H	α-helix	trans	-59.3	-48	179.8	-174.6	177.3	179	179.3	0	111.8	N288 T289 A290 F295 D296	N288-K292 PolarHBondContact O-N 3.45Å; N288-K292 VanDerWaalsContact O-N 3.12Å; T289-K292 PolarHBondContact O-N 3.3Å; A290-K292 VanDerWaalsContact C-N 3.35Å; A290-K292 PolarHBondContact O-N 2.99Å; K292-F295 PolarHBondContact O-N 3.49Å; K292-D296 PolarHBondContact O-N 2.65Å
293	H	89.6	Confident	89.6	Confident	130 Å²	130	56.4 Å²	56.4	60%	0.602	29%	0.286	S	S	*	.	H	α-helix	trans	-62.5	-44.9	178	-74.6	-62.8	0	0	0	112.5	T289 A290 F291 F295 R297	T289-H293 PolarHBondContact O-CD2 3.21Å; T289-H293 PolarHBondContact O-N 3.03Å; A290-H293 PolarHBondContact O-N 3.39Å; F291-H293 PolarHBondContact O-N 3.44Å; H293-F295 VanDerWaalsContact C-N 3.33Å; H293-R297 WeakPolarHBondContact O-CB 3.44Å; H293-R297 PolarHBondContact O-N 2.97Å
294	T	92.6	Very high	89.8	Confident	18 Å²	18	58.1 Å²	58.1	11%	0.11	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-36.6	178.5	-56.7	0	0	0	0	111.3	A290 F291 R297 L298 T726 Q729 L730	A290-T294 WeakPolarHBondContact O-CB 3.27Å; A290-T294 PolarHBondContact O-N 2.88Å; A290-T294 PolarHBondContact O-OG1 3.29Å; F291-T294 PolarHBondContact O-N 2.86Å; T294-R297 WeakPolarHBondContact O-CB 3.33Å; T294-R297 PolarHBondContact O-N 3.18Å; T294-L298 WeakPolarHBondContact O-CB 3.34Å; T294-L298 PolarHBondContact O-N 3.08Å; T294-T726 HydrophobicContact CG2-CG2 3.74Å; T294-T726 WeakPolarHBondContact O-CG2 3.46Å; T294-Q729 HydrophobicContact CG2-CB 3.9Å; T294-L730 HydrophobicContact CG2-CD2 3.7Å; T294-L730 HydrophobicContact CG2-CG 3.75Å
295	F	91.9	Very high	90.1	Very high	7 Å²	7	58.1 Å²	58.1	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-71.9	-39.7	178.8	-172.2	-105.4	0	0	0	112.4	F291 K292 H293 R297 L298 K299 I339 T343 Y671 L730	F291-F295 HydrophobicContact CE1-CB 4.28Å; F291-F295 HydrophobicContact CE1-CG 4.43Å; F291-F295 HydrophobicContact CZ-CD2 4.47Å; F291-F295 WeakPolarHBondContact O-CB 3.24Å; F291-F295 PolarHBondContact O-N 2.99Å; K292-F295 PolarHBondContact O-N 3.49Å; H293-F295 VanDerWaalsContact C-N 3.33Å; F295-R297 VanDerWaalsContact C-N 3.31Å; F295-R297 PolarHBondContact O-N 2.89Å; F295-L298 HydrophobicContact CD2-CD2 4.15Å; F295-L298 HydrophobicContact CE2-CD2 4.22Å; F295-L298 WeakPolarHBondContact O-CB 3.47Å; F295-L298 PolarHBondContact O-N 3.14Å; F295-K299 HydrophobicContact CE1-CD 4.49Å; F295-K299 PolarHBondContact O-N 3.39Å; F295-K299 VanDerWaalsContact O-N 3.07Å; F295-I339 HydrophobicContact CE1-CG2 4.33Å; F295-I339 HydrophobicContact CE2-CG2 3.82Å; F295-I339 HydrophobicContact CZ-CG2 3.42Å; F295-I339 VanDerWaalsContact CZ-CG2 3.42Å; F295-T343 HydrophobicContact CE2-CG2 3.93Å; F295-T343 HydrophobicContact CZ-CG2 4.19Å; F295-Y671 HydrophobicContact CE2-CD1 4.36Å; F295-L730 HydrophobicContact CB-CD2 4.07Å; F295-L730 HydrophobicContact CD2-CD1 4.12Å
296	D	89.9	Confident	90.4	Very high	69 Å²	69	57.5 Å²	57.5	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-66.6	-36.1	173.8	-72.9	-28.1	0	0	0	111.5	K292 K299 V300	K292-D296 PolarHBondContact O-N 2.65Å; D296-K299 WeakPolarHBondContact O-CB 3.48Å; D296-K299 PolarHBondContact O-N 3.06Å; D296-K299 IonicContact OD1-NZ 2.89Å; D296-K299 PolarHBondContact OD1-NZ 2.7Å; D296-V300 PolarHBondContact O-N 2.95Å
297	R	91.7	Very high	90.6	Very high	118 Å²	118	59.3 Å²	59.3	45%	0.445	29%	0.291	S	S	.	.	H	α-helix	trans	-62	-43.6	169.7	-179.9	177.4	174	-174	-7.4	111.9	H293 T294 F295 K299 V300 E301	H293-R297 WeakPolarHBondContact O-CB 3.44Å; H293-R297 PolarHBondContact O-N 2.97Å; T294-R297 WeakPolarHBondContact O-CB 3.33Å; T294-R297 PolarHBondContact O-N 3.18Å; F295-R297 VanDerWaalsContact C-N 3.31Å; F295-R297 PolarHBondContact O-N 2.89Å; R297-K299 VanDerWaalsContact C-N 3.28Å; R297-K299 PolarHBondContact O-N 2.85Å; R297-V300 PolarHBondContact O-N 2.84Å; R297-E301 HydrophobicContact CG-CG 4.25Å; R297-E301 IonicContact CZ-OE1 2.83Å; R297-E301 VanDerWaalsContact CZ-OE1 3.26Å; R297-E301 IonicContact NE-OE1 2.72Å; R297-E301 PolarHBondContact NE-OE1 3.49Å; R297-E301 IonicContact NE-OE2 3.65Å; R297-E301 IonicContact NH2-OE1 3.53Å; R297-E301 PolarHBondContact NH2-OE1 3.38Å; R297-E301 WeakPolarHBondContact O-CG 3.48Å; R297-E301 PolarHBondContact O-N 3.37Å
298	L	92.9	Very high	90.5	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-55.8	-42.9	176.1	-178.7	70.4	0	0	0	111.2	T294 F295 V300 E301 F302 I339 V723 T726 F727 L730	T294-L298 WeakPolarHBondContact O-CB 3.34Å; T294-L298 PolarHBondContact O-N 3.08Å; F295-L298 HydrophobicContact CD2-CD2 4.15Å; F295-L298 HydrophobicContact CE2-CD2 4.22Å; F295-L298 WeakPolarHBondContact O-CB 3.47Å; F295-L298 PolarHBondContact O-N 3.14Å; L298-V300 VanDerWaalsContact C-N 3.32Å; L298-V300 PolarHBondContact O-N 3.32Å; L298-E301 PolarHBondContact O-N 3.12Å; L298-F302 WeakPolarHBondContact O-CB 3.31Å; L298-F302 PolarHBondContact O-N 3.36Å; L298-I339 HydrophobicContact CD2-CD1 4.15Å; L298-I339 HydrophobicContact CD2-CG1 4.46Å; L298-I339 HydrophobicContact CG-CD1 3.87Å; L298-V723 HydrophobicContact CD1-CG1 4.32Å; L298-T726 HydrophobicContact CB-CG2 3.64Å; L298-T726 HydrophobicContact CD1-CG2 3.87Å; L298-T726 HydrophobicContact CG-CG2 4.34Å; L298-F727 HydrophobicContact CD1-CD1 4.05Å; L298-F727 HydrophobicContact CD1-CD2 4.28Å; L298-F727 HydrophobicContact CD1-CE1 3.83Å; L298-F727 HydrophobicContact CD1-CE2 4.11Å; L298-F727 HydrophobicContact CD1-CG 4.24Å; L298-F727 HydrophobicContact CD1-CZ 3.85Å; L298-F727 HydrophobicContact CD2-CD1 3.91Å; L298-F727 HydrophobicContact CD2-CE1 3.39Å; L298-F727 HydrophobicContact CD2-CZ 4.01Å; L298-F727 HydrophobicContact CG-CE1 4.2Å; L298-F727 HydrophobicContact CG-CZ 4.43Å; L298-L730 HydrophobicContact CB-CD1 4.3Å; L298-L730 HydrophobicContact CD2-CD1 3.55Å; L298-L730 HydrophobicContact CG-CD1 4.38Å
299	K	90.8	Very high	90.6	Very high	72 Å²	72	57.7 Å²	57.7	31%	0.313	28%	0.28	S	S	.	.	H	α-helix	trans	-54.4	-48.2	178	-69.6	172.9	-171	156.7	0	112.6	F295 D296 R297 Q303 I339	F295-K299 HydrophobicContact CE1-CD 4.49Å; F295-K299 PolarHBondContact O-N 3.39Å; F295-K299 VanDerWaalsContact O-N 3.07Å; D296-K299 WeakPolarHBondContact O-CB 3.48Å; D296-K299 PolarHBondContact O-N 3.06Å; D296-K299 IonicContact OD1-NZ 2.89Å; D296-K299 PolarHBondContact OD1-NZ 2.7Å; R297-K299 VanDerWaalsContact C-N 3.28Å; R297-K299 PolarHBondContact O-N 2.85Å; K299-Q303 WeakPolarHBondContact O-CB 3.35Å; K299-Q303 PolarHBondContact O-N 3.34Å; K299-I339 VanDerWaalsContact CA-CD1 3.46Å; K299-I339 HydrophobicContact CB-CD1 4.35Å; K299-I339 HydrophobicContact CG-CD1 4.16Å; K299-I339 HydrophobicContact CG-CG2 4.28Å
300	V	91.2	Very high	90.5	Very high	94 Å²	94	55.9 Å²	55.9	57%	0.57	27%	0.268	S	S	*	.	H	α-helix	trans	-68.2	-47.1	-179.1	179.4	0	0	0	0	111	D296 R297 L298 T304	D296-V300 PolarHBondContact O-N 2.95Å; R297-V300 PolarHBondContact O-N 2.84Å; L298-V300 VanDerWaalsContact C-N 3.32Å; L298-V300 PolarHBondContact O-N 3.32Å; V300-T304 WeakPolarHBondContact O-CB 3.32Å; V300-T304 PolarHBondContact O-N 3.22Å; V300-T304 PolarHBondContact O-OG1 3.2Å
301	E	92.9	Very high	90.2	Very high	25 Å²	25	58.8 Å²	58.8	12%	0.117	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-41.9	-178.6	-71.6	179.7	160.4	0	0	111.6	R297 L298 T304 W305 V723 T726	R297-E301 HydrophobicContact CG-CG 4.25Å; R297-E301 IonicContact CZ-OE1 2.83Å; R297-E301 VanDerWaalsContact CZ-OE1 3.26Å; R297-E301 IonicContact NE-OE1 2.72Å; R297-E301 PolarHBondContact NE-OE1 3.49Å; R297-E301 IonicContact NE-OE2 3.65Å; R297-E301 IonicContact NH2-OE1 3.53Å; R297-E301 PolarHBondContact NH2-OE1 3.38Å; R297-E301 WeakPolarHBondContact O-CG 3.48Å; R297-E301 PolarHBondContact O-N 3.37Å; L298-E301 PolarHBondContact O-N 3.12Å; E301-T304 PolarHBondContact O-N 3.07Å; E301-W305 WeakPolarHBondContact O-CB 3.42Å; E301-W305 PolarHBondContact O-N 3.41Å; E301-V723 HydrophobicContact CB-CG2 4.1Å; E301-T726 WeakPolarHBondContact OE2-CB 3.21Å; E301-T726 PolarHBondContact OE2-OG1 2.66Å
302	F	92.9	Very high	89.7	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-68	-44	178.3	-172.6	-92.1	0	0	0	112.4	L298 T304 W305 L306 V337 I339 L672 M692 V723 F727	L298-F302 WeakPolarHBondContact O-CB 3.31Å; L298-F302 PolarHBondContact O-N 3.36Å; F302-T304 VanDerWaalsContact C-N 3.29Å; F302-T304 PolarHBondContact O-N 2.96Å; F302-W305 AromaticContact CD2-CE3 3.99Å; F302-W305 HydrophobicContact CD2-CE3 3.99Å; F302-W305 HydrophobicContact CD2-CZ3 4.18Å; F302-W305 AromaticContact CE2-CE3 3.85Å; F302-W305 HydrophobicContact CE2-CE3 3.85Å; F302-W305 AromaticContact CE2-CZ3 3.56Å; F302-W305 HydrophobicContact CE2-CZ3 3.56Å; F302-W305 HydrophobicContact CZ-CE3 4.31Å; F302-W305 AromaticContact CZ-CZ3 3.9Å; F302-W305 HydrophobicContact CZ-CZ3 3.9Å; F302-W305 PolarHBondContact O-N 3.09Å; F302-L306 HydrophobicContact CE1-CD2 4.33Å; F302-L306 VanDerWaalsContact O-CB 3.31Å; F302-L306 WeakPolarHBondContact O-CB 3.29Å; F302-L306 PolarHBondContact O-N 2.85Å; F302-V337 HydrophobicContact CZ-CG1 4.07Å; F302-V337 HydrophobicContact CZ-CG2 4.02Å; F302-I339 HydrophobicContact CB-CD1 3.33Å; F302-I339 HydrophobicContact CB-CG1 4.13Å; F302-I339 HydrophobicContact CD1-CD1 3.79Å; F302-I339 HydrophobicContact CD1-CG1 3.75Å; F302-I339 HydrophobicContact CD2-CD1 4.42Å; F302-I339 HydrophobicContact CD2-CG1 4.38Å; F302-I339 HydrophobicContact CE1-CG1 4.26Å; F302-I339 HydrophobicContact CG-CD1 3.6Å; F302-I339 HydrophobicContact CG-CG1 3.82Å; F302-L672 HydrophobicContact CD2-CD2 4.36Å; F302-L672 HydrophobicContact CE1-CD2 4.48Å; F302-L672 HydrophobicContact CE2-CD2 3.67Å; F302-L672 HydrophobicContact CZ-CD2 3.74Å; F302-M692 HydrophobicContact CE2-SD 3.86Å; F302-V723 HydrophobicContact CD2-CG1 3.94Å; F302-F727 HydrophobicContact CD2-CE2 4.44Å; F302-F727 HydrophobicContact CD2-CZ 4.31Å
303	Q	90.5	Very high	89	Confident	142 Å²	142	54.4 Å²	54.4	66%	0.664	27%	0.265	S	S	*	.	H	α-helix	trans	-61.9	-39.9	173.8	-91.6	-172.4	-34.1	0	0	111.8	K299 L306 R307	K299-Q303 WeakPolarHBondContact O-CB 3.35Å; K299-Q303 PolarHBondContact O-N 3.34Å; Q303-L306 PolarHBondContact O-N 3.09Å; Q303-R307 VanDerWaalsContact O-CB 3.29Å; Q303-R307 WeakPolarHBondContact O-CB 3.36Å; Q303-R307 PolarHBondContact O-N 3.26Å
304	T	90.9	Very high	88	Confident	60 Å²	60	49 Å²	49	37%	0.368	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-46.3	177.1	-59.5	0	0	0	0	110.8	V300 E301 F302 R307 L308	V300-T304 WeakPolarHBondContact O-CB 3.32Å; V300-T304 PolarHBondContact O-N 3.22Å; V300-T304 PolarHBondContact O-OG1 3.2Å; E301-T304 PolarHBondContact O-N 3.07Å; F302-T304 VanDerWaalsContact C-N 3.29Å; F302-T304 PolarHBondContact O-N 2.96Å; T304-R307 PolarHBondContact O-N 2.92Å; T304-L308 WeakPolarHBondContact O-CG 3.5Å; T304-L308 PolarHBondContact O-N 3.23Å; T304-L308 VanDerWaalsContact O-N 3.1Å
305	W	93.2	Very high	86.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-51	175.1	172.3	74.5	0	0	0	111.3	E301 F302 R307 L308 V309 F333 M692 W693 W696 A719 T720 V723	E301-W305 WeakPolarHBondContact O-CB 3.42Å; E301-W305 PolarHBondContact O-N 3.41Å; F302-W305 AromaticContact CD2-CE3 3.99Å; F302-W305 HydrophobicContact CD2-CE3 3.99Å; F302-W305 HydrophobicContact CD2-CZ3 4.18Å; F302-W305 AromaticContact CE2-CE3 3.85Å; F302-W305 HydrophobicContact CE2-CE3 3.85Å; F302-W305 AromaticContact CE2-CZ3 3.56Å; F302-W305 HydrophobicContact CE2-CZ3 3.56Å; F302-W305 HydrophobicContact CZ-CE3 4.31Å; F302-W305 AromaticContact CZ-CZ3 3.9Å; F302-W305 HydrophobicContact CZ-CZ3 3.9Å; F302-W305 PolarHBondContact O-N 3.09Å; W305-R307 VanDerWaalsContact C-N 3.29Å; W305-R307 PolarHBondContact O-N 3.19Å; W305-L308 WeakPolarHBondContact O-CB 3.49Å; W305-L308 PolarHBondContact O-N 3.12Å; W305-V309 HydrophobicContact CD2-CG2 4.17Å; W305-V309 HydrophobicContact CZ2-CG2 4.12Å; W305-V309 WeakPolarHBondContact O-CG2 3.26Å; W305-V309 PolarHBondContact O-N 3.03Å; W305-F333 AromaticContact CH2-CD1 3.98Å; W305-F333 HydrophobicContact CH2-CD1 3.98Å; W305-F333 AromaticContact CH2-CE1 3.8Å; W305-F333 HydrophobicContact CH2-CE1 3.8Å; W305-M692 HydrophobicContact CH2-CE 4.24Å; W305-M692 HydrophobicContact CH2-SD 4.2Å; W305-M692 HydrophobicContact CZ3-SD 4.29Å; W305-W693 HydrophobicContact CZ2-CZ3 4.1Å; W305-W696 HydrophobicContact CH2-CD2 4.47Å; W305-W696 HydrophobicContact CH2-CE3 4.28Å; W305-W696 AromaticContact CZ2-CD2 3.57Å; W305-W696 HydrophobicContact CZ2-CD2 3.57Å; W305-W696 AromaticContact CZ2-CE3 3.6Å; W305-W696 HydrophobicContact CZ2-CE3 3.6Å; W305-W696 HydrophobicContact CZ2-CG 4Å; W305-W696 HydrophobicContact CZ2-CH2 4.44Å; W305-W696 HydrophobicContact CZ2-CZ2 4.42Å; W305-W696 HydrophobicContact CZ2-CZ3 4.06Å; W305-W696 AromaticContact NE1-CZ2 3.97Å; W305-A719 HydrophobicContact CB-CB 4.25Å; W305-T720 PolarHBondContact NE1-OG1 3.24Å; W305-V723 HydrophobicContact CB-CG2 3.77Å; W305-V723 HydrophobicContact CG-CG2 4.16Å
306	L	90.7	Very high	84.8	Confident	21 Å²	21	58.4 Å²	58.4	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-37.9	-179.9	-163.5	69.1	0	0	0	112.2	F302 Q303 L308 V309 N310 F333 V337	F302-L306 HydrophobicContact CE1-CD2 4.33Å; F302-L306 VanDerWaalsContact O-CB 3.31Å; F302-L306 WeakPolarHBondContact O-CB 3.29Å; F302-L306 PolarHBondContact O-N 2.85Å; Q303-L306 PolarHBondContact O-N 3.09Å; L306-L308 VanDerWaalsContact C-N 3.35Å; L306-L308 PolarHBondContact O-N 3.48Å; L306-V309 PolarHBondContact O-N 3.42Å; L306-N310 WeakPolarHBondContact O-CB 3.31Å; L306-N310 VanDerWaalsContact O-CG 3.29Å; L306-N310 PolarHBondContact O-N 2.03Å; L306-N310 PolarHBondContact O-ND2 2.95Å; L306-F333 VanDerWaalsContact CD1-O 3.27Å; L306-F333 WeakPolarHBondContact CD1-O 3.4Å; L306-V337 HydrophobicContact CD1-CG1 3.62Å
307	R	88.8	Confident	83.1	Confident	165 Å²	165	62.5 Å²	62.5	62%	0.623	31%	0.313	S	S	*	.	H	α-helix	trans	-62.4	-42.1	174.6	-173.6	-179.6	69.3	125.9	0.9	111.8	Q303 T304 W305 N310 T311	Q303-R307 VanDerWaalsContact O-CB 3.29Å; Q303-R307 WeakPolarHBondContact O-CB 3.36Å; Q303-R307 PolarHBondContact O-N 3.26Å; T304-R307 PolarHBondContact O-N 2.92Å; W305-R307 VanDerWaalsContact C-N 3.29Å; W305-R307 PolarHBondContact O-N 3.19Å; R307-N310 PolarHBondContact O-N 2.92Å; R307-T311 WeakPolarHBondContact O-CB 2.94Å; R307-T311 PolarHBondContact O-N 3.41Å; R307-T311 PolarHBondContact O-OG1 3.39Å
308	L	89.4	Confident	81.3	Confident	36 Å²	36	60.9 Å²	60.9	19%	0.188	31%	0.313	C	S	.	.	H	α-helix	trans	-63.4	-47.9	174.1	-69.6	170.5	0	0	0	110.3	T304 W305 L306 N310 T311 E312 L716 A719	T304-L308 WeakPolarHBondContact O-CG 3.5Å; T304-L308 PolarHBondContact O-N 3.23Å; T304-L308 VanDerWaalsContact O-N 3.1Å; W305-L308 WeakPolarHBondContact O-CB 3.49Å; W305-L308 PolarHBondContact O-N 3.12Å; L306-L308 VanDerWaalsContact C-N 3.35Å; L306-L308 PolarHBondContact O-N 3.48Å; L308-N310 VanDerWaalsContact C-N 3.26Å; L308-N310 PolarHBondContact O-N 3.43Å; L308-T311 PolarHBondContact O-N 2.8Å; L308-E312 VanDerWaalsContact O-CB 3.26Å; L308-E312 WeakPolarHBondContact O-CB 3.33Å; L308-E312 WeakPolarHBondContact O-CG 2.81Å; L308-E312 PolarHBondContact O-N 2.96Å; L308-L716 HydrophobicContact CB-CD1 4.15Å; L308-A719 HydrophobicContact CD1-CB 3.67Å
309	V	88.1	Confident	79.2	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-53.8	-44.1	175.7	175.9	0	0	0	0	111.8	W305 L306 S313 F333 W696 Y699 L716	W305-V309 HydrophobicContact CD2-CG2 4.17Å; W305-V309 HydrophobicContact CZ2-CG2 4.12Å; W305-V309 WeakPolarHBondContact O-CG2 3.26Å; W305-V309 PolarHBondContact O-N 3.03Å; L306-V309 PolarHBondContact O-N 3.42Å; V309-S313 VanDerWaalsContact O-CB 3.26Å; V309-S313 WeakPolarHBondContact O-CB 3.3Å; V309-S313 PolarHBondContact O-N 3.44Å; V309-F333 HydrophobicContact CG1-CB 3.91Å; V309-F333 HydrophobicContact CG1-CG 4.44Å; V309-W696 HydrophobicContact CB-CZ3 4.28Å; V309-W696 HydrophobicContact CG1-CH2 4.5Å; V309-W696 HydrophobicContact CG1-CZ3 3.81Å; V309-W696 HydrophobicContact CG2-CE3 4.36Å; V309-W696 HydrophobicContact CG2-CH2 3.54Å; V309-W696 HydrophobicContact CG2-CZ3 3.42Å; V309-W696 VanDerWaalsContact CG2-CZ3 3.42Å; V309-Y699 HydrophobicContact CG1-CE1 4Å; V309-L716 HydrophobicContact CG2-CD1 3.9Å
310	N	84	Confident	77.5	Confident	32 Å²	32	75.7 Å²	75.7	17%	0.171	38%	0.376	C	S	.	.	H	α-helix	trans	-75.7	-34.6	-177.4	-72.2	-18.9	0	0	0	113.8	L306 R307 L308 E312 S313 F333 Y334	L306-N310 WeakPolarHBondContact O-CB 3.31Å; L306-N310 VanDerWaalsContact O-CG 3.29Å; L306-N310 PolarHBondContact O-N 2.03Å; L306-N310 PolarHBondContact O-ND2 2.95Å; R307-N310 PolarHBondContact O-N 2.92Å; L308-N310 VanDerWaalsContact C-N 3.26Å; L308-N310 PolarHBondContact O-N 3.43Å; N310-E312 VanDerWaalsContact C-N 3.32Å; N310-S313 PolarHBondContact O-N 3.12Å; N310-F333 PolarHBondContact OD1-O 3.37Å; N310-Y334 HydrophobicContact CB-CD2 4.25Å; N310-Y334 HydrophobicContact CB-CE2 4.27Å; N310-Y334 WeakPolarHBondContact OD1-CA 3.32Å
311	T	83.5	Confident	76.1	Confident	99 Å²	99	73.3 Å²	73.3	61%	0.607	36%	0.364	S	S	*	.	H	α-helix	trans	-70	-35.7	177.1	-59	0	0	0	0	111	R307 L308 S313	R307-T311 WeakPolarHBondContact O-CB 2.94Å; R307-T311 PolarHBondContact O-N 3.41Å; R307-T311 PolarHBondContact O-OG1 3.39Å; L308-T311 PolarHBondContact O-N 2.8Å; T311-S313 VanDerWaalsContact C-N 3.34Å
312	E	79.5	Confident	74.9	Confident	44 Å²	44	72.8 Å²	72.8	21%	0.206	36%	0.363	C	S	.	.	S	Bend	trans	-88.5	-4.5	-179.5	-60.7	-57.2	167	0	0	112.7	L308 N310 L704 L708 Q712	L308-E312 VanDerWaalsContact O-CB 3.26Å; L308-E312 WeakPolarHBondContact O-CB 3.33Å; L308-E312 WeakPolarHBondContact O-CG 2.81Å; L308-E312 PolarHBondContact O-N 2.96Å; N310-E312 VanDerWaalsContact C-N 3.32Å; E312-L704 WeakPolarHBondContact O-CD2 3.38Å; E312-L708 HydrophobicContact CB-CD1 4.43Å; E312-L708 HydrophobicContact CB-CD2 3.7Å; E312-L708 HydrophobicContact CG-CD2 4.2Å; E312-L708 WeakPolarHBondContact OE2-CD2 3.39Å; E312-Q712 VanDerWaalsContact CD-NE2 3.3Å; E312-Q712 WeakPolarHBondContact OE1-CG 3.27Å; E312-Q712 PolarHBondContact OE1-NE2 3.1Å; E312-Q712 VanDerWaalsContact OE2-CD 3.29Å; E312-Q712 PolarHBondContact OE2-NE2 3.43Å
313	S	74.9	Confident	73.8	Confident	7 Å²	7	77.9 Å²	77.9	5%	0.049	40%	0.395	C	S	.	.	S	Bend	trans	-76.6	146.3	176.5	176.4	0	0	0	0	111.4	V309 N310 T311 N315 Y699	V309-S313 VanDerWaalsContact O-CB 3.26Å; V309-S313 WeakPolarHBondContact O-CB 3.3Å; V309-S313 PolarHBondContact O-N 3.44Å; N310-S313 PolarHBondContact O-N 3.12Å; T311-S313 VanDerWaalsContact C-N 3.34Å; S313-N315 PolarHBondContact O-N 3.46Å; S313-Y699 PolarHBondContact OG-OH 3.15Å; S313-Y699 VanDerWaalsContact OG-OH 3.1Å
314	P	66.9	Low	73.1	Confident	16 Å²	16	74 Å²	74	10%	0.104	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-56.9	135.3	174.4	17.2	-27.9	0	0	0	113	R330	P314-R330 VanDerWaalsContact O-CZ 3.23Å; P314-R330 PolarHBondContact O-NH1 3.21Å; P314-R330 VanDerWaalsContact O-NH1 3.12Å
315	N	64.1	Low	72.4	Confident	128 Å²	128	75.9 Å²	75.9	68%	0.684	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-68.1	156.9	-177.5	-87	-28.2	0	0	0	113.3	S313 N317 D318	S313-N315 PolarHBondContact O-N 3.46Å; N315-N317 PolarHBondContact O-N 2.95Å; N315-N317 VanDerWaalsContact O-N 3.13Å; N315-D318 WeakPolarHBondContact O-CB 3.37Å; N315-D318 PolarHBondContact O-N 2.69Å; N315-D318 VanDerWaalsContact O-N 3.11Å
316	N	55.1	Low	71.6	Confident	94 Å²	94	76.8 Å²	76.8	50%	0.503	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-27.3	177.5	-102.9	1.3	0	0	0	114.3	D318 Y319 R330	N316-D318 PolarHBondContact O-N 3.42Å; N316-Y319 WeakPolarHBondContact O-CD2 3.28Å; N316-Y319 VanDerWaalsContact O-CE2 3.24Å; N316-Y319 WeakPolarHBondContact O-CE2 3.28Å; N316-R330 PolarHBondContact OD1-NH2 3.06Å
317	N	52.5	Low	71	Confident	156 Å²	156	80 Å²	80	83%	0.834	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.3	-177.5	-65.4	-8.1	0	0	0	113.3	N315 Y319	N315-N317 PolarHBondContact O-N 2.95Å; N315-N317 VanDerWaalsContact O-N 3.13Å; N317-Y319 PolarHBondContact O-N 2.91Å
318	D	55.1	Low	70.5	Confident	83 Å²	83	77.8 Å²	77.8	44%	0.444	42%	0.417	S	S	.	.			trans	-93	41.3	-179.9	-143.3	37.5	0	0	0	111.1	N315 N316 Q320 S321	N315-D318 WeakPolarHBondContact O-CB 3.37Å; N315-D318 PolarHBondContact O-N 2.69Å; N315-D318 VanDerWaalsContact O-N 3.11Å; N316-D318 PolarHBondContact O-N 3.42Å; D318-Q320 PolarHBondContact O-N 3.09Å; D318-S321 PolarHBondContact O-N 3.06Å; D318-S321 PolarHBondContact O-OG 3.4Å; D318-S321 WeakPolarHBondContact OD2-CB 3.5Å; D318-S321 PolarHBondContact OD2-OG 3.13Å
319	Y	47.8	Very low	70.1	Confident	191 Å²	191	76.2 Å²	76.2	75%	0.749	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-21.9	-171.5	-103.8	-82.8	0	0	0	114.4	N316 N317	N316-Y319 WeakPolarHBondContact O-CD2 3.28Å; N316-Y319 VanDerWaalsContact O-CE2 3.24Å; N316-Y319 WeakPolarHBondContact O-CE2 3.28Å; N317-Y319 PolarHBondContact O-N 2.91Å
320	Q	56.5	Low	69.8	Low	192 Å²	192	77.4 Å²	77.4	90%	0.897	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-18.6	177.4	-83.1	175.4	-14.7	0	0	114.2	D318	D318-Q320 PolarHBondContact O-N 3.09Å
321	S	61.1	Low	69.5	Low	44 Å²	44	77.3 Å²	77.3	31%	0.308	42%	0.415	S	S	.	.	S	Bend	trans	-95.7	-9.7	-169.2	81.9	0	0	0	0	115.5	D318	D318-S321 PolarHBondContact O-N 3.06Å; D318-S321 PolarHBondContact O-OG 3.4Å; D318-S321 WeakPolarHBondContact OD2-CB 3.5Å; D318-S321 PolarHBondContact OD2-OG 3.13Å
322	C	67.5	Low	69.4	Low	15 Å²	15	73.3 Å²	73.3	10%	0.101	39%	0.391	C	S	.	.			trans	-138.7	76.8	-174.2	-166.5	0	0	0	0	112.6	C326	C322-C326 VanDerWaalsContact CA-SG 3.54Å; C322-C326 HydrophobicContact CB-CB 4.08Å; C322-C326 WeakPolarHBondContact CB-SG 3.25Å; C322-C326 WeakPolarHBondContact SG-CB 3.5Å; C322-C326 PolarHBondContact SG-O 3.16Å; C322-C326 VanDerWaalsContact SG-O 3.39Å; C322-C326 CovalentContact SG-SG 2.05Å; C322-C326 PolarHBondContact SG-SG 2.92Å
323	T	70.1	Confident	69.7	Low	110 Å²	110	71.2 Å²	71.2	68%	0.675	38%	0.381	S	S	*	.			trans	-107.5	161.3	174.3	56.3	0	0	0	0	111.5	H325	T323-H325 PolarHBondContact O-N 3.46Å
324	G	74.9	Confident	69.9	Low	61 Å²	61	75.6 Å²	75.6	63%	0.629	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	-130.6	180	0	0	0	0	0	113.3	C326 N327 E328	G324-C326 PolarHBondContact O-N 3Å; G324-N327 WeakPolarHBondContact O-CB 3.33Å; G324-N327 PolarHBondContact O-N 3.36Å; G324-E328 PolarHBondContact O-N 2.93Å
325	H	76.1	Confident	70	Confident	99 Å²	99	80 Å²	80	46%	0.458	42%	0.42	S	S	.	.	H	α-helix	trans	-61.5	-26.5	-175.4	-164.8	54.3	0	0	0	113.5	T323 E328 L329	T323-H325 PolarHBondContact O-N 3.46Å; H325-E328 IonicContact CE1-OE2 3.88Å; H325-E328 IonicContact ND1-OE2 3.18Å; H325-E328 PolarHBondContact ND1-OE2 2.81Å; H325-E328 PolarHBondContact O-N 2.85Å; H325-L329 WeakPolarHBondContact O-CG 3.49Å; H325-L329 PolarHBondContact O-N 3.17Å
326	C	77.4	Confident	70.8	Confident	20 Å²	20	75.3 Å²	75.3	14%	0.135	40%	0.395	C	S	.	.	H	α-helix	trans	-61.7	-43.9	173.3	179.6	0	0	0	0	111.7	C322 G324 E328 L329 R330 I703	C322-C326 VanDerWaalsContact CA-SG 3.54Å; C322-C326 HydrophobicContact CB-CB 4.08Å; C322-C326 WeakPolarHBondContact CB-SG 3.25Å; C322-C326 WeakPolarHBondContact SG-CB 3.5Å; C322-C326 PolarHBondContact SG-O 3.16Å; C322-C326 VanDerWaalsContact SG-O 3.39Å; C322-C326 CovalentContact SG-SG 2.05Å; C322-C326 PolarHBondContact SG-SG 2.92Å; G324-C326 PolarHBondContact O-N 3Å; C326-E328 VanDerWaalsContact C-N 3.32Å; C326-E328 PolarHBondContact O-N 3.29Å; C326-L329 PolarHBondContact O-N 3.28Å; C326-R330 WeakPolarHBondContact O-CB 3.35Å; C326-R330 PolarHBondContact O-N 2.92Å; C326-I703 HydrophobicContact CB-CD1 3.97Å; C326-I703 HydrophobicContact CB-CG1 4.46Å
327	N	77.5	Confident	72.3	Confident	89 Å²	89	70.9 Å²	70.9	48%	0.476	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-37.4	-179.5	-170.4	38.5	0	0	0	111.4	G324 S331	G324-N327 WeakPolarHBondContact O-CB 3.33Å; G324-N327 PolarHBondContact O-N 3.36Å; N327-S331 VanDerWaalsContact O-CB 3.23Å; N327-S331 WeakPolarHBondContact O-CB 3Å; N327-S331 PolarHBondContact O-N 3.47Å; N327-S331 PolarHBondContact O-OG 3.44Å
328	E	77.9	Confident	73.9	Confident	117 Å²	117	65.5 Å²	65.5	55%	0.547	35%	0.346	S	S	.	.	H	α-helix	trans	-65.1	-48.9	175.8	-170.5	-174.3	-176	0	0	112	G324 H325 C326 S331 T332	G324-E328 PolarHBondContact O-N 2.93Å; H325-E328 IonicContact CE1-OE2 3.88Å; H325-E328 IonicContact ND1-OE2 3.18Å; H325-E328 PolarHBondContact ND1-OE2 2.81Å; H325-E328 PolarHBondContact O-N 2.85Å; C326-E328 VanDerWaalsContact C-N 3.32Å; C326-E328 PolarHBondContact O-N 3.29Å; E328-S331 WeakPolarHBondContact CA-OG 3.44Å; E328-S331 PolarHBondContact O-OG 2.91Å; E328-T332 WeakPolarHBondContact O-CB 3.48Å; E328-T332 PolarHBondContact O-N 3.49Å; E328-T332 PolarHBondContact O-OG1 3.16Å
329	L	81.9	Confident	75.4	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-65.9	-40.9	177.5	-68.9	170.7	0	0	0	112	H325 C326 T332 F333 L695 I698 Y699 I703	H325-L329 WeakPolarHBondContact O-CG 3.49Å; H325-L329 PolarHBondContact O-N 3.17Å; C326-L329 PolarHBondContact O-N 3.28Å; L329-T332 WeakPolarHBondContact O-CB 3.29Å; L329-T332 PolarHBondContact O-N 2.84Å; L329-F333 VanDerWaalsContact O-CD2 3.26Å; L329-F333 WeakPolarHBondContact O-CD2 3.14Å; L329-F333 PolarHBondContact O-N 3.15Å; L329-L695 HydrophobicContact CD2-CB 4.25Å; L329-L695 HydrophobicContact CD2-CD2 3.7Å; L329-I698 HydrophobicContact CD1-CB 4.48Å; L329-I698 HydrophobicContact CD1-CG2 3.61Å; L329-Y699 HydrophobicContact CB-CD2 3.59Å; L329-Y699 HydrophobicContact CB-CE2 4.33Å; L329-Y699 HydrophobicContact CB-CG 4.37Å; L329-I703 HydrophobicContact CB-CD1 4.32Å; L329-I703 HydrophobicContact CD1-CD1 3.95Å
330	R	81.2	Confident	77.1	Confident	25 Å²	25	56.7 Å²	56.7	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-63	-52.3	176.3	179.4	-177.2	149.9	-165.8	-12.7	110.6	P314 N316 C326 T332 F333 Y334 Y699	P314-R330 VanDerWaalsContact O-CZ 3.23Å; P314-R330 PolarHBondContact O-NH1 3.21Å; P314-R330 VanDerWaalsContact O-NH1 3.12Å; N316-R330 PolarHBondContact OD1-NH2 3.06Å; C326-R330 WeakPolarHBondContact O-CB 3.35Å; C326-R330 PolarHBondContact O-N 2.92Å; R330-T332 PolarHBondContact O-N 3.21Å; R330-F333 PolarHBondContact O-N 2.79Å; R330-F333 VanDerWaalsContact O-N 3.13Å; R330-Y334 WeakPolarHBondContact O-CB 3.42Å; R330-Y334 PolarHBondContact O-N 2.9Å; R330-Y699 HydrophobicContact CB-CE2 3.98Å
331	S	77.8	Confident	77.7	Confident	29 Å²	29	51.9 Å²	51.9	20%	0.203	29%	0.292	C	S	.	.	H	α-helix	trans	-58.3	-36.1	179.7	56.1	0	0	0	0	111.9	N327 E328 F333 Y334 N336	N327-S331 VanDerWaalsContact O-CB 3.23Å; N327-S331 WeakPolarHBondContact O-CB 3Å; N327-S331 PolarHBondContact O-N 3.47Å; N327-S331 PolarHBondContact O-OG 3.44Å; E328-S331 WeakPolarHBondContact CA-OG 3.44Å; E328-S331 PolarHBondContact O-OG 2.91Å; S331-F333 PolarHBondContact O-N 3.46Å; S331-Y334 PolarHBondContact O-N 3.21Å; S331-N336 WeakPolarHBondContact O-CB 3.46Å; S331-N336 PolarHBondContact O-ND2 2.83Å
332	T	82.3	Confident	78.2	Confident	16 Å²	16	53.7 Å²	53.7	10%	0.098	30%	0.298	C	S	.	.	I	π-helix	trans	-56	-46.3	173.9	-66.7	0	0	0	0	113.4	E328 L329 R330 N336 V337 I674 W687	E328-T332 WeakPolarHBondContact O-CB 3.48Å; E328-T332 PolarHBondContact O-N 3.49Å; E328-T332 PolarHBondContact O-OG1 3.16Å; L329-T332 WeakPolarHBondContact O-CB 3.29Å; L329-T332 PolarHBondContact O-N 2.84Å; R330-T332 PolarHBondContact O-N 3.21Å; T332-N336 WeakPolarHBondContact O-CB 3.47Å; T332-V337 PolarHBondContact O-N 3.2Å; T332-V337 VanDerWaalsContact O-N 3.15Å; T332-I674 HydrophobicContact CG2-CD1 3.77Å; T332-W687 HydrophobicContact CG2-CH2 3.35Å; T332-W687 HydrophobicContact CG2-CZ2 4.19Å; T332-W687 HydrophobicContact CG2-CZ3 3.98Å
333	F	84.7	Confident	78.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.295	C	S	.	.	I	π-helix	trans	-87.4	-22.2	178.5	-66.8	-68.9	0	0	0	113.2	W305 L306 V309 N310 L329 R330 S331 N335 V337 M692 L695 W696 Y699	W305-F333 AromaticContact CH2-CD1 3.98Å; W305-F333 HydrophobicContact CH2-CD1 3.98Å; W305-F333 AromaticContact CH2-CE1 3.8Å; W305-F333 HydrophobicContact CH2-CE1 3.8Å; L306-F333 VanDerWaalsContact CD1-O 3.27Å; L306-F333 WeakPolarHBondContact CD1-O 3.4Å; V309-F333 HydrophobicContact CG1-CB 3.91Å; V309-F333 HydrophobicContact CG1-CG 4.44Å; N310-F333 PolarHBondContact OD1-O 3.37Å; L329-F333 VanDerWaalsContact O-CD2 3.26Å; L329-F333 WeakPolarHBondContact O-CD2 3.14Å; L329-F333 PolarHBondContact O-N 3.15Å; R330-F333 PolarHBondContact O-N 2.79Å; R330-F333 VanDerWaalsContact O-N 3.13Å; S331-F333 PolarHBondContact O-N 3.46Å; F333-N335 PolarHBondContact O-N 2.74Å; F333-V337 HydrophobicContact CD1-CG1 4.02Å; F333-M692 HydrophobicContact CE1-CG 4.27Å; F333-L695 HydrophobicContact CZ-CB 4.32Å; F333-W696 HydrophobicContact CE1-CB 4.33Å; F333-W696 HydrophobicContact CE1-CE3 4.35Å; F333-W696 HydrophobicContact CE2-CE3 4.38Å; F333-W696 HydrophobicContact CZ-CB 3.82Å; F333-W696 HydrophobicContact CZ-CE3 4.26Å; F333-Y699 AromaticContact CD2-CD1 3.81Å; F333-Y699 HydrophobicContact CD2-CD1 3.81Å; F333-Y699 HydrophobicContact CD2-CE1 4.35Å; F333-Y699 AromaticContact CD2-CG 3.91Å; F333-Y699 HydrophobicContact CD2-CG 3.91Å; F333-Y699 HydrophobicContact CE2-CD1 4.28Å; F333-Y699 HydrophobicContact CE2-CG 4.13Å
334	Y	79.1	Confident	78.9	Confident	98 Å²	98	54.7 Å²	54.7	38%	0.384	29%	0.292	S	S	.	.	I	π-helix	trans	-82.3	86.4	178.6	-159.1	-94	0	0	0	110.6	N310 R330 S331 N336	N310-Y334 HydrophobicContact CB-CD2 4.25Å; N310-Y334 HydrophobicContact CB-CE2 4.27Å; N310-Y334 WeakPolarHBondContact OD1-CA 3.32Å; R330-Y334 WeakPolarHBondContact O-CB 3.42Å; R330-Y334 PolarHBondContact O-N 2.9Å; S331-Y334 PolarHBondContact O-N 3.21Å; Y334-N336 PolarHBondContact O-N 2.74Å; Y334-N336 VanDerWaalsContact O-N 3.15Å
335	N	69.5	Low	79.1	Confident	110 Å²	110	52.8 Å²	52.8	59%	0.588	27%	0.267	S	S	*	.	I	π-helix	trans	67.9	-2.6	176.1	-60	-26.5	0	0	0	117	F333	F333-N335 PolarHBondContact O-N 2.74Å
336	N	80.9	Confident	79	Confident	28 Å²	28	49.2 Å²	49.2	15%	0.15	25%	0.253	C	S	.	.	I	π-helix	trans	-87.1	-34.3	179.3	-71.4	-5.2	0	0	0	113.7	S331 T332 Y334 I674 Q675	S331-N336 WeakPolarHBondContact O-CB 3.46Å; S331-N336 PolarHBondContact O-ND2 2.83Å; T332-N336 WeakPolarHBondContact O-CB 3.47Å; Y334-N336 PolarHBondContact O-N 2.74Å; Y334-N336 VanDerWaalsContact O-N 3.15Å; N336-I674 HydrophobicContact CB-CG1 4.17Å; N336-I674 WeakPolarHBondContact O-CA 3.12Å; N336-Q675 WeakPolarHBondContact CB-O 3.33Å; N336-Q675 PolarHBondContact O-N 3.35Å
337	V	86.3	Confident	78.7	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	129.1	176.6	72.5	0	0	0	0	111.2	F302 L306 T332 F333 W687	F302-V337 HydrophobicContact CZ-CG1 4.07Å; F302-V337 HydrophobicContact CZ-CG2 4.02Å; L306-V337 HydrophobicContact CD1-CG1 3.62Å; T332-V337 PolarHBondContact O-N 3.2Å; T332-V337 VanDerWaalsContact O-N 3.15Å; F333-V337 HydrophobicContact CD1-CG1 4.02Å; V337-W687 HydrophobicContact CG2-CE3 4.01Å; V337-W687 HydrophobicContact CG2-CZ3 4.03Å
338	S	87	Confident	78.4	Confident	43 Å²	43	51.9 Å²	51.9	30%	0.301	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	158.2	179.7	53.3	0	0	0	0	111	R340 L672 S673	S338-R340 PolarHBondContact O-N 2.88Å; S338-L672 WeakPolarHBondContact O-CA 3.36Å; S338-S673 PolarHBondContact N-O 2.81Å; S338-S673 PolarHBondContact O-N 3.48Å; S338-S673 PolarHBondContact O-OG 3.47Å; S338-S673 PolarHBondContact OG-O 3.1Å; S338-S673 PolarHBondContact OG-OG 2.88Å
339	I	85.8	Confident	77.9	Confident	23 Å²	23	50.5 Å²	50.5	12%	0.118	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	128.9	165.2	-72.5	164.1	0	0	0	107.7	F295 L298 K299 F302 P341 L672	F295-I339 HydrophobicContact CE1-CG2 4.33Å; F295-I339 HydrophobicContact CE2-CG2 3.82Å; F295-I339 HydrophobicContact CZ-CG2 3.42Å; F295-I339 VanDerWaalsContact CZ-CG2 3.42Å; L298-I339 HydrophobicContact CD2-CD1 4.15Å; L298-I339 HydrophobicContact CD2-CG1 4.46Å; L298-I339 HydrophobicContact CG-CD1 3.87Å; K299-I339 VanDerWaalsContact CA-CD1 3.46Å; K299-I339 HydrophobicContact CB-CD1 4.35Å; K299-I339 HydrophobicContact CG-CD1 4.16Å; K299-I339 HydrophobicContact CG-CG2 4.28Å; F302-I339 HydrophobicContact CB-CD1 3.33Å; F302-I339 HydrophobicContact CB-CG1 4.13Å; F302-I339 HydrophobicContact CD1-CD1 3.79Å; F302-I339 HydrophobicContact CD1-CG1 3.75Å; F302-I339 HydrophobicContact CD2-CD1 4.42Å; F302-I339 HydrophobicContact CD2-CG1 4.38Å; F302-I339 HydrophobicContact CE1-CG1 4.26Å; F302-I339 HydrophobicContact CG-CD1 3.6Å; F302-I339 HydrophobicContact CG-CG1 3.82Å; I339-P341 VanDerWaalsContact O-CD 3.3Å; I339-P341 WeakPolarHBondContact O-CD 3.17Å; I339-P341 VanDerWaalsContact O-N 3.13Å; I339-L672 HydrophobicContact CG1-CD2 4.23Å
340	R	83.2	Confident	77.4	Confident	65 Å²	65	51.3 Å²	51.3	25%	0.245	26%	0.261	C	S	.	.			trans	-61.9	112.6	178.7	174.9	-176.3	-178.6	-166.1	-1.6	108.9	S338 D342 T343 Y671	S338-R340 PolarHBondContact O-N 2.88Å; R340-D342 WeakPolarHBondContact CD-OD1 3.49Å; R340-D342 WeakPolarHBondContact CG-OD1 3.25Å; R340-D342 IonicContact CZ-OD1 3.96Å; R340-D342 IonicContact CZ-OD2 3.95Å; R340-D342 IonicContact NE-OD1 2.67Å; R340-D342 PolarHBondContact NE-OD1 2.8Å; R340-D342 IonicContact NE-OD2 3.39Å; R340-D342 PolarHBondContact NE-OD2 2.92Å; R340-D342 IonicContact NH2-OD2 3.77Å; R340-D342 PolarHBondContact NH2-OD2 3.23Å; R340-D342 PolarHBondContact O-N 2.87Å; R340-T343 VanDerWaalsContact CB-OG1 3.29Å; R340-T343 WeakPolarHBondContact CB-OG1 3.43Å; R340-T343 WeakPolarHBondContact CG-OG1 3.46Å; R340-T343 PolarHBondContact O-N 3.41Å; R340-T343 VanDerWaalsContact O-N 3.15Å; R340-T343 PolarHBondContact O-OG1 3.33Å; R340-Y671 WeakPolarHBondContact CB-O 3.35Å; R340-Y671 PolarHBondContact N-O 3Å
341	P	70.4	Confident	76.7	Confident	92 Å²	92	50.3 Å²	50.3	60%	0.597	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.2	-174	27.4	-33.8	0	0	0	112.3	I339 T343 F344	I339-P341 VanDerWaalsContact O-CD 3.3Å; I339-P341 WeakPolarHBondContact O-CD 3.17Å; I339-P341 VanDerWaalsContact O-N 3.13Å; P341-T343 VanDerWaalsContact C-N 3.34Å; P341-F344 WeakPolarHBondContact O-CE2 3.42Å; P341-F344 WeakPolarHBondContact O-CZ 3.44Å
342	D	71.5	Confident	75.9	Confident	81 Å²	81	54.4 Å²	54.4	43%	0.433	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	13.8	178.1	63.5	-43.7	0	0	0	114	R340 F344	R340-D342 WeakPolarHBondContact CD-OD1 3.49Å; R340-D342 WeakPolarHBondContact CG-OD1 3.25Å; R340-D342 IonicContact CZ-OD1 3.96Å; R340-D342 IonicContact CZ-OD2 3.95Å; R340-D342 IonicContact NE-OD1 2.67Å; R340-D342 PolarHBondContact NE-OD1 2.8Å; R340-D342 IonicContact NE-OD2 3.39Å; R340-D342 PolarHBondContact NE-OD2 2.92Å; R340-D342 IonicContact NH2-OD2 3.77Å; R340-D342 PolarHBondContact NH2-OD2 3.23Å; R340-D342 PolarHBondContact O-N 2.87Å; D342-F344 VanDerWaalsContact C-N 3.3Å; D342-F344 VanDerWaalsContact CA-CE2 3.48Å; D342-F344 HydrophobicContact CB-CD2 4.46Å; D342-F344 HydrophobicContact CB-CE2 4.26Å; D342-F344 WeakPolarHBondContact O-CD2 3.25Å; D342-F344 PolarHBondContact O-N 2.97Å
343	T	77.2	Confident	75.1	Confident	4 Å²	4	55.8 Å²	55.8	3%	0.025	29%	0.289	C	S	.	.			trans	-73.7	88.9	167.3	-47.9	0	0	0	0	109.3	F291 F295 R340 P341 P668 Y671	F291-T343 HydrophobicContact CZ-CG2 4.3Å; F295-T343 HydrophobicContact CE2-CG2 3.93Å; F295-T343 HydrophobicContact CZ-CG2 4.19Å; R340-T343 VanDerWaalsContact CB-OG1 3.29Å; R340-T343 WeakPolarHBondContact CB-OG1 3.43Å; R340-T343 WeakPolarHBondContact CG-OG1 3.46Å; R340-T343 PolarHBondContact O-N 3.41Å; R340-T343 VanDerWaalsContact O-N 3.15Å; R340-T343 PolarHBondContact O-OG1 3.33Å; P341-T343 VanDerWaalsContact C-N 3.34Å; T343-P668 HydrophobicContact CG2-CB 3.74Å; T343-P668 HydrophobicContact CG2-CG 4.44Å; T343-Y671 HydrophobicContact CG2-CD1 3.72Å; T343-Y671 HydrophobicContact CG2-CE1 4.36Å
344	F	74.6	Confident	74.3	Confident	142 Å²	142	55.9 Å²	55.9	62%	0.623	29%	0.29	S	S	*	.			trans	-113	145	173.1	-59.4	-69	0	0	0	109.7	P341 D342	P341-F344 WeakPolarHBondContact O-CE2 3.42Å; P341-F344 WeakPolarHBondContact O-CZ 3.44Å; D342-F344 VanDerWaalsContact C-N 3.3Å; D342-F344 VanDerWaalsContact CA-CE2 3.48Å; D342-F344 HydrophobicContact CB-CD2 4.46Å; D342-F344 HydrophobicContact CB-CE2 4.26Å; D342-F344 WeakPolarHBondContact O-CD2 3.25Å; D342-F344 PolarHBondContact O-N 2.97Å
345	M	78.9	Confident	73.8	Confident	21 Å²	21	56.5 Å²	56.5	10%	0.103	29%	0.294	C	S	.	.			trans	-60.4	134.4	161.4	-167.2	70.6	72.1	0	0	107.3	N288 F291 E347 I348 L667 I734 I737	N288-M345 VanDerWaalsContact OD1-CB 3.23Å; N288-M345 WeakPolarHBondContact OD1-CB 3.26Å; N288-M345 VanDerWaalsContact OD1-CG 3.25Å; N288-M345 WeakPolarHBondContact OD1-CG 3.32Å; F291-M345 HydrophobicContact CB-CE 3.72Å; F291-M345 HydrophobicContact CD1-CB 4.4Å; F291-M345 HydrophobicContact CD1-CE 3.94Å; F291-M345 HydrophobicContact CD2-CE 3.86Å; F291-M345 HydrophobicContact CE2-CE 4.48Å; F291-M345 HydrophobicContact CG-CE 3.55Å; M345-E347 PolarHBondContact O-N 2.73Å; M345-I348 HydrophobicContact CG-CD1 4.17Å; M345-I348 HydrophobicContact CG-CG1 4.4Å; M345-L667 HydrophobicContact SD-CD2 3.66Å; M345-I734 HydrophobicContact CE-CD1 3.61Å; M345-I734 HydrophobicContact SD-CD1 4.04Å; M345-I737 HydrophobicContact CE-CD1 3.22Å; M345-I737 HydrophobicContact SD-CD1 4.05Å
346	P	74.8	Confident	73.4	Confident	25 Å²	25	57.8 Å²	57.8	16%	0.162	30%	0.295	C	S	.	.			trans	-53.3	144.2	172.2	22.9	-34.1	0	0	0	109.5	I348 V663 K666 L667	P346-I348 VanDerWaalsContact O-CG1 3.26Å; P346-I348 WeakPolarHBondContact O-CG1 3.45Å; P346-I348 PolarHBondContact O-N 3.32Å; P346-V663 HydrophobicContact CG-CG1 4.29Å; P346-K666 HydrophobicContact CB-CB 4.14Å; P346-K666 HydrophobicContact CG-CB 4.22Å; P346-L667 HydrophobicContact CG-CD2 4.39Å
347	E	69.4	Low	72.6	Confident	156 Å²	156	58.3 Å²	58.3	73%	0.729	30%	0.297	S	S	*	.			trans	-58.5	107.7	172.6	-75	-173.5	170.7	0	0	109	M345 N349	M345-E347 PolarHBondContact O-N 2.73Å; E347-N349 PolarHBondContact O-N 3.46Å; E347-N349 PolarHBondContact OE2-ND2 3.24Å; E347-N349 PolarHBondContact OE2-OD1 3.01Å
348	I	71.7	Confident	71.6	Confident	8 Å²	8	59 Å²	59	4%	0.041	30%	0.302	C	S	.	.			trans	-80.1	66.4	176.3	-44.5	-174.1	0	0	0	106.8	I284 N288 M345 P346 F350 A351 I352	I284-I348 HydrophobicContact CG2-CD1 3.43Å; I284-I348 VanDerWaalsContact CG2-CD1 3.43Å; I284-I348 HydrophobicContact CG2-CG2 4.25Å; N288-I348 HydrophobicContact CB-CD1 4.38Å; M345-I348 HydrophobicContact CG-CD1 4.17Å; M345-I348 HydrophobicContact CG-CG1 4.4Å; P346-I348 VanDerWaalsContact O-CG1 3.26Å; P346-I348 WeakPolarHBondContact O-CG1 3.45Å; P346-I348 PolarHBondContact O-N 3.32Å; I348-F350 HydrophobicContact CB-CE1 4.5Å; I348-F350 HydrophobicContact CG2-CD1 3.71Å; I348-F350 HydrophobicContact CG2-CD2 4.38Å; I348-F350 HydrophobicContact CG2-CE1 3.18Å; I348-F350 HydrophobicContact CG2-CE2 3.92Å; I348-F350 HydrophobicContact CG2-CG 4.29Å; I348-F350 HydrophobicContact CG2-CZ 3.3Å; I348-F350 PolarHBondContact O-N 3.43Å; I348-A351 HydrophobicContact CB-CB 3.9Å; I348-A351 HydrophobicContact CG2-CB 3.43Å; I348-A351 VanDerWaalsContact CG2-CB 3.43Å; I348-A351 WeakPolarHBondContact O-CA 3.29Å; I348-A351 WeakPolarHBondContact O-CB 3.49Å; I348-A351 PolarHBondContact O-N 3.22Å; I348-I352 PolarHBondContact O-N 3.03Å
349	N	68.2	Low	70.5	Confident	89 Å²	89	60.9 Å²	60.9	48%	0.476	31%	0.312	S	S	.	.	H	α-helix	trans	-59.8	-34.3	-171	-77.6	-29.4	0	0	0	112.5	E347 A351 I352 A353	E347-N349 PolarHBondContact O-N 3.46Å; E347-N349 PolarHBondContact OE2-ND2 3.24Å; E347-N349 PolarHBondContact OE2-OD1 3.01Å; N349-A351 PolarHBondContact O-N 3.13Å; N349-I352 PolarHBondContact O-N 3.04Å; N349-A353 PolarHBondContact O-N 2.93Å
350	F	70.7	Confident	69.4	Low	20 Å²	20	64.9 Å²	64.9	9%	0.088	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-33	172.7	73.9	-97.1	0	0	0	112	I348 L354 F656 V658 Y660 V663 L741 L744	I348-F350 HydrophobicContact CB-CE1 4.5Å; I348-F350 HydrophobicContact CG2-CD1 3.71Å; I348-F350 HydrophobicContact CG2-CD2 4.38Å; I348-F350 HydrophobicContact CG2-CE1 3.18Å; I348-F350 HydrophobicContact CG2-CE2 3.92Å; I348-F350 HydrophobicContact CG2-CG 4.29Å; I348-F350 HydrophobicContact CG2-CZ 3.3Å; I348-F350 PolarHBondContact O-N 3.43Å; F350-L354 WeakPolarHBondContact O-CB 3.43Å; F350-L354 PolarHBondContact O-N 3.45Å; F350-F656 HydrophobicContact CB-CD1 4.31Å; F350-F656 WeakPolarHBondContact O-CD1 3.39Å; F350-V658 HydrophobicContact CB-CG2 4.4Å; F350-V658 HydrophobicContact CD1-CG2 3.77Å; F350-V658 HydrophobicContact CE1-CG2 4.28Å; F350-V658 HydrophobicContact CG-CG2 4.19Å; F350-Y660 HydrophobicContact CD2-CE1 4.31Å; F350-Y660 HydrophobicContact CE1-CD1 4.22Å; F350-Y660 HydrophobicContact CE1-CE1 4.19Å; F350-Y660 AromaticContact CE2-CE1 3.91Å; F350-Y660 HydrophobicContact CE2-CE1 3.91Å; F350-Y660 HydrophobicContact CZ-CD1 4.05Å; F350-Y660 AromaticContact CZ-CE1 3.84Å; F350-Y660 HydrophobicContact CZ-CE1 3.84Å; F350-V663 HydrophobicContact CE1-CG2 4.25Å; F350-L741 HydrophobicContact CE1-CD2 4.45Å; F350-L741 HydrophobicContact CZ-CD2 3.94Å; F350-L744 HydrophobicContact CE2-CD1 4.44Å
351	A	65.9	Low	68.4	Low	4 Å²	4	68.6 Å²	68.6	3%	0.033	35%	0.347	C	S	.	.	H	α-helix	trans	-71.5	-41	178.3	0	0	0	0	0	111.6	Y281 V285 I348 N349 A353 L354 K355	Y281-A351 HydrophobicContact CD2-CB 3.68Å; Y281-A351 VanDerWaalsContact CE2-CA 3.43Å; Y281-A351 HydrophobicContact CE2-CB 3.56Å; Y281-A351 WeakPolarHBondContact CE2-O 3.46Å; V285-A351 HydrophobicContact CG2-CB 3.88Å; I348-A351 HydrophobicContact CB-CB 3.9Å; I348-A351 HydrophobicContact CG2-CB 3.43Å; I348-A351 VanDerWaalsContact CG2-CB 3.43Å; I348-A351 WeakPolarHBondContact O-CA 3.29Å; I348-A351 WeakPolarHBondContact O-CB 3.49Å; I348-A351 PolarHBondContact O-N 3.22Å; N349-A351 PolarHBondContact O-N 3.13Å; A351-A353 VanDerWaalsContact C-N 3.29Å; A351-A353 PolarHBondContact O-N 3.3Å; A351-L354 PolarHBondContact O-N 3.03Å; A351-K355 PolarHBondContact O-N 2.82Å
352	I	61.6	Low	68.1	Low	116 Å²	116	71 Å²	71	60%	0.595	36%	0.355	S	S	*	.	H	α-helix	trans	-59.2	-44.6	176.7	-62.5	174.4	0	0	0	110.6	I348 N349 K355 F356	I348-I352 PolarHBondContact O-N 3.03Å; N349-I352 PolarHBondContact O-N 3.04Å; I352-K355 VanDerWaalsContact O-CB 3.26Å; I352-K355 WeakPolarHBondContact O-CB 3.34Å; I352-K355 PolarHBondContact O-N 3.49Å; I352-F356 PolarHBondContact O-N 3.26Å
353	A	65.5	Low	67.8	Low	45 Å²	45	68.4 Å²	68.4	37%	0.372	34%	0.341	S	S	.	.	H	α-helix	trans	-76.3	-28.6	-178.3	0	0	0	0	0	112.8	N349 A351 F356 L357 F656	N349-A353 PolarHBondContact O-N 2.93Å; A351-A353 VanDerWaalsContact C-N 3.29Å; A351-A353 PolarHBondContact O-N 3.3Å; A353-F356 WeakPolarHBondContact O-CB 3.39Å; A353-F356 PolarHBondContact O-N 2.98Å; A353-L357 PolarHBondContact O-N 3Å; A353-F656 HydrophobicContact CB-CD1 4.44Å; A353-F656 HydrophobicContact CB-CE1 3.51Å; A353-F656 HydrophobicContact CB-CZ 4.29Å
354	L	68.8	Low	67.2	Low	2 Å²	2	71.3 Å²	71.3	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-68.9	-34.2	169.4	-140.2	89.8	0	0	0	112.4	L277 Y281 F350 A351 F356 L357 T358 L653 F656	L277-L354 HydrophobicContact CD2-CD1 4.26Å; L277-L354 HydrophobicContact CG-CD2 4.17Å; Y281-L354 HydrophobicContact CD1-CB 4.27Å; Y281-L354 HydrophobicContact CD1-CD2 3.58Å; Y281-L354 HydrophobicContact CD1-CG 4.42Å; Y281-L354 HydrophobicContact CD2-CB 3.91Å; Y281-L354 HydrophobicContact CD2-CD2 4.09Å; Y281-L354 HydrophobicContact CE1-CB 4.39Å; Y281-L354 HydrophobicContact CE1-CD2 4.41Å; Y281-L354 HydrophobicContact CE2-CB 4.04Å; Y281-L354 HydrophobicContact CG-CB 4.05Å; Y281-L354 HydrophobicContact CG-CD2 3.41Å; Y281-L354 VanDerWaalsContact CG-CD2 3.41Å; Y281-L354 HydrophobicContact CG-CG 4.33Å; F350-L354 WeakPolarHBondContact O-CB 3.43Å; F350-L354 PolarHBondContact O-N 3.45Å; A351-L354 PolarHBondContact O-N 3.03Å; L354-F356 PolarHBondContact O-N 3.06Å; L354-L357 HydrophobicContact CD1-CD1 4.49Å; L354-L357 PolarHBondContact O-N 3.39Å; L354-L357 VanDerWaalsContact O-N 3.16Å; L354-T358 PolarHBondContact O-N 3.36Å; L354-T358 PolarHBondContact O-OG1 2.96Å; L354-L653 HydrophobicContact CD1-CD2 3.96Å; L354-F656 HydrophobicContact CB-CD1 4.49Å; L354-F656 HydrophobicContact CD1-CB 3.67Å; L354-F656 HydrophobicContact CD1-CD1 3.67Å; L354-F656 HydrophobicContact CD1-CD2 3.48Å; L354-F656 VanDerWaalsContact CD1-CD2 3.48Å; L354-F656 HydrophobicContact CD1-CE1 4.17Å; L354-F656 HydrophobicContact CD1-CE2 4.01Å; L354-F656 HydrophobicContact CD1-CG 3.28Å; L354-F656 HydrophobicContact CD1-CZ 4.33Å
355	K	67.4	Low	66.8	Low	111 Å²	111	65.2 Å²	65.2	48%	0.483	33%	0.334	S	S	.	.	H	α-helix	trans	-55	-42.7	172.9	-161.9	171.3	175.6	-177.4	0	111.7	Y281 A351 I352 L357 T358 T359	Y281-K355 WeakPolarHBondContact OH-CA 3.33Å; Y281-K355 WeakPolarHBondContact OH-CB 3.38Å; Y281-K355 WeakPolarHBondContact OH-CG 3.41Å; Y281-K355 PolarHBondContact OH-N 3.3Å; A351-K355 PolarHBondContact O-N 2.82Å; I352-K355 VanDerWaalsContact O-CB 3.26Å; I352-K355 WeakPolarHBondContact O-CB 3.34Å; I352-K355 PolarHBondContact O-N 3.49Å; K355-L357 VanDerWaalsContact C-N 3.33Å; K355-T358 PolarHBondContact O-N 3.41Å; K355-T358 PolarHBondContact O-OG1 3.25Å; K355-T359 WeakPolarHBondContact CG-OG1 3.34Å; K355-T359 WeakPolarHBondContact O-CB 3.21Å; K355-T359 PolarHBondContact O-N 3.47Å; K355-T359 PolarHBondContact O-OG1 3.38Å
356	F	62.5	Low	66.2	Low	136 Å²	136	71.6 Å²	71.6	60%	0.596	36%	0.364	S	S	*	.	H	α-helix	trans	-62.1	-44.6	-179.9	-169.9	-95.9	0	0	0	110.6	I352 A353 L354 T358 D360	I352-F356 PolarHBondContact O-N 3.26Å; A353-F356 WeakPolarHBondContact O-CB 3.39Å; A353-F356 PolarHBondContact O-N 2.98Å; L354-F356 PolarHBondContact O-N 3.06Å; F356-T358 PolarHBondContact O-N 3.16Å; F356-D360 WeakPolarHBondContact CE2-OD2 3.18Å; F356-D360 WeakPolarHBondContact CZ-OD2 3.31Å; F356-D360 WeakPolarHBondContact O-CB 3.23Å; F356-D360 PolarHBondContact O-N 2.7Å
357	L	63	Low	65.9	Low	39 Å²	39	71.9 Å²	71.9	20%	0.204	37%	0.366	C	S	.	.	H	α-helix	trans	-64.4	-40.3	178.1	-68.4	166.1	0	0	0	113	A353 L354 K355 M649 L653 F656	A353-L357 PolarHBondContact O-N 3Å; L354-L357 HydrophobicContact CD1-CD1 4.49Å; L354-L357 PolarHBondContact O-N 3.39Å; L354-L357 VanDerWaalsContact O-N 3.16Å; K355-L357 VanDerWaalsContact C-N 3.33Å; L357-M649 HydrophobicContact CB-CE 4.17Å; L357-M649 HydrophobicContact CD2-CE 3.2Å; L357-M649 HydrophobicContact CG-CE 4.26Å; L357-L653 HydrophobicContact CD1-CD2 4Å; L357-F656 HydrophobicContact CD1-CD2 4.3Å; L357-F656 HydrophobicContact CD1-CE1 4.37Å; L357-F656 HydrophobicContact CD1-CE2 3.27Å; L357-F656 HydrophobicContact CD1-CZ 3.32Å; L357-F656 HydrophobicContact CG-CZ 4.46Å
358	T	65.2	Low	65.8	Low	17 Å²	17	65.3 Å²	65.3	10%	0.104	34%	0.337	C	S	.	.	H	α-helix	trans	-80	-39	-178.1	57.5	0	0	0	0	113.2	M278 L354 K355 F356 N362 Q363	M278-T358 HydrophobicContact CE-CG2 4.12Å; M278-T358 HydrophobicContact CG-CG2 4.13Å; M278-T358 HydrophobicContact SD-CG2 4.19Å; L354-T358 PolarHBondContact O-N 3.36Å; L354-T358 PolarHBondContact O-OG1 2.96Å; K355-T358 PolarHBondContact O-N 3.41Å; K355-T358 PolarHBondContact O-OG1 3.25Å; F356-T358 PolarHBondContact O-N 3.16Å; T358-N362 PolarHBondContact O-N 3.34Å; T358-Q363 PolarHBondContact O-N 2.88Å
359	T	64.1	Low	65.6	Low	83 Å²	83	67.1 Å²	67.1	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-79.7	-44.7	-173.2	-42.1	0	0	0	0	111.9	K355 R361 N362	K355-T359 WeakPolarHBondContact CG-OG1 3.34Å; K355-T359 WeakPolarHBondContact O-CB 3.21Å; K355-T359 PolarHBondContact O-N 3.47Å; K355-T359 PolarHBondContact O-OG1 3.38Å; T359-R361 VanDerWaalsContact C-N 3.35Å; T359-R361 PolarHBondContact O-N 2.86Å; T359-N362 PolarHBondContact O-N 3.29Å
360	D	62.9	Low	65.7	Low	106 Å²	106	65.3 Å²	65.3	57%	0.567	34%	0.343	S	S	*	.	H	α-helix	trans	-73.1	-27.8	-174	-79.4	7.2	0	0	0	113.1	F356	F356-D360 WeakPolarHBondContact CE2-OD2 3.18Å; F356-D360 WeakPolarHBondContact CZ-OD2 3.31Å; F356-D360 WeakPolarHBondContact O-CB 3.23Å; F356-D360 PolarHBondContact O-N 2.7Å
361	R	62.6	Low	65.8	Low	143 Å²	143	68 Å²	68	54%	0.54	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	0.7	176.8	-70	-134.6	172.8	-172.6	-3.4	114	T359 Q363 M649	T359-R361 VanDerWaalsContact C-N 3.35Å; T359-R361 PolarHBondContact O-N 2.86Å; R361-Q363 HydrophobicContact CB-CG 4.14Å; R361-Q363 PolarHBondContact O-N 2.89Å; R361-Q363 VanDerWaalsContact O-N 3.15Å; R361-M649 HydrophobicContact CG-CE 4.45Å
362	N	63	Low	66	Low	142 Å²	142	69.2 Å²	69.2	76%	0.759	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	34.5	-177.6	-154	26.2	0	0	0	112.7	T358 T359	T358-N362 PolarHBondContact O-N 3.34Å; T359-N362 PolarHBondContact O-N 3.29Å
363	Q	65.4	Low	66.8	Low	28 Å²	28	65.7 Å²	65.7	13%	0.131	34%	0.344	C	S	.	.			trans	-94.8	110.9	-179.4	-75.8	-173.5	-8	0	0	109.2	T358 R361 S367 V368 N646	T358-Q363 PolarHBondContact O-N 2.88Å; R361-Q363 HydrophobicContact CB-CG 4.14Å; R361-Q363 PolarHBondContact O-N 2.89Å; R361-Q363 VanDerWaalsContact O-N 3.15Å; Q363-S367 WeakPolarHBondContact CA-OG 3.49Å; Q363-V368 HydrophobicContact CB-CG2 4.49Å; Q363-N646 PolarHBondContact NE2-ND2 3.31Å; Q363-N646 PolarHBondContact NE2-OD1 3.44Å
364	T	65.4	Low	67.4	Low	64 Å²	64	67.3 Å²	67.3	39%	0.393	34%	0.343	S	S	.	.			trans	-89.3	158	168.4	65.6	0	0	0	0	110.1	E366 S367 V368	T364-E366 PolarHBondContact O-N 3.36Å; T364-S367 PolarHBondContact N-OG 2.73Å; T364-S367 WeakPolarHBondContact O-CB 3.38Å; T364-S367 PolarHBondContact O-N 2.84Å; T364-S367 PolarHBondContact O-OG 2.96Å; T364-S367 PolarHBondContact OG1-N 3.43Å; T364-S367 VanDerWaalsContact OG1-N 3.1Å; T364-V368 PolarHBondContact O-N 3.27Å; T364-V368 VanDerWaalsContact O-N 3.1Å
365	A	65.4	Low	67.8	Low	15 Å²	15	67.3 Å²	67.3	12%	0.124	34%	0.344	C	S	.	.	H	α-helix	trans	-51.9	-40.1	172.2	0	0	0	0	0	111.8	V275 M278 V368 Q369	V275-A365 HydrophobicContact CB-CB 4.18Å; V275-A365 HydrophobicContact CG1-CB 4.04Å; V275-A365 HydrophobicContact CG2-CB 4.01Å; M278-A365 HydrophobicContact CB-CB 4.22Å; M278-A365 HydrophobicContact SD-CB 4.39Å; A365-V368 PolarHBondContact O-N 3.48Å; A365-Q369 PolarHBondContact O-N 3.48Å
366	E	66.5	Low	68.4	Low	155 Å²	155	65.7 Å²	65.7	72%	0.724	34%	0.337	S	S	*	.	H	α-helix	trans	-62.9	-42.4	175.5	-64.2	147.2	-177.8	0	0	112	T364 V368 Q369 A370	T364-E366 PolarHBondContact O-N 3.36Å; E366-V368 VanDerWaalsContact C-N 3.35Å; E366-V368 PolarHBondContact O-N 2.94Å; E366-Q369 PolarHBondContact O-N 3.06Å; E366-A370 WeakPolarHBondContact O-CB 3.48Å; E366-A370 PolarHBondContact O-N 3.43Å
367	S	69.2	Low	69.4	Low	31 Å²	31	64.9 Å²	64.9	22%	0.217	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-38.6	178.4	74.1	0	0	0	0	112.4	Q363 T364 Q371	Q363-S367 WeakPolarHBondContact CA-OG 3.49Å; T364-S367 PolarHBondContact N-OG 2.73Å; T364-S367 WeakPolarHBondContact O-CB 3.38Å; T364-S367 PolarHBondContact O-N 2.84Å; T364-S367 PolarHBondContact O-OG 2.96Å; T364-S367 PolarHBondContact OG1-N 3.43Å; T364-S367 VanDerWaalsContact OG1-N 3.1Å; S367-Q371 WeakPolarHBondContact O-CB 3.39Å; S367-Q371 VanDerWaalsContact O-CG 3.26Å; S367-Q371 WeakPolarHBondContact O-CG 3.47Å; S367-Q371 PolarHBondContact O-N 2.82Å
368	V	66.4	Low	70.3	Confident	17 Å²	17	64 Å²	64	10%	0.103	33%	0.331	C	S	.	.	H	α-helix	trans	-69.2	-45.3	177.7	177	0	0	0	0	110.2	V274 M278 Q363 T364 A365 E366 A370 Q371 L372	V274-V368 HydrophobicContact CG1-CG1 4.09Å; M278-V368 HydrophobicContact CE-CG2 4.29Å; Q363-V368 HydrophobicContact CB-CG2 4.49Å; T364-V368 PolarHBondContact O-N 3.27Å; T364-V368 VanDerWaalsContact O-N 3.1Å; A365-V368 PolarHBondContact O-N 3.48Å; E366-V368 VanDerWaalsContact C-N 3.35Å; E366-V368 PolarHBondContact O-N 2.94Å; V368-A370 VanDerWaalsContact C-N 3.34Å; V368-A370 PolarHBondContact O-N 2.86Å; V368-Q371 PolarHBondContact O-N 3.26Å; V368-L372 HydrophobicContact CG1-CD1 4.06Å; V368-L372 WeakPolarHBondContact O-CG 3.47Å; V368-L372 PolarHBondContact O-N 3.31Å
369	Q	68.8	Low	71.1	Confident	46 Å²	46	63.5 Å²	63.5	22%	0.215	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-41.9	176.3	-170.8	64.7	46.5	0	0	111.5	V275 A365 E366 Q371 L372 N373	V275-Q369 HydrophobicContact CG2-CB 4.21Å; A365-Q369 PolarHBondContact O-N 3.48Å; E366-Q369 PolarHBondContact O-N 3.06Å; Q369-Q371 VanDerWaalsContact C-N 3.34Å; Q369-Q371 PolarHBondContact O-N 3.17Å; Q369-L372 PolarHBondContact O-N 2.88Å; Q369-N373 PolarHBondContact NE2-OD1 3.47Å; Q369-N373 VanDerWaalsContact O-CB 3.25Å; Q369-N373 WeakPolarHBondContact O-CB 3.11Å; Q369-N373 PolarHBondContact O-N 2.89Å
370	A	70.3	Confident	72	Confident	52 Å²	52	63.4 Å²	63.4	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-41.3	176.6	0	0	0	0	0	111.5	E366 V368 N373 H374	E366-A370 WeakPolarHBondContact O-CB 3.48Å; E366-A370 PolarHBondContact O-N 3.43Å; V368-A370 VanDerWaalsContact C-N 3.34Å; V368-A370 PolarHBondContact O-N 2.86Å; A370-N373 CarbonylContact O-C 3.59Å; A370-N373 PolarHBondContact O-N 2.79Å; A370-H374 WeakPolarHBondContact O-CA 3.49Å; A370-H374 WeakPolarHBondContact O-CB 3.48Å; A370-H374 PolarHBondContact O-N 3.18Å
371	Q	72.3	Confident	73	Confident	75 Å²	75	60.7 Å²	60.7	35%	0.35	31%	0.313	S	S	.	.	H	α-helix	trans	-66.4	-40.3	175.8	-75.7	174	4.9	0	0	112.9	S367 V368 Q369 N373 H374 N646	S367-Q371 WeakPolarHBondContact O-CB 3.39Å; S367-Q371 VanDerWaalsContact O-CG 3.26Å; S367-Q371 WeakPolarHBondContact O-CG 3.47Å; S367-Q371 PolarHBondContact O-N 2.82Å; V368-Q371 PolarHBondContact O-N 3.26Å; Q369-Q371 VanDerWaalsContact C-N 3.34Å; Q369-Q371 PolarHBondContact O-N 3.17Å; Q371-N373 VanDerWaalsContact C-N 3.32Å; Q371-H374 WeakPolarHBondContact O-CB 3.49Å; Q371-H374 PolarHBondContact O-N 2.91Å; Q371-N646 PolarHBondContact OE1-ND2 2.98Å
372	L	70.9	Confident	73.9	Confident	30 Å²	30	55.1 Å²	55.1	16%	0.157	29%	0.293	C	S	.	.	H	α-helix	trans	-67	-35.8	175.1	-70.4	168.3	0	0	0	111.6	V368 Q369 L647	V368-L372 HydrophobicContact CG1-CD1 4.06Å; V368-L372 WeakPolarHBondContact O-CG 3.47Å; V368-L372 PolarHBondContact O-N 3.31Å; Q369-L372 PolarHBondContact O-N 2.88Å; L372-L647 HydrophobicContact CD2-CD2 4.35Å
373	N	76.7	Confident	75	Confident	43 Å²	43	49.3 Å²	49.3	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-78.3	-19.6	176.2	-70.1	-7.8	0	0	0	113.1	Q369 A370 Q371 G375 K376 E377	Q369-N373 PolarHBondContact NE2-OD1 3.47Å; Q369-N373 VanDerWaalsContact O-CB 3.25Å; Q369-N373 WeakPolarHBondContact O-CB 3.11Å; Q369-N373 PolarHBondContact O-N 2.89Å; A370-N373 CarbonylContact O-C 3.59Å; A370-N373 PolarHBondContact O-N 2.79Å; Q371-N373 VanDerWaalsContact C-N 3.32Å; N373-G375 VanDerWaalsContact C-N 3.32Å; N373-G375 PolarHBondContact O-N 3.34Å; N373-K376 CarbonylContact O-C 3.58Å; N373-K376 WeakPolarHBondContact O-CA 3.36Å; N373-K376 VanDerWaalsContact O-CB 3.32Å; N373-K376 WeakPolarHBondContact O-CB 3.27Å; N373-K376 PolarHBondContact O-N 2.93Å; N373-E377 PolarHBondContact O-N 2.85Å
374	H	79.1	Confident	75.9	Confident	78 Å²	78	52.7 Å²	52.7	36%	0.361	28%	0.278	S	S	.	.	H	α-helix	trans	-57.2	-44.7	-175.2	-174.8	62.7	0	0	0	112	A370 Q371 K376 E377 L378	A370-H374 WeakPolarHBondContact O-CA 3.49Å; A370-H374 WeakPolarHBondContact O-CB 3.48Å; A370-H374 PolarHBondContact O-N 3.18Å; Q371-H374 WeakPolarHBondContact O-CB 3.49Å; Q371-H374 PolarHBondContact O-N 2.91Å; H374-K376 VanDerWaalsContact C-N 3.27Å; H374-K376 PolarHBondContact O-N 3.34Å; H374-E377 PolarHBondContact O-N 3.14Å; H374-L378 WeakPolarHBondContact O-CB 3.02Å; H374-L378 PolarHBondContact O-N 2.93Å
375	G	76.5	Confident	76.8	Confident	2 Å²	2	55.9 Å²	55.9	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-35.7	175.6	0	0	0	0	0	112.9	N373 S379 M638	N373-G375 VanDerWaalsContact C-N 3.32Å; N373-G375 PolarHBondContact O-N 3.34Å; G375-S379 WeakPolarHBondContact O-CB 3.33Å; G375-S379 PolarHBondContact O-N 3.34Å; G375-M638 WeakPolarHBondContact CA-O 3.19Å
376	K	81.5	Confident	77.6	Confident	77 Å²	77	55.9 Å²	55.9	34%	0.335	29%	0.285	S	S	.	.	H	α-helix	trans	-71.8	-41.5	176.8	-170.3	177.9	-175.1	173.4	0	111.6	F264 D268 N373 H374 S379 N380	F264-K376 HydrophobicContact CD1-CB 4.37Å; F264-K376 HydrophobicContact CD2-CB 4.46Å; F264-K376 HydrophobicContact CD2-CG 4.32Å; F264-K376 HydrophobicContact CE1-CB 4.15Å; F264-K376 HydrophobicContact CE2-CB 4.21Å; F264-K376 HydrophobicContact CE2-CG 4.28Å; F264-K376 HydrophobicContact CZ-CB 4.07Å; D268-K376 IonicContact OD2-NZ 2.64Å; N373-K376 CarbonylContact O-C 3.58Å; N373-K376 WeakPolarHBondContact O-CA 3.36Å; N373-K376 VanDerWaalsContact O-CB 3.32Å; N373-K376 WeakPolarHBondContact O-CB 3.27Å; N373-K376 PolarHBondContact O-N 2.93Å; H374-K376 VanDerWaalsContact C-N 3.27Å; H374-K376 PolarHBondContact O-N 3.34Å; K376-S379 PolarHBondContact O-N 3.05Å; K376-N380 WeakPolarHBondContact O-CB 3.36Å; K376-N380 PolarHBondContact O-N 3.38Å; K376-N380 PolarHBondContact O-ND2 3.03Å
377	E	83.2	Confident	78.4	Confident	119 Å²	119	50 Å²	50	56%	0.556	26%	0.257	S	S	*	.	H	α-helix	trans	-64.4	-45.1	174.7	-72.5	177.7	-176.3	0	0	111.9	N373 H374 S379 N380 S381	N373-E377 PolarHBondContact O-N 2.85Å; H374-E377 PolarHBondContact O-N 3.14Å; E377-S379 VanDerWaalsContact C-N 3.34Å; E377-N380 PolarHBondContact O-N 2.86Å; E377-S381 WeakPolarHBondContact O-CB 3.49Å; E377-S381 PolarHBondContact O-N 3.48Å
378	L	81.8	Confident	79.2	Confident	22 Å²	22	52.7 Å²	52.7	12%	0.115	27%	0.272	C	S	.	.	H	α-helix	trans	-64.8	-41.2	177.2	-172.4	62.4	0	0	0	111.1	H374 S381 Q382 E637 M638	H374-L378 WeakPolarHBondContact O-CB 3.02Å; H374-L378 PolarHBondContact O-N 2.93Å; L378-S381 WeakPolarHBondContact O-CB 3.43Å; L378-S381 PolarHBondContact O-N 3.28Å; L378-Q382 WeakPolarHBondContact O-CG 3.31Å; L378-Q382 PolarHBondContact O-N 3.49Å; L378-E637 HydrophobicContact CD2-CB 4.03Å; L378-E637 HydrophobicContact CD2-CG 3.69Å; L378-M638 HydrophobicContact CD2-CB 4.43Å; L378-M638 HydrophobicContact CD2-CG 3.73Å; L378-M638 HydrophobicContact CG-CG 4.34Å
379	S	81.1	Confident	80	Confident	5 Å²	5	54.7 Å²	54.7	4%	0.035	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-45.7	173.2	176.1	0	0	0	0	112.3	F255 G375 K376 E377 S381 Q382 L383	F255-S379 WeakPolarHBondContact CE2-OG 3.38Å; F255-S379 WeakPolarHBondContact CZ-OG 3.49Å; G375-S379 WeakPolarHBondContact O-CB 3.33Å; G375-S379 PolarHBondContact O-N 3.34Å; K376-S379 PolarHBondContact O-N 3.05Å; E377-S379 VanDerWaalsContact C-N 3.34Å; S379-S381 VanDerWaalsContact C-N 3.34Å; S379-Q382 PolarHBondContact O-N 3.07Å; S379-L383 PolarHBondContact O-N 3.44Å
380	N	83.4	Confident	80.6	Confident	82 Å²	82	53.2 Å²	53.2	44%	0.439	28%	0.275	S	S	.	.	H	α-helix	trans	-64.8	-40.2	175.8	-72.6	-18.9	0	0	0	111	K376 E377 Q382 L383 E384	K376-N380 WeakPolarHBondContact O-CB 3.36Å; K376-N380 PolarHBondContact O-N 3.38Å; K376-N380 PolarHBondContact O-ND2 3.03Å; E377-N380 PolarHBondContact O-N 2.86Å; N380-Q382 VanDerWaalsContact C-N 3.33Å; N380-Q382 PolarHBondContact O-N 3.41Å; N380-L383 WeakPolarHBondContact O-CB 3.5Å; N380-L383 PolarHBondContact O-N 3.26Å; N380-E384 WeakPolarHBondContact O-CG 3.3Å; N380-E384 PolarHBondContact O-N 3.47Å
381	S	83.5	Confident	81.2	Confident	49 Å²	49	53.4 Å²	53.4	34%	0.343	28%	0.277	S	S	.	.	H	α-helix	trans	-61.2	-40.9	175.2	-174.5	0	0	0	0	111.8	E377 L378 S379 E384 K385	E377-S381 WeakPolarHBondContact O-CB 3.49Å; E377-S381 PolarHBondContact O-N 3.48Å; L378-S381 WeakPolarHBondContact O-CB 3.43Å; L378-S381 PolarHBondContact O-N 3.28Å; S379-S381 VanDerWaalsContact C-N 3.34Å; S381-E384 PolarHBondContact O-N 3.05Å; S381-K385 WeakPolarHBondContact O-CB 3.3Å; S381-K385 VanDerWaalsContact O-CG 3.28Å; S381-K385 WeakPolarHBondContact O-CG 3.36Å; S381-K385 PolarHBondContact O-N 2.96Å
382	Q	82.1	Confident	81.7	Confident	26 Å²	26	56.8 Å²	56.8	12%	0.121	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-38.6	175	-76.4	-174.6	-5.9	0	0	112.6	L378 S379 N380 K385 T386	L378-Q382 WeakPolarHBondContact O-CG 3.31Å; L378-Q382 PolarHBondContact O-N 3.49Å; S379-Q382 PolarHBondContact O-N 3.07Å; N380-Q382 VanDerWaalsContact C-N 3.33Å; N380-Q382 PolarHBondContact O-N 3.41Å; Q382-K385 PolarHBondContact O-N 3.12Å; Q382-T386 WeakPolarHBondContact O-CB 3.36Å; Q382-T386 PolarHBondContact O-N 2.89Å; Q382-T386 PolarHBondContact O-OG1 3.21Å
383	L	85	Confident	82.2	Confident	20 Å²	20	60.2 Å²	60.2	11%	0.105	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-47.3	173.4	178.6	61.6	0	0	0	110.8	T247 N251 S379 N380 T386 K387	T247-L383 HydrophobicContact CG2-CD1 3.97Å; N251-L383 HydrophobicContact CB-CD1 3.99Å; S379-L383 PolarHBondContact O-N 3.44Å; N380-L383 WeakPolarHBondContact O-CB 3.5Å; N380-L383 PolarHBondContact O-N 3.26Å; L383-T386 WeakPolarHBondContact O-CB 3.32Å; L383-T386 PolarHBondContact O-N 3.41Å; L383-T386 VanDerWaalsContact O-N 3.17Å; L383-K387 WeakPolarHBondContact O-CG 3.25Å; L383-K387 PolarHBondContact O-N 2.63Å
384	E	85.8	Confident	82.3	Confident	98 Å²	98	59 Å²	59	46%	0.458	30%	0.299	S	S	.	.	H	α-helix	trans	-63.3	-43.5	176.9	-69.6	-53.3	124.1	0	0	111.8	N380 S381 T386 K387 T388	N380-E384 WeakPolarHBondContact O-CG 3.3Å; N380-E384 PolarHBondContact O-N 3.47Å; S381-E384 PolarHBondContact O-N 3.05Å; E384-T386 VanDerWaalsContact C-N 3.27Å; E384-T386 PolarHBondContact O-N 3.28Å; E384-K387 WeakPolarHBondContact O-CB 2.95Å; E384-K387 PolarHBondContact O-N 2.57Å; E384-K387 IonicContact OE1-NZ 3.97Å; E384-K387 PolarHBondContact OE1-NZ 3.31Å; E384-T388 WeakPolarHBondContact O-CG2 3.31Å; E384-T388 PolarHBondContact O-N 3.03Å; E384-T388 PolarHBondContact O-OG1 2.83Å
385	K	84.3	Confident	82.4	Confident	131 Å²	131	57.8 Å²	57.8	57%	0.57	30%	0.296	S	S	*	.	H	α-helix	trans	-58.7	-39.7	172.3	-75.8	175.3	-175.4	177.6	0	112.2	S381 Q382 T388 L389	S381-K385 WeakPolarHBondContact O-CB 3.3Å; S381-K385 VanDerWaalsContact O-CG 3.28Å; S381-K385 WeakPolarHBondContact O-CG 3.36Å; S381-K385 PolarHBondContact O-N 2.96Å; Q382-K385 PolarHBondContact O-N 3.12Å; K385-T388 WeakPolarHBondContact CA-OG1 3.08Å; K385-T388 PolarHBondContact O-N 2.94Å; K385-T388 PolarHBondContact O-OG1 2.95Å; K385-L389 VanDerWaalsContact O-CB 3.29Å; K385-L389 WeakPolarHBondContact O-CB 3.16Å; K385-L389 PolarHBondContact O-N 2.59Å
386	T	81.2	Confident	82.6	Confident	16 Å²	16	58 Å²	58	10%	0.098	30%	0.296	C	S	.	.	H	α-helix	trans	-66.5	-43.8	177.4	-57.9	0	0	0	0	110.4	Q382 L383 E384 L389 M390 I625 S629	Q382-T386 WeakPolarHBondContact O-CB 3.36Å; Q382-T386 PolarHBondContact O-N 2.89Å; Q382-T386 PolarHBondContact O-OG1 3.21Å; L383-T386 WeakPolarHBondContact O-CB 3.32Å; L383-T386 PolarHBondContact O-N 3.41Å; L383-T386 VanDerWaalsContact O-N 3.17Å; E384-T386 VanDerWaalsContact C-N 3.27Å; E384-T386 PolarHBondContact O-N 3.28Å; T386-L389 PolarHBondContact O-N 2.85Å; T386-M390 HydrophobicContact CG2-CE 3.85Å; T386-M390 HydrophobicContact CG2-CG 4.45Å; T386-M390 HydrophobicContact CG2-SD 4.37Å; T386-M390 WeakPolarHBondContact O-CB 3.42Å; T386-M390 VanDerWaalsContact O-CG 3.28Å; T386-M390 WeakPolarHBondContact O-CG 3.38Å; T386-M390 PolarHBondContact O-N 3.1Å; T386-I625 HydrophobicContact CG2-CG2 4.05Å; T386-S629 PolarHBondContact OG1-OG 2.9Å
387	K	84.2	Confident	82.6	Confident	31 Å²	31	56 Å²	56	14%	0.135	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-45	174.4	-72	176.4	-174.1	165.1	0	112.1	T247 N248 L383 E384 L389 M390 A391	T247-K387 HydrophobicContact CG2-CG 4.17Å; N248-K387 WeakPolarHBondContact OD1-CE 3.26Å; N248-K387 PolarHBondContact OD1-NZ 2.87Å; L383-K387 WeakPolarHBondContact O-CG 3.25Å; L383-K387 PolarHBondContact O-N 2.63Å; E384-K387 WeakPolarHBondContact O-CB 2.95Å; E384-K387 PolarHBondContact O-N 2.57Å; E384-K387 IonicContact OE1-NZ 3.97Å; E384-K387 PolarHBondContact OE1-NZ 3.31Å; K387-L389 VanDerWaalsContact C-N 3.32Å; K387-L389 PolarHBondContact O-N 2.81Å; K387-M390 PolarHBondContact O-N 3.12Å; K387-A391 WeakPolarHBondContact O-CB 3.35Å; K387-A391 PolarHBondContact O-N 2.92Å
388	T	85.2	Confident	82.6	Confident	88 Å²	88	55 Å²	55	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-62.8	-41.6	177.2	54.2	0	0	0	0	111.4	E384 K385 A391 E392	E384-T388 WeakPolarHBondContact O-CG2 3.31Å; E384-T388 PolarHBondContact O-N 3.03Å; E384-T388 PolarHBondContact O-OG1 2.83Å; K385-T388 WeakPolarHBondContact CA-OG1 3.08Å; K385-T388 PolarHBondContact O-N 2.94Å; K385-T388 PolarHBondContact O-OG1 2.95Å; T388-A391 PolarHBondContact O-N 2.91Å; T388-E392 WeakPolarHBondContact O-CB 3.41Å; T388-E392 PolarHBondContact O-N 2.92Å
389	L	83.4	Confident	82.5	Confident	58 Å²	58	54.9 Å²	54.9	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-67.9	-37.9	177.6	-172.4	65.1	0	0	0	111.8	K385 T386 K387 K393 I625	K385-L389 VanDerWaalsContact O-CB 3.29Å; K385-L389 WeakPolarHBondContact O-CB 3.16Å; K385-L389 PolarHBondContact O-N 2.59Å; T386-L389 PolarHBondContact O-N 2.85Å; K387-L389 VanDerWaalsContact C-N 3.32Å; K387-L389 PolarHBondContact O-N 2.81Å; L389-K393 HydrophobicContact CD1-CD 4.1Å; L389-K393 HydrophobicContact CD1-CG 4.17Å; L389-K393 HydrophobicContact CG-CD 4.15Å; L389-K393 HydrophobicContact CG-CG 4.46Å; L389-K393 VanDerWaalsContact O-CB 3.31Å; L389-K393 WeakPolarHBondContact O-CB 3.43Å; L389-K393 PolarHBondContact O-N 3.12Å; L389-I625 HydrophobicContact CD2-CG2 4.06Å; L389-I625 HydrophobicContact CG-CG2 4.37Å
390	M	80.6	Confident	82.4	Confident	15 Å²	15	55.2 Å²	55.2	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-50.7	172.3	-75.8	-176	177.3	0	0	110.6	T247 T386 K387 E392 K393 I394 I625	T247-M390 HydrophobicContact CG2-CE 4.44Å; T247-M390 HydrophobicContact CG2-SD 4.04Å; T247-M390 PolarHBondContact OG1-SD 3.14Å; T386-M390 HydrophobicContact CG2-CE 3.85Å; T386-M390 HydrophobicContact CG2-CG 4.45Å; T386-M390 HydrophobicContact CG2-SD 4.37Å; T386-M390 WeakPolarHBondContact O-CB 3.42Å; T386-M390 VanDerWaalsContact O-CG 3.28Å; T386-M390 WeakPolarHBondContact O-CG 3.38Å; T386-M390 PolarHBondContact O-N 3.1Å; K387-M390 PolarHBondContact O-N 3.12Å; M390-E392 VanDerWaalsContact C-N 3.3Å; M390-E392 PolarHBondContact O-N 3.11Å; M390-K393 PolarHBondContact O-N 3.31Å; M390-I394 HydrophobicContact CB-CD1 3.95Å; M390-I394 HydrophobicContact CG-CD1 4.29Å; M390-I394 WeakPolarHBondContact O-CA 3.36Å; M390-I394 WeakPolarHBondContact O-CB 3.48Å; M390-I394 WeakPolarHBondContact O-CG1 3.21Å; M390-I394 PolarHBondContact O-N 3.4Å; M390-I625 HydrophobicContact CB-CD1 4.44Å; M390-I625 HydrophobicContact CE-CB 4.42Å; M390-I625 HydrophobicContact CE-CG2 4.05Å; M390-I625 HydrophobicContact CG-CB 4.32Å; M390-I625 HydrophobicContact CG-CD1 3.92Å; M390-I625 HydrophobicContact CG-CG2 3.7Å
391	A	82.7	Confident	82.2	Confident	56 Å²	56	58 Å²	58	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-56.3	-43.6	177.2	0	0	0	0	0	112.2	K387 T388 N395	K387-A391 WeakPolarHBondContact O-CB 3.35Å; K387-A391 PolarHBondContact O-N 2.92Å; T388-A391 PolarHBondContact O-N 2.91Å; A391-N395 WeakPolarHBondContact O-CA 3.47Å; A391-N395 PolarHBondContact O-N 3.14Å
392	E	83.5	Confident	82.1	Confident	146 Å²	146	59.8 Å²	59.8	68%	0.682	30%	0.299	S	S	*	.	H	α-helix	trans	-68.7	-49.8	179.1	-174.6	-176.4	179.2	0	0	113	T388 M390	T388-E392 WeakPolarHBondContact O-CB 3.41Å; T388-E392 PolarHBondContact O-N 2.92Å; M390-E392 VanDerWaalsContact C-N 3.3Å; M390-E392 PolarHBondContact O-N 3.11Å
393	K	81.9	Confident	81.8	Confident	102 Å²	102	62.2 Å²	62.2	44%	0.443	31%	0.311	S	S	.	.	H	α-helix	trans	-76	-39	-176	-75.9	-172.7	171.8	-178	0	112.9	L389 M390 L621 I625	L389-K393 HydrophobicContact CD1-CD 4.1Å; L389-K393 HydrophobicContact CD1-CG 4.17Å; L389-K393 HydrophobicContact CG-CD 4.15Å; L389-K393 HydrophobicContact CG-CG 4.46Å; L389-K393 VanDerWaalsContact O-CB 3.31Å; L389-K393 WeakPolarHBondContact O-CB 3.43Å; L389-K393 PolarHBondContact O-N 3.12Å; M390-K393 PolarHBondContact O-N 3.31Å; K393-L621 HydrophobicContact CB-CD2 4.41Å; K393-L621 WeakPolarHBondContact O-CD2 3.38Å; K393-I625 HydrophobicContact CB-CD1 3.86Å; K393-I625 HydrophobicContact CD-CD1 3.88Å; K393-I625 HydrophobicContact CD-CG1 3.92Å; K393-I625 HydrophobicContact CG-CD1 4.44Å
394	I	78	Confident	81.4	Confident	17 Å²	17	62.9 Å²	62.9	9%	0.087	32%	0.316	C	S	.	.	H	α-helix	trans	-72.8	-40.2	179.5	-63.9	176.6	0	0	0	109.7	Q243 M390 I396 F618 L621 I625	Q243-I394 HydrophobicContact CG-CD1 4.48Å; M390-I394 HydrophobicContact CB-CD1 3.95Å; M390-I394 HydrophobicContact CG-CD1 4.29Å; M390-I394 WeakPolarHBondContact O-CA 3.36Å; M390-I394 WeakPolarHBondContact O-CB 3.48Å; M390-I394 WeakPolarHBondContact O-CG1 3.21Å; M390-I394 PolarHBondContact O-N 3.4Å; I394-I396 VanDerWaalsContact C-N 3.34Å; I394-I396 HydrophobicContact CG2-CG1 3.74Å; I394-I396 PolarHBondContact O-N 3.08Å; I394-F618 HydrophobicContact CG2-CD1 3.36Å; I394-F618 HydrophobicContact CG2-CE1 3.28Å; I394-L621 HydrophobicContact CB-CD2 4.31Å; I394-L621 HydrophobicContact CG1-CD2 3.73Å; I394-L621 HydrophobicContact CG1-CG 4.17Å; I394-I625 HydrophobicContact CG1-CD1 4.47Å
395	N	81.8	Confident	81.2	Confident	53 Å²	53	61 Å²	61	28%	0.283	31%	0.309	S	S	.	.			trans	43.7	59.5	178	-164.4	-15	0	0	0	111.7	A391 P397 E398 S399	A391-N395 WeakPolarHBondContact O-CA 3.47Å; A391-N395 PolarHBondContact O-N 3.14Å; N395-P397 VanDerWaalsContact C-N 3.27Å; N395-E398 HydrophobicContact CB-CB 4.29Å; N395-E398 WeakPolarHBondContact ND2-CB 3.35Å; N395-E398 PolarHBondContact ND2-OE2 2.79Å; N395-E398 PolarHBondContact O-N 3.06Å; N395-E398 VanDerWaalsContact O-N 3.11Å; N395-E398 WeakPolarHBondContact OD1-CB 3.38Å; N395-E398 PolarHBondContact OD1-N 3.42Å; N395-E398 VanDerWaalsContact OD1-N 3.16Å; N395-S399 WeakPolarHBondContact O-CB 3.43Å; N395-S399 PolarHBondContact O-N 2.81Å
396	I	80.3	Confident	81	Confident	6 Å²	6	61 Å²	61	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-46.4	-47.9	179.1	-65.9	169.3	0	0	0	111.5	I236 T239 E240 Q243 I394 E398 S399 I400	I236-I396 HydrophobicContact CG2-CG2 4.41Å; T239-I396 HydrophobicContact CG2-CD1 3.87Å; T239-I396 HydrophobicContact CG2-CG1 4.26Å; T239-I396 HydrophobicContact CG2-CG2 3.7Å; E240-I396 HydrophobicContact CB-CD1 4.47Å; E240-I396 HydrophobicContact CG-CB 4.41Å; E240-I396 HydrophobicContact CG-CD1 3.88Å; Q243-I396 HydrophobicContact CB-CD1 4.16Å; I394-I396 VanDerWaalsContact C-N 3.34Å; I394-I396 HydrophobicContact CG2-CG1 3.74Å; I394-I396 PolarHBondContact O-N 3.08Å; I396-E398 PolarHBondContact O-N 3.31Å; I396-S399 PolarHBondContact O-N 3.29Å; I396-I400 HydrophobicContact CG2-CD1 3.6Å; I396-I400 HydrophobicContact CG2-CG1 4.27Å; I396-I400 WeakPolarHBondContact O-CB 3.42Å; I396-I400 WeakPolarHBondContact O-CG1 3.44Å; I396-I400 PolarHBondContact O-N 2.81Å
397	P	82.3	Confident	81	Confident	35 Å²	35	64.6 Å²	64.6	23%	0.227	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-46.7	-178.8	-21.3	32.1	0	0	0	112.4	I236 N395 R401	I236-P397 HydrophobicContact CD1-CB 4.24Å; I236-P397 HydrophobicContact CG2-CB 4.13Å; I236-P397 HydrophobicContact CG2-CG 3.78Å; N395-P397 VanDerWaalsContact C-N 3.27Å; P397-R401 VanDerWaalsContact O-CB 3.27Å; P397-R401 WeakPolarHBondContact O-CB 3.34Å; P397-R401 WeakPolarHBondContact O-CG 3.49Å; P397-R401 PolarHBondContact O-N 3.34Å
398	E	81.6	Confident	81	Confident	100 Å²	100	64.6 Å²	64.6	47%	0.467	32%	0.324	S	S	.	.	H	α-helix	trans	-69.4	-40.2	179.8	-166.7	-177.4	154.5	0	0	111.5	N395 I396 I400 R401 N402	N395-E398 HydrophobicContact CB-CB 4.29Å; N395-E398 WeakPolarHBondContact ND2-CB 3.35Å; N395-E398 PolarHBondContact ND2-OE2 2.79Å; N395-E398 PolarHBondContact O-N 3.06Å; N395-E398 VanDerWaalsContact O-N 3.11Å; N395-E398 WeakPolarHBondContact OD1-CB 3.38Å; N395-E398 PolarHBondContact OD1-N 3.42Å; N395-E398 VanDerWaalsContact OD1-N 3.16Å; I396-E398 PolarHBondContact O-N 3.31Å; E398-I400 PolarHBondContact O-N 3.21Å; E398-R401 PolarHBondContact O-N 2.91Å; E398-N402 WeakPolarHBondContact CG-ND2 3.1Å; E398-N402 WeakPolarHBondContact O-CB 3.47Å; E398-N402 PolarHBondContact O-N 3.2Å; E398-N402 PolarHBondContact OE1-ND2 3.36Å
399	S	80.3	Confident	80.9	Confident	19 Å²	19	64.5 Å²	64.5	13%	0.133	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-46.5	178.1	-172.1	0	0	0	0	111.8	N395 I396 M403 M614	N395-S399 WeakPolarHBondContact O-CB 3.43Å; N395-S399 PolarHBondContact O-N 2.81Å; I396-S399 PolarHBondContact O-N 3.29Å; S399-M403 VanDerWaalsContact O-CB 3.29Å; S399-M403 WeakPolarHBondContact O-CB 3.26Å; S399-M403 PolarHBondContact O-N 2.95Å; S399-M614 VanDerWaalsContact OG-CE 3.27Å; S399-M614 WeakPolarHBondContact OG-CE 3.43Å
400	I	79.1	Confident	80.8	Confident	12 Å²	12	66.8 Å²	66.8	6%	0.062	33%	0.329	C	S	.	.	H	α-helix	trans	-66.5	-41.9	177.6	-67	177.2	0	0	0	110.6	V232 L235 I236 I396 E398 T404	V232-I400 HydrophobicContact CG1-CG2 4.02Å; L235-I400 HydrophobicContact CD2-CG2 4.49Å; L235-I400 HydrophobicContact CG-CD1 4.34Å; I236-I400 HydrophobicContact CG1-CB 4.37Å; I236-I400 HydrophobicContact CG1-CD1 3.95Å; I236-I400 HydrophobicContact CG1-CG2 4.39Å; I396-I400 HydrophobicContact CG2-CD1 3.6Å; I396-I400 HydrophobicContact CG2-CG1 4.27Å; I396-I400 WeakPolarHBondContact O-CB 3.42Å; I396-I400 WeakPolarHBondContact O-CG1 3.44Å; I396-I400 PolarHBondContact O-N 2.81Å; E398-I400 PolarHBondContact O-N 3.21Å; I400-T404 WeakPolarHBondContact O-CB 3.33Å; I400-T404 PolarHBondContact O-N 2.81Å; I400-T404 PolarHBondContact O-OG1 2.85Å
401	R	80	Confident	81	Confident	141 Å²	141	68.3 Å²	68.3	53%	0.532	34%	0.337	S	S	.	.	H	α-helix	trans	-65.1	-44.3	177	-76.8	175	177.1	-175.3	-1.2	112.4	P397 E398 T404 N405	P397-R401 VanDerWaalsContact O-CB 3.27Å; P397-R401 WeakPolarHBondContact O-CB 3.34Å; P397-R401 WeakPolarHBondContact O-CG 3.49Å; P397-R401 PolarHBondContact O-N 3.34Å; E398-R401 PolarHBondContact O-N 2.91Å; R401-T404 PolarHBondContact O-N 3.41Å; R401-N405 VanDerWaalsContact O-CB 3.29Å; R401-N405 WeakPolarHBondContact O-CB 3.36Å; R401-N405 VanDerWaalsContact O-CG 3.28Å; R401-N405 PolarHBondContact O-N 2.84Å; R401-N405 PolarHBondContact O-ND2 3.06Å
402	N	80.4	Confident	81.1	Confident	86 Å²	86	70.8 Å²	70.8	46%	0.46	34%	0.34	S	S	.	.	H	α-helix	trans	-65.3	-42.1	179	-75	-9.7	0	0	0	111.2	E398 N405 K406	E398-N402 WeakPolarHBondContact CG-ND2 3.1Å; E398-N402 WeakPolarHBondContact O-CB 3.47Å; E398-N402 PolarHBondContact O-N 3.2Å; E398-N402 PolarHBondContact OE1-ND2 3.36Å; N402-N405 PolarHBondContact O-N 2.9Å; N402-K406 VanDerWaalsContact O-CB 3.25Å; N402-K406 WeakPolarHBondContact O-CB 3.5Å; N402-K406 PolarHBondContact O-N 3.47Å
403	M	75.5	Confident	81.3	Confident	76 Å²	76	67.9 Å²	67.9	37%	0.374	33%	0.333	S	S	.	.	H	α-helix	trans	-60.2	-48.8	173.2	177.9	174.5	52.7	0	0	111.1	S399 N405 K406 Q407 M614	S399-M403 VanDerWaalsContact O-CB 3.29Å; S399-M403 WeakPolarHBondContact O-CB 3.26Å; S399-M403 PolarHBondContact O-N 2.95Å; M403-N405 PolarHBondContact O-N 3.43Å; M403-K406 PolarHBondContact O-N 3.24Å; M403-Q407 WeakPolarHBondContact O-CG 3.24Å; M403-Q407 PolarHBondContact O-N 3.35Å; M403-Q407 VanDerWaalsContact O-N 3.17Å; M403-M614 HydrophobicContact SD-CE 4.29Å
404	T	77.5	Confident	81.5	Confident	35 Å²	35	69.5 Å²	69.5	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178.7	-56.3	0	0	0	0	111.2	I228 I400 R401 Q407 W408	I228-T404 HydrophobicContact CD1-CG2 4.16Å; I400-T404 WeakPolarHBondContact O-CB 3.33Å; I400-T404 PolarHBondContact O-N 2.81Å; I400-T404 PolarHBondContact O-OG1 2.85Å; R401-T404 PolarHBondContact O-N 3.41Å; T404-Q407 PolarHBondContact O-N 3.19Å; T404-W408 VanDerWaalsContact CG2-NE1 3.3Å; T404-W408 PolarHBondContact O-N 3.05Å; T404-W408 VanDerWaalsContact O-N 3.15Å
405	N	80.8	Confident	82	Confident	59 Å²	59	70.2 Å²	70.2	32%	0.316	35%	0.346	S	S	.	.	H	α-helix	trans	-62.7	-45.1	178	-77.3	-30.8	0	0	0	111.9	K225 R401 N402 M403 Q407 W408 D409	K225-N405 PolarHBondContact NZ-OD1 3.12Å; R401-N405 VanDerWaalsContact O-CB 3.29Å; R401-N405 WeakPolarHBondContact O-CB 3.36Å; R401-N405 VanDerWaalsContact O-CG 3.28Å; R401-N405 PolarHBondContact O-N 2.84Å; R401-N405 PolarHBondContact O-ND2 3.06Å; N402-N405 PolarHBondContact O-N 2.9Å; M403-N405 PolarHBondContact O-N 3.43Å; N405-Q407 VanDerWaalsContact C-N 3.25Å; N405-Q407 PolarHBondContact O-N 3.33Å; N405-W408 CarbonylContact O-C 3.5Å; N405-W408 WeakPolarHBondContact O-CA 3.44Å; N405-W408 PolarHBondContact O-N 3.06Å; N405-D409 WeakPolarHBondContact O-CB 3.25Å; N405-D409 PolarHBondContact O-N 3.43Å
406	K	80.7	Confident	82.4	Confident	130 Å²	130	70.8 Å²	70.8	57%	0.565	35%	0.352	S	S	*	.	H	α-helix	trans	-56.9	-39.4	177.1	-175	-177.9	178.1	-173.1	0	112.2	N402 M403 Q410	N402-K406 VanDerWaalsContact O-CB 3.25Å; N402-K406 WeakPolarHBondContact O-CB 3.5Å; N402-K406 PolarHBondContact O-N 3.47Å; M403-K406 PolarHBondContact O-N 3.24Å; K406-Q410 VanDerWaalsContact O-CG 3.3Å; K406-Q410 WeakPolarHBondContact O-CG 3.36Å; K406-Q410 PolarHBondContact O-N 2.89Å; K406-Q410 VanDerWaalsContact O-N 3.11Å
407	Q	80.9	Confident	82.8	Confident	92 Å²	92	77.1 Å²	77.1	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-67	-39.9	175.9	-64.5	-63.1	-30.1	0	0	111.8	M403 T404 N405 Q410 L411	M403-Q407 WeakPolarHBondContact O-CG 3.24Å; M403-Q407 PolarHBondContact O-N 3.35Å; M403-Q407 VanDerWaalsContact O-N 3.17Å; T404-Q407 PolarHBondContact O-N 3.19Å; N405-Q407 VanDerWaalsContact C-N 3.25Å; N405-Q407 PolarHBondContact O-N 3.33Å; Q407-Q410 PolarHBondContact O-N 3.36Å; Q407-L411 PolarHBondContact O-N 3.05Å
408	W	84.1	Confident	83.1	Confident	30 Å²	30	77.1 Å²	77.1	11%	0.114	38%	0.382	C	S	.	.	H	α-helix	trans	-67.4	-40.5	174.8	-65.3	122.8	0	0	0	112.9	F220 I221 T224 K225 I228 T404 N405 Q410 L411 E412 V809	F220-W408 AromaticContact CE1-CZ3 3.85Å; F220-W408 HydrophobicContact CE1-CZ3 3.85Å; I221-W408 WeakPolarHBondContact CD1-O 3.25Å; I221-W408 HydrophobicContact CG1-CE3 4.29Å; I221-W408 HydrophobicContact CG2-CB 4Å; I221-W408 HydrophobicContact CG2-CG 4.28Å; T224-W408 HydrophobicContact CG2-CH2 3.46Å; T224-W408 VanDerWaalsContact CG2-CH2 3.46Å; T224-W408 HydrophobicContact CG2-CZ2 3.5Å; T224-W408 HydrophobicContact CG2-CZ3 4.39Å; K225-W408 HydrophobicContact CG-CG 4.41Å; I228-W408 HydrophobicContact CD1-CZ2 4.02Å; T404-W408 VanDerWaalsContact CG2-NE1 3.3Å; T404-W408 PolarHBondContact O-N 3.05Å; T404-W408 VanDerWaalsContact O-N 3.15Å; N405-W408 CarbonylContact O-C 3.5Å; N405-W408 WeakPolarHBondContact O-CA 3.44Å; N405-W408 PolarHBondContact O-N 3.06Å; W408-Q410 VanDerWaalsContact C-N 3.26Å; W408-Q410 PolarHBondContact O-N 3.19Å; W408-L411 HydrophobicContact CE3-CD2 3.96Å; W408-L411 HydrophobicContact CZ3-CD2 3.87Å; W408-L411 WeakPolarHBondContact O-CB 3.44Å; W408-L411 PolarHBondContact O-N 3.2Å; W408-E412 PolarHBondContact O-N 3.42Å; W408-V809 HydrophobicContact CH2-CG1 4.34Å
409	D	82.9	Confident	83.6	Confident	86 Å²	86	73.8 Å²	73.8	46%	0.46	37%	0.367	S	S	.	.	H	α-helix	trans	-66.6	-29.6	179.4	-59.6	-13.1	0	0	0	111.3	N405 L411 P413	N405-D409 WeakPolarHBondContact O-CB 3.25Å; N405-D409 PolarHBondContact O-N 3.43Å; D409-L411 VanDerWaalsContact C-N 3.34Å; D409-P413 WeakPolarHBondContact O-CD 3.37Å
410	Q	82.7	Confident	84.1	Confident	107 Å²	107	77.9 Å²	77.9	50%	0.5	38%	0.384	S	S	.	.	H	α-helix	trans	-71.6	-27.7	171.8	-75.2	177.6	-7.9	0	0	113.1	K406 Q407 W408	K406-Q410 VanDerWaalsContact O-CG 3.3Å; K406-Q410 WeakPolarHBondContact O-CG 3.36Å; K406-Q410 PolarHBondContact O-N 2.89Å; K406-Q410 VanDerWaalsContact O-N 3.11Å; Q407-Q410 PolarHBondContact O-N 3.36Å; W408-Q410 VanDerWaalsContact C-N 3.26Å; W408-Q410 PolarHBondContact O-N 3.19Å
411	L	83.2	Confident	84.7	Confident	46 Å²	46	81.3 Å²	81.3	24%	0.241	40%	0.4	C	S	.	.	H	α-helix	trans	-82.4	-31.3	179.9	-170.6	65.2	0	0	0	112.2	F220 Q407 W408 D409 Q414 L415	F220-L411 HydrophobicContact CD1-CD2 4.11Å; F220-L411 HydrophobicContact CE1-CD2 3.67Å; Q407-L411 PolarHBondContact O-N 3.05Å; W408-L411 HydrophobicContact CE3-CD2 3.96Å; W408-L411 HydrophobicContact CZ3-CD2 3.87Å; W408-L411 WeakPolarHBondContact O-CB 3.44Å; W408-L411 PolarHBondContact O-N 3.2Å; D409-L411 VanDerWaalsContact C-N 3.34Å; L411-Q414 WeakPolarHBondContact O-CB 3.43Å; L411-Q414 PolarHBondContact O-N 2.96Å; L411-L415 HydrophobicContact CD2-CD1 4.1Å; L411-L415 HydrophobicContact CG-CD1 3.97Å; L411-L415 HydrophobicContact CG-CD2 4.46Å; L411-L415 HydrophobicContact CG-CG 4.01Å; L411-L415 PolarHBondContact O-N 3.05Å
412	E	86.6	Confident	85.2	Confident	109 Å²	109	75.4 Å²	75.4	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-54.2	-45	-175.5	-176.9	175	-156.9	0	0	114.6	I221 W408 Q414 L415 T416	I221-E412 HydrophobicContact CD1-CB 3.67Å; I221-E412 HydrophobicContact CD1-CG 4.29Å; W408-E412 PolarHBondContact O-N 3.42Å; E412-Q414 VanDerWaalsContact C-N 3.28Å; E412-Q414 PolarHBondContact O-N 3.18Å; E412-L415 PolarHBondContact O-N 2.88Å; E412-T416 WeakPolarHBondContact O-CB 3.39Å; E412-T416 PolarHBondContact O-N 3.46Å; E412-T416 PolarHBondContact O-OG1 3.33Å
413	P	87.3	Confident	85.7	Confident	85 Å²	85	73.3 Å²	73.3	55%	0.552	37%	0.368	S	S	*	.	H	α-helix	trans	-63.1	-34	176.2	-22.9	33.5	0	0	0	113.1	D409 K417	D409-P413 WeakPolarHBondContact O-CD 3.37Å; P413-K417 PolarHBondContact O-N 3.42Å
414	Q	85.3	Confident	86.4	Confident	136 Å²	136	75 Å²	75	64%	0.636	37%	0.373	S	S	*	.	H	α-helix	trans	-70.9	-41.2	179.7	-58	-174.1	2.5	0	0	111.1	L411 E412 K417 A418	L411-Q414 WeakPolarHBondContact O-CB 3.43Å; L411-Q414 PolarHBondContact O-N 2.96Å; E412-Q414 VanDerWaalsContact C-N 3.28Å; E412-Q414 PolarHBondContact O-N 3.18Å; Q414-K417 PolarHBondContact O-N 3.31Å; Q414-A418 PolarHBondContact O-N 3.36Å
415	L	88.3	Confident	87	Confident	31 Å²	31	77.2 Å²	77.2	16%	0.162	38%	0.383	C	S	.	.	H	α-helix	trans	-66.5	-39.6	174.8	-62.8	178.4	0	0	0	111.5	I217 F220 I221 L411 E412 K417 A418 I419	I217-L415 HydrophobicContact CG2-CB 3.71Å; I217-L415 HydrophobicContact CG2-CD2 3.98Å; I217-L415 HydrophobicContact CG2-CG 4.33Å; I217-L415 WeakPolarHBondContact CG2-O 3.49Å; F220-L415 HydrophobicContact CB-CD1 4.2Å; F220-L415 HydrophobicContact CD1-CD1 3.9Å; F220-L415 HydrophobicContact CG-CD1 4.36Å; I221-L415 HydrophobicContact CD1-CD1 3.79Å; I221-L415 HydrophobicContact CG1-CD1 3.73Å; L411-L415 HydrophobicContact CD2-CD1 4.1Å; L411-L415 HydrophobicContact CG-CD1 3.97Å; L411-L415 HydrophobicContact CG-CD2 4.46Å; L411-L415 HydrophobicContact CG-CG 4.01Å; L411-L415 PolarHBondContact O-N 3.05Å; E412-L415 PolarHBondContact O-N 2.88Å; L415-K417 VanDerWaalsContact C-N 3.34Å; L415-K417 PolarHBondContact O-N 3.48Å; L415-A418 WeakPolarHBondContact O-CB 3.33Å; L415-A418 PolarHBondContact O-N 3.37Å; L415-A418 VanDerWaalsContact O-N 3.13Å; L415-I419 WeakPolarHBondContact O-CG1 3.28Å; L415-I419 PolarHBondContact O-N 2.92Å
416	T	90.1	Very high	87.4	Confident	65 Å²	65	74.4 Å²	74.4	40%	0.399	37%	0.367	S	S	.	.	H	α-helix	trans	-59.9	-45.3	175.4	-57.6	0	0	0	0	111.1	E412 A418 I419 E420	E412-T416 WeakPolarHBondContact O-CB 3.39Å; E412-T416 PolarHBondContact O-N 3.46Å; E412-T416 PolarHBondContact O-OG1 3.33Å; T416-A418 VanDerWaalsContact C-N 3.31Å; T416-A418 PolarHBondContact O-N 2.81Å; T416-I419 WeakPolarHBondContact O-CB 3.18Å; T416-I419 PolarHBondContact O-N 2.85Å; T416-I419 VanDerWaalsContact O-N 3.16Å; T416-E420 PolarHBondContact O-N 2.68Å
417	K	89.2	Confident	87.8	Confident	139 Å²	139	71.2 Å²	71.2	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-61.8	-38	174.8	-171	178.5	-179.4	-178.2	0	112.4	P413 Q414 L415 E420 E421	P413-K417 PolarHBondContact O-N 3.42Å; Q414-K417 PolarHBondContact O-N 3.31Å; L415-K417 VanDerWaalsContact C-N 3.34Å; L415-K417 PolarHBondContact O-N 3.48Å; K417-E420 PolarHBondContact O-N 3.11Å; K417-E421 PolarHBondContact O-N 3.01Å; K417-E421 VanDerWaalsContact O-N 3.11Å
418	A	89.7	Confident	88.1	Confident	36 Å²	36	72.4 Å²	72.4	30%	0.298	36%	0.36	S	S	.	.	H	α-helix	trans	-64.8	-39.1	175.2	0	0	0	0	0	112	I217 Q414 L415 T416 E421 I422	I217-A418 HydrophobicContact CD1-CB 4.09Å; Q414-A418 PolarHBondContact O-N 3.36Å; L415-A418 WeakPolarHBondContact O-CB 3.33Å; L415-A418 PolarHBondContact O-N 3.37Å; L415-A418 VanDerWaalsContact O-N 3.13Å; T416-A418 VanDerWaalsContact C-N 3.31Å; T416-A418 PolarHBondContact O-N 2.81Å; A418-E421 PolarHBondContact O-N 3.15Å; A418-I422 WeakPolarHBondContact O-CG1 3.24Å; A418-I422 PolarHBondContact O-N 2.91Å
419	I	90.2	Very high	88.3	Confident	29 Å²	29	72 Å²	72	15%	0.149	36%	0.36	C	S	.	.	H	α-helix	trans	-61.5	-45.6	173.4	-67.9	167.2	0	0	0	110.8	R214 I217 L415 T416 E421 I422 D423	R214-I419 HydrophobicContact CG-CG2 4.16Å; I217-I419 HydrophobicContact CB-CG1 4.12Å; I217-I419 HydrophobicContact CG2-CD1 3.92Å; I217-I419 HydrophobicContact CG2-CG1 3.6Å; L415-I419 WeakPolarHBondContact O-CG1 3.28Å; L415-I419 PolarHBondContact O-N 2.92Å; T416-I419 WeakPolarHBondContact O-CB 3.18Å; T416-I419 PolarHBondContact O-N 2.85Å; T416-I419 VanDerWaalsContact O-N 3.16Å; I419-E421 VanDerWaalsContact C-N 3.32Å; I419-E421 PolarHBondContact O-N 3.34Å; I419-I422 PolarHBondContact O-N 2.83Å; I419-I422 VanDerWaalsContact O-N 3.16Å; I419-D423 PolarHBondContact O-N 2.94Å
420	E	91.1	Very high	88.5	Confident	105 Å²	105	68.6 Å²	68.6	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-40.6	177.9	-71.2	179.2	-175.3	0	0	112.6	T416 K417 D423 K424	T416-E420 PolarHBondContact O-N 2.68Å; K417-E420 PolarHBondContact O-N 3.11Å; E420-D423 PolarHBondContact O-N 3.34Å; E420-K424 VanDerWaalsContact O-CG 3.32Å; E420-K424 WeakPolarHBondContact O-CG 3.43Å; E420-K424 PolarHBondContact O-N 3.03Å
421	E	92.2	Very high	88.6	Confident	84 Å²	84	71.2 Å²	71.2	39%	0.393	35%	0.347	S	S	.	.	H	α-helix	trans	-66.7	-38.8	175.9	-70.3	-57.1	140.1	0	0	112.1	K417 A418 I419 D423 K424 I425	K417-E421 PolarHBondContact O-N 3.01Å; K417-E421 VanDerWaalsContact O-N 3.11Å; A418-E421 PolarHBondContact O-N 3.15Å; I419-E421 VanDerWaalsContact C-N 3.32Å; I419-E421 PolarHBondContact O-N 3.34Å; E421-D423 VanDerWaalsContact C-N 3.35Å; E421-K424 PolarHBondContact O-N 2.92Å; E421-K424 IonicContact OE1-NZ 3.9Å; E421-K424 PolarHBondContact OE1-NZ 2.93Å; E421-I425 VanDerWaalsContact O-CG1 3.27Å; E421-I425 WeakPolarHBondContact O-CG1 3.48Å; E421-I425 PolarHBondContact O-N 3.43Å
422	I	91.5	Very high	88.8	Confident	17 Å²	17	71 Å²	71	9%	0.087	35%	0.35	C	S	.	.	H	α-helix	trans	-63	-43.2	174	-69.3	163.8	0	0	0	110.9	L186 L210 I213 R214 I217 A418 I419 K424 I425 S426	L186-I422 HydrophobicContact CD1-CG2 3.62Å; L210-I422 HydrophobicContact CB-CG2 4.26Å; L210-I422 HydrophobicContact CD2-CG2 4.38Å; I213-I422 HydrophobicContact CB-CD1 4.4Å; I213-I422 HydrophobicContact CG2-CD1 3.61Å; R214-I422 HydrophobicContact CB-CG2 4.21Å; I217-I422 HydrophobicContact CD1-CD1 3.48Å; I217-I422 VanDerWaalsContact CD1-CD1 3.48Å; A418-I422 WeakPolarHBondContact O-CG1 3.24Å; A418-I422 PolarHBondContact O-N 2.91Å; I419-I422 PolarHBondContact O-N 2.83Å; I419-I422 VanDerWaalsContact O-N 3.16Å; I422-K424 PolarHBondContact O-N 3Å; I422-I425 PolarHBondContact O-N 3.31Å; I422-S426 WeakPolarHBondContact O-CB 3.3Å; I422-S426 PolarHBondContact O-N 3.14Å
423	D	89.7	Confident	88.8	Confident	43 Å²	43	68.6 Å²	68.6	23%	0.23	34%	0.34	C	S	.	.	H	α-helix	trans	-64.7	-39.5	178	-73.7	-21.4	0	0	0	111.1	R214 I419 E420 E421 S426 I427	R214-D423 WeakPolarHBondContact CD-OD1 3.4Å; R214-D423 IonicContact NE-OD1 3.92Å; R214-D423 PolarHBondContact NE-OD1 2.74Å; R214-D423 VanDerWaalsContact NE-OD1 3.13Å; R214-D423 IonicContact NE-OD2 2.86Å; I419-D423 PolarHBondContact O-N 2.94Å; E420-D423 PolarHBondContact O-N 3.34Å; E421-D423 VanDerWaalsContact C-N 3.35Å; D423-S426 WeakPolarHBondContact O-CB 3.29Å; D423-S426 PolarHBondContact O-N 3Å; D423-I427 VanDerWaalsContact O-CG1 3.27Å; D423-I427 WeakPolarHBondContact O-CG1 3.35Å; D423-I427 PolarHBondContact O-N 2.76Å
424	K	90.4	Very high	88.8	Confident	110 Å²	110	65.7 Å²	65.7	48%	0.478	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-44	172.1	-72.6	172.3	-163	166.8	0	112.2	E420 E421 I422 I427 F428	E420-K424 VanDerWaalsContact O-CG 3.32Å; E420-K424 WeakPolarHBondContact O-CG 3.43Å; E420-K424 PolarHBondContact O-N 3.03Å; E421-K424 PolarHBondContact O-N 2.92Å; E421-K424 IonicContact OE1-NZ 3.9Å; E421-K424 PolarHBondContact OE1-NZ 2.93Å; I422-K424 PolarHBondContact O-N 3Å; K424-I427 PolarHBondContact O-N 3.01Å; K424-F428 WeakPolarHBondContact O-CB 3.4Å; K424-F428 PolarHBondContact O-N 3.07Å
425	I	90.2	Very high	88.8	Confident	82 Å²	82	62.5 Å²	62.5	42%	0.421	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-44.3	177.2	-70	165.3	0	0	0	110.2	L210 E421 I422 F428 I429	L210-I425 HydrophobicContact CD1-CG2 4.08Å; L210-I425 HydrophobicContact CD2-CG2 4.47Å; E421-I425 VanDerWaalsContact O-CG1 3.27Å; E421-I425 WeakPolarHBondContact O-CG1 3.48Å; E421-I425 PolarHBondContact O-N 3.43Å; I422-I425 PolarHBondContact O-N 3.31Å; I425-F428 PolarHBondContact O-N 2.9Å; I425-I429 HydrophobicContact CG2-CD1 3.67Å; I425-I429 HydrophobicContact CG2-CG1 4.36Å; I425-I429 VanDerWaalsContact O-CG1 3.29Å; I425-I429 WeakPolarHBondContact O-CG1 3.32Å; I425-I429 PolarHBondContact O-N 3.5Å
426	S	89.6	Confident	88.8	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-57	-50.4	175.2	175.2	0	0	0	0	111.6	G184 L186 I422 D423 F428 I429 T430	G184-S426 PolarHBondContact O-OG 2.78Å; L186-S426 WeakPolarHBondContact CD2-OG 3.41Å; L186-S426 WeakPolarHBondContact CG-OG 3.22Å; I422-S426 WeakPolarHBondContact O-CB 3.3Å; I422-S426 PolarHBondContact O-N 3.14Å; D423-S426 WeakPolarHBondContact O-CB 3.29Å; D423-S426 PolarHBondContact O-N 3Å; S426-F428 VanDerWaalsContact C-N 3.3Å; S426-F428 PolarHBondContact O-N 3.37Å; S426-I429 PolarHBondContact O-N 3.07Å; S426-T430 PolarHBondContact O-N 3.14Å; S426-T430 PolarHBondContact O-OG1 2.82Å
427	I	88.3	Confident	88.7	Confident	64 Å²	64	67 Å²	67	33%	0.328	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-41.8	177.6	-67.9	165.2	0	0	0	111	D423 K424 T430 R431	D423-I427 VanDerWaalsContact O-CG1 3.27Å; D423-I427 WeakPolarHBondContact O-CG1 3.35Å; D423-I427 PolarHBondContact O-N 2.76Å; K424-I427 PolarHBondContact O-N 3.01Å; I427-T430 PolarHBondContact O-N 3.44Å; I427-R431 HydrophobicContact CG2-CG 4.29Å; I427-R431 VanDerWaalsContact O-CB 3.31Å; I427-R431 WeakPolarHBondContact O-CB 3.3Å; I427-R431 PolarHBondContact O-N 3.31Å
428	F	88.6	Confident	88.6	Confident	117 Å²	117	62.1 Å²	62.1	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-63	-45.1	177.2	179.4	-108.9	0	0	0	111.9	K424 I425 S426 S432 I433	K424-F428 WeakPolarHBondContact O-CB 3.4Å; K424-F428 PolarHBondContact O-N 3.07Å; I425-F428 PolarHBondContact O-N 2.9Å; S426-F428 VanDerWaalsContact C-N 3.3Å; S426-F428 PolarHBondContact O-N 3.37Å; F428-S432 WeakPolarHBondContact O-CA 3.35Å; F428-S432 WeakPolarHBondContact O-CB 3.4Å; F428-S432 PolarHBondContact O-N 2.7Å; F428-I433 HydrophobicContact CD1-CD1 3.85Å; F428-I433 HydrophobicContact CD1-CG1 4.11Å; F428-I433 HydrophobicContact CE1-CD1 3.59Å; F428-I433 HydrophobicContact CE1-CG1 3.8Å; F428-I433 HydrophobicContact CZ-CD1 4.5Å; F428-I433 HydrophobicContact CZ-CG1 4.3Å; F428-I433 PolarHBondContact O-N 3.3Å
429	I	87.3	Confident	88.5	Confident	20 Å²	20	64.1 Å²	64.1	10%	0.103	32%	0.324	C	S	.	.	I	π-helix	trans	-61.1	-50.3	176.8	-69.8	165.1	0	0	0	110.2	F203 I206 L207 L210 I425 S426 I433 S434	F203-I429 HydrophobicContact CD1-CG2 3.88Å; F203-I429 HydrophobicContact CE1-CG2 4.27Å; I206-I429 HydrophobicContact CG2-CD1 3.95Å; L207-I429 HydrophobicContact CD2-CG2 4.36Å; L210-I429 HydrophobicContact CD1-CD1 3.61Å; I425-I429 HydrophobicContact CG2-CD1 3.67Å; I425-I429 HydrophobicContact CG2-CG1 4.36Å; I425-I429 VanDerWaalsContact O-CG1 3.29Å; I425-I429 WeakPolarHBondContact O-CG1 3.32Å; I425-I429 PolarHBondContact O-N 3.5Å; S426-I429 PolarHBondContact O-N 3.07Å; I429-I433 HydrophobicContact CG1-CD1 4.09Å; I429-I433 PolarHBondContact O-N 3.2Å; I429-S434 WeakPolarHBondContact O-CB 3.34Å; I429-S434 PolarHBondContact O-N 2.76Å
430	T	87.2	Confident	88.3	Confident	15 Å²	15	67.2 Å²	67.2	9%	0.092	34%	0.344	C	S	.	.	I	π-helix	trans	-69.3	-42.3	-175.7	-60.7	0	0	0	0	112.9	E181 S182 S426 I427 P435	E181-T430 WeakPolarHBondContact O-CG2 3.04Å; S182-T430 VanDerWaalsContact O-CG2 3.23Å; S182-T430 WeakPolarHBondContact O-CG2 3.38Å; S426-T430 PolarHBondContact O-N 3.14Å; S426-T430 PolarHBondContact O-OG1 2.82Å; I427-T430 PolarHBondContact O-N 3.44Å; T430-P435 VanDerWaalsContact O-CD 3.24Å; T430-P435 WeakPolarHBondContact O-CD 3.3Å
431	R	85.3	Confident	88.2	Confident	162 Å²	162	62.4 Å²	62.4	61%	0.611	32%	0.322	S	S	*	.	I	π-helix	trans	-90.3	-29.7	-174.9	-64.2	-171.8	-178.7	165.1	2.2	114.1	I183 I427	I183-R431 PolarHBondContact O-NH2 3.3Å; I427-R431 HydrophobicContact CG2-CG 4.29Å; I427-R431 VanDerWaalsContact O-CB 3.31Å; I427-R431 WeakPolarHBondContact O-CB 3.3Å; I427-R431 PolarHBondContact O-N 3.31Å
432	S	86.7	Confident	88.1	Confident	41 Å²	41	61 Å²	61	29%	0.287	32%	0.322	S	S	.	.	I	π-helix	trans	-109.4	-44.5	-172.4	-57	0	0	0	0	113.3	F428 K436	F428-S432 WeakPolarHBondContact O-CA 3.35Å; F428-S432 WeakPolarHBondContact O-CB 3.4Å; F428-S432 PolarHBondContact O-N 2.7Å; S432-K436 VanDerWaalsContact O-CD 3.23Å; S432-K436 WeakPolarHBondContact O-CD 3.49Å; S432-K436 VanDerWaalsContact O-CG 3.24Å; S432-K436 WeakPolarHBondContact O-CG 3.44Å
433	I	87.3	Confident	88	Confident	60 Å²	60	65.3 Å²	65.3	31%	0.308	35%	0.345	S	S	.	.	I	π-helix	trans	-85.5	-54.2	-173.8	-55.6	-176.4	0	0	0	111	F203 F428 I429 K436 V437	F203-I433 HydrophobicContact CE1-CG2 4.02Å; F203-I433 HydrophobicContact CZ-CG2 4.29Å; F428-I433 HydrophobicContact CD1-CD1 3.85Å; F428-I433 HydrophobicContact CD1-CG1 4.11Å; F428-I433 HydrophobicContact CE1-CD1 3.59Å; F428-I433 HydrophobicContact CE1-CG1 3.8Å; F428-I433 HydrophobicContact CZ-CD1 4.5Å; F428-I433 HydrophobicContact CZ-CG1 4.3Å; F428-I433 PolarHBondContact O-N 3.3Å; I429-I433 HydrophobicContact CG1-CD1 4.09Å; I429-I433 PolarHBondContact O-N 3.2Å; I433-K436 PolarHBondContact O-N 3.06Å; I433-K436 VanDerWaalsContact O-N 3.15Å; I433-V437 HydrophobicContact CG2-CG2 3.87Å; I433-V437 WeakPolarHBondContact O-CG2 3.38Å; I433-V437 PolarHBondContact O-N 2.82Å
434	S	86.2	Confident	87.9	Confident	24 Å²	24	65.8 Å²	65.8	17%	0.168	34%	0.344	C	S	.	.	H	α-helix	trans	-56.1	-48.1	-173.2	173.3	0	0	0	0	113.3	I429 K436 V437 S438	I429-S434 WeakPolarHBondContact O-CB 3.34Å; I429-S434 PolarHBondContact O-N 2.76Å; S434-K436 VanDerWaalsContact C-N 3.35Å; S434-K436 PolarHBondContact O-N 3.37Å; S434-V437 PolarHBondContact O-N 3.39Å; S434-S438 VanDerWaalsContact O-CB 3.29Å; S434-S438 WeakPolarHBondContact O-CB 3.34Å; S434-S438 PolarHBondContact O-N 3.43Å
435	P	86.1	Confident	87.8	Confident	69 Å²	69	62.1 Å²	62.1	45%	0.448	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-37.7	178.3	-23.5	35.2	0	0	0	113	T430 S439	T430-P435 VanDerWaalsContact O-CD 3.24Å; T430-P435 WeakPolarHBondContact O-CD 3.3Å; P435-S439 WeakPolarHBondContact O-CB 3.41Å; P435-S439 PolarHBondContact O-N 2.03Å
436	K	88.3	Confident	87.8	Confident	147 Å²	147	62.6 Å²	62.6	64%	0.639	34%	0.337	S	S	*	.	H	α-helix	trans	-67.9	-43.2	178	-70.6	-178.5	-173.1	176.7	0	111.6	S432 I433 S434 T440	S432-K436 VanDerWaalsContact O-CD 3.23Å; S432-K436 WeakPolarHBondContact O-CD 3.49Å; S432-K436 VanDerWaalsContact O-CG 3.24Å; S432-K436 WeakPolarHBondContact O-CG 3.44Å; I433-K436 PolarHBondContact O-N 3.06Å; I433-K436 VanDerWaalsContact O-N 3.15Å; S434-K436 VanDerWaalsContact C-N 3.35Å; S434-K436 PolarHBondContact O-N 3.37Å; K436-T440 WeakPolarHBondContact O-CB 3.26Å; K436-T440 PolarHBondContact O-N 2.8Å; K436-T440 PolarHBondContact O-OG1 3.3Å
437	V	88.1	Confident	87.7	Confident	44 Å²	44	67.7 Å²	67.7	27%	0.267	36%	0.364	S	S	.	.	H	α-helix	trans	-67.6	-40.4	177.1	172.9	0	0	0	0	110.6	L173 F203 I433 S434 T440 S441	L173-V437 HydrophobicContact CB-CG1 4.35Å; L173-V437 HydrophobicContact CD1-CG1 4.2Å; L173-V437 HydrophobicContact CD2-CG1 3.95Å; L173-V437 HydrophobicContact CG-CG1 4.42Å; F203-V437 HydrophobicContact CE2-CB 4.01Å; F203-V437 HydrophobicContact CE2-CG1 3.82Å; F203-V437 HydrophobicContact CZ-CB 3.69Å; F203-V437 HydrophobicContact CZ-CG1 3.79Å; F203-V437 HydrophobicContact CZ-CG2 3.98Å; I433-V437 HydrophobicContact CG2-CG2 3.87Å; I433-V437 WeakPolarHBondContact O-CG2 3.38Å; I433-V437 PolarHBondContact O-N 2.82Å; S434-V437 PolarHBondContact O-N 3.39Å; V437-T440 PolarHBondContact O-N 3.45Å; V437-S441 WeakPolarHBondContact O-CB 3.49Å; V437-S441 PolarHBondContact O-N 3.15Å
438	S	86.5	Confident	87.7	Confident	36 Å²	36	65 Å²	65	25%	0.252	35%	0.35	S	S	.	.	H	α-helix	trans	-62	-47.5	175.5	177.1	0	0	0	0	112.1	S434 T440 S441 S442	S434-S438 VanDerWaalsContact O-CB 3.29Å; S434-S438 WeakPolarHBondContact O-CB 3.34Å; S434-S438 PolarHBondContact O-N 3.43Å; S438-T440 PolarHBondContact O-N 3.17Å; S438-S441 WeakPolarHBondContact O-CB 3.36Å; S438-S441 PolarHBondContact O-N 3.04Å; S438-S442 PolarHBondContact O-N 3.5Å
439	S	87	Confident	87.7	Confident	78 Å²	78	62.8 Å²	62.8	55%	0.545	34%	0.343	S	S	.	.	H	α-helix	trans	-59.5	-46.8	174.8	-179.1	0	0	0	0	111.7	P435 S441 S442 L443	P435-S439 WeakPolarHBondContact O-CB 3.41Å; P435-S439 PolarHBondContact O-N 2.03Å; S439-S441 VanDerWaalsContact C-N 3.32Å; S439-S441 PolarHBondContact O-N 3.29Å; S439-S442 PolarHBondContact O-N 2.82Å; S439-S442 PolarHBondContact O-OG 3.31Å; S439-L443 PolarHBondContact O-N 3.16Å
440	T	87.1	Confident	87.9	Confident	93 Å²	93	68.6 Å²	68.6	57%	0.571	37%	0.368	S	S	*	.	H	α-helix	trans	-63.6	-38.6	177.3	-53.8	0	0	0	0	111.8	K436 V437 S438 L443 F444	K436-T440 WeakPolarHBondContact O-CB 3.26Å; K436-T440 PolarHBondContact O-N 2.8Å; K436-T440 PolarHBondContact O-OG1 3.3Å; V437-T440 PolarHBondContact O-N 3.45Å; S438-T440 PolarHBondContact O-N 3.17Å; T440-L443 PolarHBondContact O-N 3.15Å; T440-F444 WeakPolarHBondContact O-CB 3.11Å; T440-F444 PolarHBondContact O-N 3.19Å
441	S	89.6	Confident	88	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.028	37%	0.367	C	S	.	.	H	α-helix	trans	-63.8	-40.1	177.3	179.3	0	0	0	0	111.6	H170 V437 S438 S439 F444 L445	H170-S441 WeakPolarHBondContact CA-OG 3.31Å; H170-S441 PolarHBondContact ND1-O 2.94Å; H170-S441 PolarHBondContact ND1-OG 3.08Å; V437-S441 WeakPolarHBondContact O-CB 3.49Å; V437-S441 PolarHBondContact O-N 3.15Å; S438-S441 WeakPolarHBondContact O-CB 3.36Å; S438-S441 PolarHBondContact O-N 3.04Å; S439-S441 VanDerWaalsContact C-N 3.32Å; S439-S441 PolarHBondContact O-N 3.29Å; S441-F444 PolarHBondContact O-N 3.48Å; S441-L445 WeakPolarHBondContact O-CB 3.11Å; S441-L445 PolarHBondContact O-N 3.4Å
442	S	89.8	Confident	88.3	Confident	54 Å²	54	61.1 Å²	61.1	38%	0.378	34%	0.338	S	S	.	.	H	α-helix	trans	-63.2	-44	175.3	74	0	0	0	0	112	S438 S439 L445 T446	S438-S442 PolarHBondContact O-N 3.5Å; S439-S442 PolarHBondContact O-N 2.82Å; S439-S442 PolarHBondContact O-OG 3.31Å; S442-L445 WeakPolarHBondContact O-CB 3.2Å; S442-L445 PolarHBondContact O-N 2.86Å; S442-T446 PolarHBondContact O-N 3.46Å; S442-T446 PolarHBondContact O-OG1 3.26Å; S442-T446 VanDerWaalsContact O-OG1 3.08Å
443	L	88.7	Confident	88.4	Confident	109 Å²	109	64.4 Å²	64.4	57%	0.571	35%	0.348	S	S	*	.	H	α-helix	trans	-64.3	-43.1	176.2	-178.5	146.1	0	0	0	111.3	S439 T440 L445 T446 L447	S439-L443 PolarHBondContact O-N 3.16Å; T440-L443 PolarHBondContact O-N 3.15Å; L443-L445 VanDerWaalsContact C-N 3.34Å; L443-L445 PolarHBondContact O-N 3.13Å; L443-T446 PolarHBondContact O-N 3.07Å; L443-L447 HydrophobicContact CD2-CD1 3.62Å; L443-L447 HydrophobicContact CD2-CG 4.34Å; L443-L447 WeakPolarHBondContact O-CG 3.46Å; L443-L447 PolarHBondContact O-N 3.31Å
444	F	86.9	Confident	88.5	Confident	52 Å²	52	62.7 Å²	62.7	23%	0.228	34%	0.341	C	S	.	.	H	α-helix	trans	-61.7	-43	175.5	-174.4	-106.2	0	0	0	111.3	F169 T440 S441 L447 N448 F505 F837	F169-F444 AromaticContact CD1-CD1 3.86Å; F169-F444 HydrophobicContact CD1-CD1 3.86Å; F169-F444 AromaticContact CD1-CE1 3.83Å; F169-F444 HydrophobicContact CD1-CE1 3.83Å; F169-F444 AromaticContact CE1-CD1 3.94Å; F169-F444 HydrophobicContact CE1-CD1 3.94Å; F169-F444 AromaticContact CE1-CE1 3.95Å; F169-F444 HydrophobicContact CE1-CE1 3.95Å; T440-F444 WeakPolarHBondContact O-CB 3.11Å; T440-F444 PolarHBondContact O-N 3.19Å; S441-F444 PolarHBondContact O-N 3.48Å; F444-L447 PolarHBondContact O-N 3.17Å; F444-N448 WeakPolarHBondContact CD1-ND2 3.2Å; F444-N448 WeakPolarHBondContact CD2-ND2 3.3Å; F444-N448 WeakPolarHBondContact CE1-ND2 3.47Å; F444-N448 VanDerWaalsContact CE2-ND2 3.28Å; F444-N448 WeakPolarHBondContact CE2-ND2 2.96Å; F444-N448 WeakPolarHBondContact CG-ND2 3.22Å; F444-N448 WeakPolarHBondContact CZ-ND2 3.48Å; F444-N448 WeakPolarHBondContact O-CB 3.28Å; F444-N448 PolarHBondContact O-N 2.97Å; F444-N448 PolarHBondContact O-ND2 2.98Å; F444-F505 AromaticContact CE2-CZ 3.77Å; F444-F505 HydrophobicContact CE2-CZ 3.77Å; F444-F505 HydrophobicContact CZ-CE1 4.09Å; F444-F505 HydrophobicContact CZ-CE2 4.41Å; F444-F505 AromaticContact CZ-CZ 3.5Å; F444-F505 HydrophobicContact CZ-CZ 3.5Å; F444-F837 HydrophobicContact CE1-CE1 4.31Å; F444-F837 HydrophobicContact CE1-CE2 4.11Å; F444-F837 AromaticContact CE1-CZ 3.75Å; F444-F837 HydrophobicContact CE1-CZ 3.75Å; F444-F837 HydrophobicContact CZ-CZ 4.33Å
445	L	90.1	Very high	88.5	Confident	33 Å²	33	61.8 Å²	61.8	17%	0.173	33%	0.334	C	S	.	.	H	α-helix	trans	-59.3	-49.6	174.6	179.1	64.3	0	0	0	110.7	C166 H170 S441 S442 L443 L447 N448 L449	C166-L445 HydrophobicContact CB-CD1 3.82Å; H170-L445 HydrophobicContact CB-CB 4.35Å; H170-L445 HydrophobicContact CB-CD1 4.33Å; H170-L445 HydrophobicContact CB-CD2 4.03Å; H170-L445 HydrophobicContact CB-CG 4.47Å; S441-L445 WeakPolarHBondContact O-CB 3.11Å; S441-L445 PolarHBondContact O-N 3.4Å; S442-L445 WeakPolarHBondContact O-CB 3.2Å; S442-L445 PolarHBondContact O-N 2.86Å; L443-L445 VanDerWaalsContact C-N 3.34Å; L443-L445 PolarHBondContact O-N 3.13Å; L445-L447 PolarHBondContact O-N 3.39Å; L445-N448 PolarHBondContact O-N 2.68Å; L445-L449 HydrophobicContact CD1-CD1 4.2Å; L445-L449 HydrophobicContact CD1-CD2 4.33Å; L445-L449 HydrophobicContact CD1-CG 4.02Å; L445-L449 HydrophobicContact CG-CD1 3.94Å; L445-L449 HydrophobicContact CG-CG 4.19Å; L445-L449 WeakPolarHBondContact O-CB 3.3Å; L445-L449 VanDerWaalsContact O-CG 3.24Å; L445-L449 WeakPolarHBondContact O-CG 3.35Å; L445-L449 PolarHBondContact O-N 3.28Å
446	T	89.1	Confident	88.5	Confident	93 Å²	93	60.9 Å²	60.9	57%	0.571	33%	0.325	S	S	*	.	H	α-helix	trans	-58.1	-46	179.2	-54.1	0	0	0	0	112.4	S442 L443 N448 L449 F450	S442-T446 PolarHBondContact O-N 3.46Å; S442-T446 PolarHBondContact O-OG1 3.26Å; S442-T446 VanDerWaalsContact O-OG1 3.08Å; L443-T446 PolarHBondContact O-N 3.07Å; T446-N448 PolarHBondContact O-N 2.96Å; T446-L449 PolarHBondContact O-N 3.48Å; T446-F450 PolarHBondContact O-N 2.92Å
447	L	88.3	Confident	88.5	Confident	107 Å²	107	58.4 Å²	58.4	56%	0.56	32%	0.319	S	S	*	.	H	α-helix	trans	-63	-42.3	178	-71.8	176.9	0	0	0	112	L443 F444 L445 F450 F451	L443-L447 HydrophobicContact CD2-CD1 3.62Å; L443-L447 HydrophobicContact CD2-CG 4.34Å; L443-L447 WeakPolarHBondContact O-CG 3.46Å; L443-L447 PolarHBondContact O-N 3.31Å; F444-L447 PolarHBondContact O-N 3.17Å; L445-L447 PolarHBondContact O-N 3.39Å; L447-F450 PolarHBondContact O-N 3.49Å; L447-F451 WeakPolarHBondContact O-CB 3.22Å; L447-F451 PolarHBondContact O-N 2.78Å
448	N	86.9	Confident	88.2	Confident	8 Å²	8	58.2 Å²	58.2	4%	0.043	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-40.5	176.9	-79.1	-73	0	0	0	112.3	C166 F444 L445 T446 F450 F451 W452	C166-N448 HydrophobicContact CB-CB 4.32Å; C166-N448 WeakPolarHBondContact SG-CB 3.16Å; F444-N448 WeakPolarHBondContact CD1-ND2 3.2Å; F444-N448 WeakPolarHBondContact CD2-ND2 3.3Å; F444-N448 WeakPolarHBondContact CE1-ND2 3.47Å; F444-N448 VanDerWaalsContact CE2-ND2 3.28Å; F444-N448 WeakPolarHBondContact CE2-ND2 2.96Å; F444-N448 WeakPolarHBondContact CG-ND2 3.22Å; F444-N448 WeakPolarHBondContact CZ-ND2 3.48Å; F444-N448 WeakPolarHBondContact O-CB 3.28Å; F444-N448 PolarHBondContact O-N 2.97Å; F444-N448 PolarHBondContact O-ND2 2.98Å; L445-N448 PolarHBondContact O-N 2.68Å; T446-N448 PolarHBondContact O-N 2.96Å; N448-F450 VanDerWaalsContact C-N 3.3Å; N448-F450 PolarHBondContact O-N 3.39Å; N448-F451 WeakPolarHBondContact O-CB 2.95Å; N448-F451 PolarHBondContact O-N 3.36Å; N448-F451 VanDerWaalsContact O-N 3.15Å; N448-W452 PolarHBondContact O-N 3.32Å
449	L	89.7	Confident	87.8	Confident	69 Å²	69	56.8 Å²	56.8	36%	0.361	31%	0.306	S	S	.	.	H	α-helix	trans	-59.6	-43.9	175.4	-71.2	176.9	0	0	0	110.9	F163 L445 T446 F451 W452 F453	F163-L449 HydrophobicContact CD1-CD2 3.4Å; F163-L449 HydrophobicContact CE1-CD2 3.52Å; L445-L449 HydrophobicContact CD1-CD1 4.2Å; L445-L449 HydrophobicContact CD1-CD2 4.33Å; L445-L449 HydrophobicContact CD1-CG 4.02Å; L445-L449 HydrophobicContact CG-CD1 3.94Å; L445-L449 HydrophobicContact CG-CG 4.19Å; L445-L449 WeakPolarHBondContact O-CB 3.3Å; L445-L449 VanDerWaalsContact O-CG 3.24Å; L445-L449 WeakPolarHBondContact O-CG 3.35Å; L445-L449 PolarHBondContact O-N 3.28Å; T446-L449 PolarHBondContact O-N 3.48Å; L449-F451 VanDerWaalsContact C-N 3.34Å; L449-F451 PolarHBondContact O-N 2.84Å; L449-W452 PolarHBondContact O-N 3.38Å; L449-F453 WeakPolarHBondContact O-CB 2.96Å; L449-F453 PolarHBondContact O-N 3.37Å
450	F	90.8	Very high	87.7	Confident	143 Å²	143	57.8 Å²	57.8	63%	0.627	30%	0.304	S	S	*	.	H	α-helix	trans	-61.8	-42	174.7	-178.5	-95.9	0	0	0	112	T446 L447 N448 S454	T446-F450 PolarHBondContact O-N 2.92Å; L447-F450 PolarHBondContact O-N 3.49Å; N448-F450 VanDerWaalsContact C-N 3.3Å; N448-F450 PolarHBondContact O-N 3.39Å; F450-S454 WeakPolarHBondContact O-CB 3.22Å; F450-S454 PolarHBondContact O-N 3.18Å; F450-S454 PolarHBondContact O-OG 3.31Å
451	F	89.7	Confident	87.5	Confident	18 Å²	18	54.7 Å²	54.7	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-61	-52.1	175.5	176.3	-88.9	0	0	0	111.7	L447 N448 L449 F453 S454 I455 I494 F841	L447-F451 WeakPolarHBondContact O-CB 3.22Å; L447-F451 PolarHBondContact O-N 2.78Å; N448-F451 WeakPolarHBondContact O-CB 2.95Å; N448-F451 PolarHBondContact O-N 3.36Å; N448-F451 VanDerWaalsContact O-N 3.15Å; L449-F451 VanDerWaalsContact C-N 3.34Å; L449-F451 PolarHBondContact O-N 2.84Å; F451-F453 VanDerWaalsContact C-N 3.34Å; F451-F453 PolarHBondContact O-N 3.36Å; F451-S454 WeakPolarHBondContact O-CB 3.47Å; F451-S454 PolarHBondContact O-N 3.35Å; F451-S454 VanDerWaalsContact O-N 3.15Å; F451-I455 HydrophobicContact CD1-CG1 4.41Å; F451-I455 HydrophobicContact CE1-CG1 3.89Å; F451-I455 HydrophobicContact CZ-CD1 4.21Å; F451-I455 HydrophobicContact CZ-CG1 4Å; F451-I455 PolarHBondContact O-N 3.2Å; F451-I494 HydrophobicContact CD2-CG2 4.36Å; F451-I494 HydrophobicContact CE2-CG2 3.82Å; F451-F841 HydrophobicContact CD1-CD1 4.46Å; F451-F841 AromaticContact CD1-CE1 3.66Å; F451-F841 HydrophobicContact CD1-CE1 3.66Å; F451-F841 AromaticContact CE1-CD1 3.7Å; F451-F841 HydrophobicContact CE1-CD1 3.7Å; F451-F841 AromaticContact CE1-CE1 3.34Å; F451-F841 HydrophobicContact CE1-CE1 3.34Å; F451-F841 HydrophobicContact CE2-CE1 4.48Å; F451-F841 HydrophobicContact CG-CE1 4.38Å; F451-F841 AromaticContact CZ-CD1 3.91Å; F451-F841 HydrophobicContact CZ-CD1 3.91Å; F451-F841 AromaticContact CZ-CE1 3.79Å; F451-F841 HydrophobicContact CZ-CE1 3.79Å
452	W	90.5	Very high	86.8	Confident	1 Å²	1	55.2 Å²	55.2	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-37.6	-179.7	-67.2	121.9	0	0	0	112.5	V159 G162 F163 C166 N448 L449 I455 L456 L840 F841 V844	V159-W452 HydrophobicContact CB-CE3 4.43Å; V159-W452 HydrophobicContact CG1-CB 4.44Å; V159-W452 HydrophobicContact CG1-CE3 4.37Å; V159-W452 HydrophobicContact CG2-CE3 4.23Å; G162-W452 VanDerWaalsContact CA-CE2 3.49Å; G162-W452 PolarHBondContact O-NE1 2.65Å; F163-W452 HydrophobicContact CD1-CB 4.14Å; F163-W452 HydrophobicContact CD2-CB 4.14Å; F163-W452 HydrophobicContact CE1-CB 3.66Å; F163-W452 HydrophobicContact CE2-CB 3.68Å; F163-W452 HydrophobicContact CG-CB 4.35Å; F163-W452 HydrophobicContact CZ-CB 3.41Å; F163-W452 VanDerWaalsContact CZ-CB 3.41Å; C166-W452 PolarHBondContact SG-NE1 2.87Å; N448-W452 PolarHBondContact O-N 3.32Å; L449-W452 PolarHBondContact O-N 3.38Å; W452-I455 PolarHBondContact O-N 2.98Å; W452-L456 WeakPolarHBondContact O-CB 3.34Å; W452-L456 PolarHBondContact O-N 3.03Å; W452-L840 HydrophobicContact CH2-CB 4.44Å; W452-F841 HydrophobicContact CH2-CD1 4.09Å; W452-F841 HydrophobicContact CH2-CE1 4.17Å; W452-F841 HydrophobicContact CZ2-CD1 4.2Å; W452-F841 AromaticContact CZ2-CE1 3.87Å; W452-F841 HydrophobicContact CZ2-CE1 3.87Å; W452-F841 HydrophobicContact CZ2-CZ 4.08Å; W452-V844 HydrophobicContact CH2-CG2 4.02Å; W452-V844 HydrophobicContact CZ3-CB 4.29Å; W452-V844 HydrophobicContact CZ3-CG1 4.17Å; W452-V844 HydrophobicContact CZ3-CG2 3.62Å
453	F	90.6	Very high	86.2	Confident	110 Å²	110	54.8 Å²	54.8	48%	0.482	29%	0.285	S	S	.	.	H	α-helix	trans	-65.2	-38.7	173.7	-167	-101	0	0	0	112	L449 F451 L456 L457	L449-F453 WeakPolarHBondContact O-CB 2.96Å; L449-F453 PolarHBondContact O-N 3.37Å; F451-F453 VanDerWaalsContact C-N 3.34Å; F451-F453 PolarHBondContact O-N 3.36Å; F453-L456 PolarHBondContact O-N 3.2Å; F453-L457 HydrophobicContact CD1-CD1 3.71Å; F453-L457 HydrophobicContact CD1-CG 4.04Å; F453-L457 HydrophobicContact CE1-CD1 3.48Å; F453-L457 VanDerWaalsContact CE1-CD1 3.48Å; F453-L457 HydrophobicContact CE1-CD2 4.2Å; F453-L457 HydrophobicContact CE1-CG 3.83Å; F453-L457 HydrophobicContact CZ-CD1 4.39Å; F453-L457 HydrophobicContact CZ-CD2 4.32Å; F453-L457 HydrophobicContact CZ-CG 4.34Å; F453-L457 WeakPolarHBondContact O-CG 3.22Å; F453-L457 PolarHBondContact O-N 2.89Å
454	S	88.2	Confident	85.9	Confident	24 Å²	24	56.2 Å²	56.2	17%	0.168	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-43.7	174.6	-61.4	0	0	0	0	111.5	F450 F451 L457 I458	F450-S454 WeakPolarHBondContact O-CB 3.22Å; F450-S454 PolarHBondContact O-N 3.18Å; F450-S454 PolarHBondContact O-OG 3.31Å; F451-S454 WeakPolarHBondContact O-CB 3.47Å; F451-S454 PolarHBondContact O-N 3.35Å; F451-S454 VanDerWaalsContact O-N 3.15Å; S454-L457 PolarHBondContact O-N 2.59Å; S454-I458 VanDerWaalsContact O-CG1 3.28Å; S454-I458 WeakPolarHBondContact O-CG1 3.31Å; S454-I458 PolarHBondContact O-N 3.08Å
455	I	87	Confident	85.3	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-41.4	174.6	-59.7	-62.7	0	0	0	110.9	L155 V159 F451 W452 L457 I458 T459 I494 V844	L155-I455 HydrophobicContact CD1-CG2 4.42Å; V159-I455 HydrophobicContact CG2-CB 4.13Å; V159-I455 HydrophobicContact CG2-CG2 3.47Å; V159-I455 VanDerWaalsContact CG2-CG2 3.47Å; F451-I455 HydrophobicContact CD1-CG1 4.41Å; F451-I455 HydrophobicContact CE1-CG1 3.89Å; F451-I455 HydrophobicContact CZ-CD1 4.21Å; F451-I455 HydrophobicContact CZ-CG1 4Å; F451-I455 PolarHBondContact O-N 3.2Å; W452-I455 PolarHBondContact O-N 2.98Å; I455-L457 PolarHBondContact O-N 3.25Å; I455-I458 WeakPolarHBondContact O-CB 3.39Å; I455-I458 PolarHBondContact O-N 2.61Å; I455-I458 VanDerWaalsContact O-N 3.17Å; I455-T459 HydrophobicContact CG2-CG2 4.46Å; I455-T459 WeakPolarHBondContact O-CG2 3.46Å; I455-T459 PolarHBondContact O-N 2.75Å; I455-T459 PolarHBondContact O-OG1 3.24Å; I455-I494 HydrophobicContact CD1-CG2 3.65Å; I455-V844 HydrophobicContact CG1-CG1 4.41Å; I455-V844 HydrophobicContact CG2-CG1 4.06Å
456	L	85.9	Confident	84.4	Confident	50 Å²	50	54.2 Å²	54.2	26%	0.262	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-41.2	176.9	-172.4	67.1	0	0	0	112.3	V159 W452 F453 I458 T459 I460	V159-L456 HydrophobicContact CG1-CB 4.16Å; V159-L456 HydrophobicContact CG1-CD1 4.28Å; W452-L456 WeakPolarHBondContact O-CB 3.34Å; W452-L456 PolarHBondContact O-N 3.03Å; F453-L456 PolarHBondContact O-N 3.2Å; L456-I458 VanDerWaalsContact C-N 3.3Å; L456-I458 PolarHBondContact O-N 3.49Å; L456-T459 WeakPolarHBondContact CA-OG1 3.4Å; L456-T459 PolarHBondContact O-N 3.17Å; L456-T459 PolarHBondContact O-OG1 2.91Å; L456-I460 HydrophobicContact CD1-CD1 4.41Å; L456-I460 HydrophobicContact CG-CD1 4Å; L456-I460 WeakPolarHBondContact O-CB 3.04Å; L456-I460 VanDerWaalsContact O-CG1 3.28Å; L456-I460 WeakPolarHBondContact O-CG1 3.39Å; L456-I460 PolarHBondContact O-N 2.96Å
457	L	87.8	Confident	83.6	Confident	95 Å²	95	53.5 Å²	53.5	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-64.9	-37.8	174.6	-74.7	177.2	0	0	0	111.6	F453 S454 I455 G461	F453-L457 HydrophobicContact CD1-CD1 3.71Å; F453-L457 HydrophobicContact CD1-CG 4.04Å; F453-L457 HydrophobicContact CE1-CD1 3.48Å; F453-L457 VanDerWaalsContact CE1-CD1 3.48Å; F453-L457 HydrophobicContact CE1-CD2 4.2Å; F453-L457 HydrophobicContact CE1-CG 3.83Å; F453-L457 HydrophobicContact CZ-CD1 4.39Å; F453-L457 HydrophobicContact CZ-CD2 4.32Å; F453-L457 HydrophobicContact CZ-CG 4.34Å; F453-L457 WeakPolarHBondContact O-CG 3.22Å; F453-L457 PolarHBondContact O-N 2.89Å; S454-L457 PolarHBondContact O-N 2.59Å; I455-L457 PolarHBondContact O-N 3.25Å; L457-G461 WeakPolarHBondContact O-CA 3.45Å; L457-G461 PolarHBondContact O-N 3.09Å
458	I	81.4	Confident	82.8	Confident	41 Å²	41	53.9 Å²	53.9	21%	0.21	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-44.1	174.1	-69.7	165.2	0	0	0	110.4	S454 I455 L456 G461 L462 I494 M852	S454-I458 VanDerWaalsContact O-CG1 3.28Å; S454-I458 WeakPolarHBondContact O-CG1 3.31Å; S454-I458 PolarHBondContact O-N 3.08Å; I455-I458 WeakPolarHBondContact O-CB 3.39Å; I455-I458 PolarHBondContact O-N 2.61Å; I455-I458 VanDerWaalsContact O-N 3.17Å; L456-I458 VanDerWaalsContact C-N 3.3Å; L456-I458 PolarHBondContact O-N 3.49Å; I458-G461 PolarHBondContact O-N 3.28Å; I458-L462 HydrophobicContact CG2-CD1 3.74Å; I458-L462 HydrophobicContact CG2-CG 4.27Å; I458-L462 WeakPolarHBondContact O-CB 3.2Å; I458-L462 WeakPolarHBondContact O-CG 3.48Å; I458-L462 PolarHBondContact O-N 3.27Å; I458-I494 HydrophobicContact CD1-CD1 3.87Å; I458-M852 HydrophobicContact CG2-SD 4.15Å
459	T	79.4	Confident	81.8	Confident	6 Å²	6	54.9 Å²	54.9	4%	0.037	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-46.7	178.6	54.5	0	0	0	0	112.2	L155 I455 L456 G461 L462 M463	L155-T459 HydrophobicContact CB-CG2 4.19Å; L155-T459 HydrophobicContact CD2-CG2 3.29Å; L155-T459 HydrophobicContact CG-CG2 3.51Å; I455-T459 HydrophobicContact CG2-CG2 4.46Å; I455-T459 WeakPolarHBondContact O-CG2 3.46Å; I455-T459 PolarHBondContact O-N 2.75Å; I455-T459 PolarHBondContact O-OG1 3.24Å; L456-T459 WeakPolarHBondContact CA-OG1 3.4Å; L456-T459 PolarHBondContact O-N 3.17Å; L456-T459 PolarHBondContact O-OG1 2.91Å; T459-G461 VanDerWaalsContact C-N 3.33Å; T459-G461 PolarHBondContact O-N 2.89Å; T459-L462 PolarHBondContact O-N 2.94Å; T459-M463 WeakPolarHBondContact O-CB 3.36Å; T459-M463 WeakPolarHBondContact O-CG 3.03Å; T459-M463 PolarHBondContact O-N 2.84Å
460	I	83.5	Confident	80.6	Confident	99 Å²	99	54.8 Å²	54.8	51%	0.508	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-44.9	176.2	-66.9	169	0	0	0	110	L456 L462 M463 W464	L456-I460 HydrophobicContact CD1-CD1 4.41Å; L456-I460 HydrophobicContact CG-CD1 4Å; L456-I460 WeakPolarHBondContact O-CB 3.04Å; L456-I460 VanDerWaalsContact O-CG1 3.28Å; L456-I460 WeakPolarHBondContact O-CG1 3.39Å; L456-I460 PolarHBondContact O-N 2.96Å; I460-L462 PolarHBondContact O-N 3.34Å; I460-M463 PolarHBondContact O-N 3.24Å; I460-W464 VanDerWaalsContact O-CB 3.3Å; I460-W464 WeakPolarHBondContact O-CB 3.38Å; I460-W464 PolarHBondContact O-N 3.14Å
461	G	83.2	Confident	79.2	Confident	27 Å²	27	54.3 Å²	54.3	28%	0.278	26%	0.259	S	S	.	.	H	α-helix	trans	-60.2	-45.3	177.7	0	0	0	0	0	112.4	L457 I458 T459 W464 L465	L457-G461 WeakPolarHBondContact O-CA 3.45Å; L457-G461 PolarHBondContact O-N 3.09Å; I458-G461 PolarHBondContact O-N 3.28Å; T459-G461 VanDerWaalsContact C-N 3.33Å; T459-G461 PolarHBondContact O-N 2.89Å; G461-W464 PolarHBondContact O-N 3.38Å; G461-L465 WeakPolarHBondContact O-CB 3.49Å; G461-L465 WeakPolarHBondContact O-CG 3.3Å; G461-L465 PolarHBondContact O-N 3.02Å
462	L	75.7	Confident	77.7	Confident	16 Å²	16	56.7 Å²	56.7	8%	0.084	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-48.9	175.6	-71.2	167.3	0	0	0	111.3	I458 T459 I460 W464 L465 I466 I851 M852	I458-L462 HydrophobicContact CG2-CD1 3.74Å; I458-L462 HydrophobicContact CG2-CG 4.27Å; I458-L462 WeakPolarHBondContact O-CB 3.2Å; I458-L462 WeakPolarHBondContact O-CG 3.48Å; I458-L462 PolarHBondContact O-N 3.27Å; T459-L462 PolarHBondContact O-N 2.94Å; I460-L462 PolarHBondContact O-N 3.34Å; L462-W464 VanDerWaalsContact C-N 3.29Å; L462-W464 PolarHBondContact O-N 3.34Å; L462-L465 PolarHBondContact O-N 3.46Å; L462-L465 VanDerWaalsContact O-N 3.15Å; L462-I466 HydrophobicContact CB-CD1 4.41Å; L462-I466 WeakPolarHBondContact O-CB 3.44Å; L462-I466 VanDerWaalsContact O-CD1 3.22Å; L462-I466 WeakPolarHBondContact O-CD1 3.36Å; L462-I466 WeakPolarHBondContact O-CG1 3.01Å; L462-I466 PolarHBondContact O-N 3.47Å; L462-I851 HydrophobicContact CD1-CG2 3.82Å; L462-M852 HydrophobicContact CD1-CG 4.34Å; L462-M852 HydrophobicContact CD1-SD 3.37Å; L462-M852 WeakPolarHBondContact CD1-SD 3.26Å; L462-M852 HydrophobicContact CD2-SD 3.73Å; L462-M852 HydrophobicContact CG-SD 4.03Å
463	M	76.7	Confident	76	Confident	45 Å²	45	62.7 Å²	62.7	22%	0.222	31%	0.314	C	S	.	.	H	α-helix	trans	-56	-46	177.2	-78.4	-61.6	-75.5	0	0	111.7	T149 T152 T459 I460 I466 I467	T149-M463 HydrophobicContact CG2-CE 4.38Å; T152-M463 VanDerWaalsContact CB-SD 3.51Å; T152-M463 HydrophobicContact CG2-CG 3.25Å; T152-M463 HydrophobicContact CG2-SD 3.5Å; T152-M463 WeakPolarHBondContact CG2-SD 3.15Å; T152-M463 PolarHBondContact OG1-SD 3.34Å; T459-M463 WeakPolarHBondContact O-CB 3.36Å; T459-M463 WeakPolarHBondContact O-CG 3.03Å; T459-M463 PolarHBondContact O-N 2.84Å; I460-M463 PolarHBondContact O-N 3.24Å; M463-I466 PolarHBondContact O-N 3.23Å; M463-I466 HydrophobicContact SD-CD1 4.42Å; M463-I467 WeakPolarHBondContact O-CB 3.4Å; M463-I467 VanDerWaalsContact O-CG1 3.24Å; M463-I467 WeakPolarHBondContact O-CG1 3.19Å; M463-I467 PolarHBondContact O-N 3.19Å
464	W	81.6	Confident	74.4	Confident	139 Å²	139	59.9 Å²	59.9	53%	0.527	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-42	177.9	-179.6	78.8	0	0	0	112.3	I460 G461 L462 I466 I467 R468	I460-W464 VanDerWaalsContact O-CB 3.3Å; I460-W464 WeakPolarHBondContact O-CB 3.38Å; I460-W464 PolarHBondContact O-N 3.14Å; G461-W464 PolarHBondContact O-N 3.38Å; L462-W464 VanDerWaalsContact C-N 3.29Å; L462-W464 PolarHBondContact O-N 3.34Å; W464-I466 VanDerWaalsContact C-N 3.34Å; W464-I467 PolarHBondContact O-N 2.96Å; W464-R468 WeakPolarHBondContact O-CB 3.41Å; W464-R468 PolarHBondContact O-N 2.92Å
465	L	74.6	Confident	73.2	Confident	30 Å²	30	65.6 Å²	65.6	16%	0.157	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-41.3	174.9	-72.7	170.5	0	0	0	111.8	G461 L462 Y469 I484 L859	G461-L465 WeakPolarHBondContact O-CB 3.49Å; G461-L465 WeakPolarHBondContact O-CG 3.3Å; G461-L465 PolarHBondContact O-N 3.02Å; L462-L465 PolarHBondContact O-N 3.46Å; L462-L465 VanDerWaalsContact O-N 3.15Å; L465-Y469 HydrophobicContact CB-CD2 4.43Å; L465-Y469 HydrophobicContact CD2-CD2 3.99Å; L465-Y469 HydrophobicContact CD2-CE2 3.54Å; L465-Y469 WeakPolarHBondContact O-CB 3.11Å; L465-Y469 VanDerWaalsContact O-CD2 3.32Å; L465-Y469 WeakPolarHBondContact O-CD2 3.43Å; L465-Y469 PolarHBondContact O-N 3.21Å; L465-I484 HydrophobicContact CD1-CG1 4.36Å; L465-I484 HydrophobicContact CD2-CD1 4.19Å; L465-I484 HydrophobicContact CD2-CG1 4.28Å; L465-L859 HydrophobicContact CB-CD1 4.47Å
466	I	71.2	Confident	72.1	Confident	12 Å²	12	66.7 Å²	66.7	6%	0.062	34%	0.336	C	S	.	.	H	α-helix	trans	-61.7	-53	176.3	-66.8	155.1	0	0	0	109.1	F145 L148 L462 M463 W464 R468 H470	F145-I466 HydrophobicContact CD2-CG2 3.93Å; F145-I466 HydrophobicContact CE2-CG2 3.89Å; L148-I466 HydrophobicContact CD2-CB 4.33Å; L148-I466 HydrophobicContact CD2-CD1 3.16Å; L148-I466 HydrophobicContact CD2-CG1 3.47Å; L148-I466 VanDerWaalsContact CD2-CG1 3.47Å; L148-I466 HydrophobicContact CD2-CG2 3.88Å; L148-I466 HydrophobicContact CG-CD1 3.7Å; L462-I466 HydrophobicContact CB-CD1 4.41Å; L462-I466 WeakPolarHBondContact O-CB 3.44Å; L462-I466 VanDerWaalsContact O-CD1 3.22Å; L462-I466 WeakPolarHBondContact O-CD1 3.36Å; L462-I466 WeakPolarHBondContact O-CG1 3.01Å; L462-I466 PolarHBondContact O-N 3.47Å; M463-I466 PolarHBondContact O-N 3.23Å; M463-I466 HydrophobicContact SD-CD1 4.42Å; W464-I466 VanDerWaalsContact C-N 3.34Å; I466-R468 PolarHBondContact O-N 2.82Å; I466-H470 WeakPolarHBondContact O-CB 3.15Å; I466-H470 PolarHBondContact O-N 3.43Å
467	I	72.3	Confident	71.3	Confident	79 Å²	79	67.4 Å²	67.4	41%	0.405	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-50.7	-179.6	-67.9	165.3	0	0	0	110	M463 W464 F471	M463-I467 WeakPolarHBondContact O-CB 3.4Å; M463-I467 VanDerWaalsContact O-CG1 3.24Å; M463-I467 WeakPolarHBondContact O-CG1 3.19Å; M463-I467 PolarHBondContact O-N 3.19Å; W464-I467 PolarHBondContact O-N 2.96Å; I467-F471 HydrophobicContact CB-CD2 4.33Å; I467-F471 HydrophobicContact CG2-CD2 3.94Å; I467-F471 WeakPolarHBondContact O-CB 3.48Å; I467-F471 WeakPolarHBondContact O-CD2 3.35Å; I467-F471 PolarHBondContact O-N 3.03Å
468	R	71.3	Confident	70.4	Confident	115 Å²	115	67.5 Å²	67.5	43%	0.434	35%	0.346	S	S	.	.	H	α-helix	trans	-63.2	-48.4	-175.3	-173.9	174.7	-177.8	167.3	3.5	112.6	W464 I466 V472	W464-R468 WeakPolarHBondContact O-CB 3.41Å; W464-R468 PolarHBondContact O-N 2.92Å; I466-R468 PolarHBondContact O-N 2.82Å; R468-V472 WeakPolarHBondContact O-CB 3.25Å; R468-V472 VanDerWaalsContact O-CG2 3.31Å; R468-V472 WeakPolarHBondContact O-CG2 3.5Å; R468-V472 PolarHBondContact O-N 3.29Å
469	Y	66.7	Low	70	Confident	28 Å²	28	71.1 Å²	71.1	11%	0.11	36%	0.361	C	S	.	.	H	α-helix	trans	-86	-14.3	-173.8	-70.7	-62.2	0	0	0	114.3	L465 I476 T480 I484 L859	L465-Y469 HydrophobicContact CB-CD2 4.43Å; L465-Y469 HydrophobicContact CD2-CD2 3.99Å; L465-Y469 HydrophobicContact CD2-CE2 3.54Å; L465-Y469 WeakPolarHBondContact O-CB 3.11Å; L465-Y469 VanDerWaalsContact O-CD2 3.32Å; L465-Y469 WeakPolarHBondContact O-CD2 3.43Å; L465-Y469 PolarHBondContact O-N 3.21Å; Y469-I476 HydrophobicContact CD1-CD1 4.06Å; Y469-I476 HydrophobicContact CD1-CG1 3.54Å; Y469-I476 HydrophobicContact CD2-CD1 4.35Å; Y469-I476 HydrophobicContact CD2-CG1 4.5Å; Y469-I476 HydrophobicContact CE1-CB 4.42Å; Y469-I476 HydrophobicContact CE1-CD1 4.29Å; Y469-I476 HydrophobicContact CE1-CG1 3.45Å; Y469-I476 VanDerWaalsContact CE1-CG1 3.45Å; Y469-I476 HydrophobicContact CE2-CG1 4.39Å; Y469-I476 HydrophobicContact CG-CD1 4.1Å; Y469-I476 HydrophobicContact CG-CG1 4.09Å; Y469-T480 VanDerWaalsContact OH-CG2 3.31Å; Y469-T480 WeakPolarHBondContact OH-CG2 3.29Å; Y469-I484 HydrophobicContact CE2-CD1 4.15Å; Y469-L859 HydrophobicContact CD2-CD2 3.75Å; Y469-L859 HydrophobicContact CG-CD2 4.09Å
470	H	64.2	Low	69.7	Low	67 Å²	67	72.8 Å²	72.8	31%	0.31	37%	0.372	S	S	.	.	H	α-helix	trans	-97.1	-36.4	179.1	-151.6	-51.4	0	0	0	113.1	I466	I466-H470 WeakPolarHBondContact O-CB 3.15Å; I466-H470 PolarHBondContact O-N 3.43Å
471	F	61.7	Low	69.2	Low	133 Å²	133	70 Å²	70	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-88.3	-28.9	175.4	-70	-76.9	0	0	0	113.2	F145 I467	F145-F471 HydrophobicContact CE1-CZ 4.39Å; F145-F471 AromaticContact CE2-CE2 3.74Å; F145-F471 HydrophobicContact CE2-CE2 3.74Å; F145-F471 HydrophobicContact CE2-CZ 4.17Å; F145-F471 AromaticContact CZ-CE2 3.82Å; F145-F471 HydrophobicContact CZ-CE2 3.82Å; F145-F471 AromaticContact CZ-CZ 3.98Å; F145-F471 HydrophobicContact CZ-CZ 3.98Å; I467-F471 HydrophobicContact CB-CD2 4.33Å; I467-F471 HydrophobicContact CG2-CD2 3.94Å; I467-F471 WeakPolarHBondContact O-CB 3.48Å; I467-F471 WeakPolarHBondContact O-CD2 3.35Å; I467-F471 PolarHBondContact O-N 3.03Å
472	V	58.8	Low	68.8	Low	68 Å²	68	70.2 Å²	70.2	41%	0.412	35%	0.35	S	S	.	.	S	Bend	trans	-100.2	123.4	179	-163	0	0	0	0	109	R468 T474	R468-V472 WeakPolarHBondContact O-CB 3.25Å; R468-V472 VanDerWaalsContact O-CG2 3.31Å; R468-V472 WeakPolarHBondContact O-CG2 3.5Å; R468-V472 PolarHBondContact O-N 3.29Å; V472-T474 HydrophobicContact CB-CG2 4.31Å; V472-T474 HydrophobicContact CG1-CG2 3.53Å; V472-T474 PolarHBondContact O-N 3.11Å; V472-T474 PolarHBondContact O-OG1 2.89Å
473	P	54.6	Low	69.1	Low	127 Å²	127	77.4 Å²	77.4	83%	0.825	38%	0.376	S	S	*	.			trans	-71.8	62.3	174.4	31.4	-35.2	0	0	0	110.6
474	T	56.5	Low	69.3	Low	51 Å²	51	76.2 Å²	76.2	31%	0.313	37%	0.37	S	S	.	.			trans	-106.1	140.1	177.4	46.5	0	0	0	0	110	V472 K862	V472-T474 HydrophobicContact CB-CG2 4.31Å; V472-T474 HydrophobicContact CG1-CG2 3.53Å; V472-T474 PolarHBondContact O-N 3.11Å; V472-T474 PolarHBondContact O-OG1 2.89Å; T474-K862 PolarHBondContact O-NZ 3.12Å
475	E	63.3	Low	69.3	Low	144 Å²	144	70.6 Å²	70.6	67%	0.673	35%	0.349	S	S	*	.			trans	-83.3	139.9	174	-67.9	178.9	-174	0	0	110.3	S477 I865	E475-S477 PolarHBondContact O-N 3.46Å; E475-I865 WeakPolarHBondContact OE1-CD1 2.95Å; E475-I865 WeakPolarHBondContact OE2-CD1 3.46Å
476	I	64.1	Low	69.6	Low	29 Å²	29	73 Å²	73	15%	0.149	36%	0.361	C	S	.	.			trans	-85.6	109.8	178.2	-55.4	172.2	0	0	0	107.2	Y469 T480 R481 I484 L859	Y469-I476 HydrophobicContact CD1-CD1 4.06Å; Y469-I476 HydrophobicContact CD1-CG1 3.54Å; Y469-I476 HydrophobicContact CD2-CD1 4.35Å; Y469-I476 HydrophobicContact CD2-CG1 4.5Å; Y469-I476 HydrophobicContact CE1-CB 4.42Å; Y469-I476 HydrophobicContact CE1-CD1 4.29Å; Y469-I476 HydrophobicContact CE1-CG1 3.45Å; Y469-I476 VanDerWaalsContact CE1-CG1 3.45Å; Y469-I476 HydrophobicContact CE2-CG1 4.39Å; Y469-I476 HydrophobicContact CG-CD1 4.1Å; Y469-I476 HydrophobicContact CG-CG1 4.09Å; I476-T480 HydrophobicContact CG2-CG2 4.15Å; I476-R481 HydrophobicContact CG2-CB 3.86Å; I476-R481 HydrophobicContact CG2-CG 4.5Å; I476-I484 HydrophobicContact CG2-CD1 4.18Å; I476-L859 HydrophobicContact CD1-CD2 4.1Å
477	S	68.2	Low	70.2	Confident	65 Å²	65	74.4 Å²	74.4	46%	0.455	38%	0.378	S	S	.	.			trans	-56.2	149.9	172.8	75.2	0	0	0	0	110.9	E475 H479 T480 R481	E475-S477 PolarHBondContact O-N 3.46Å; S477-H479 PolarHBondContact O-N 2.99Å; S477-H479 VanDerWaalsContact O-N 3.16Å; S477-T480 PolarHBondContact O-N 3.2Å; S477-T480 PolarHBondContact OG-N 3.2Å; S477-T480 PolarHBondContact OG-OG1 3.27Å; S477-R481 PolarHBondContact O-N 3.2Å
478	L	68.9	Low	70.7	Confident	97 Å²	97	70.9 Å²	70.9	51%	0.508	36%	0.361	S	S	.	.	H	α-helix	trans	-57	-35.4	-177.7	-163.6	117.2	0	0	0	112.2	I91 R481 N482	I91-L478 HydrophobicContact CG2-CD1 4.4Å; L478-R481 PolarHBondContact O-N 3.31Å; L478-N482 VanDerWaalsContact O-CG 3.31Å; L478-N482 PolarHBondContact O-N 3.44Å; L478-N482 PolarHBondContact O-ND2 3.5Å
479	H	72.9	Confident	71.4	Confident	116 Å²	116	66 Å²	66	54%	0.537	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-46.4	175.8	-165	57	0	0	0	112.1	S477 R481 N482 R483	S477-H479 PolarHBondContact O-N 2.99Å; S477-H479 VanDerWaalsContact O-N 3.16Å; H479-R481 VanDerWaalsContact C-N 3.34Å; H479-R481 PolarHBondContact O-N 2.98Å; H479-N482 PolarHBondContact O-N 3.24Å; H479-R483 PolarHBondContact NE2-NH2 3.4Å; H479-R483 PolarHBondContact O-N 3.07Å
480	T	73.1	Confident	72.4	Confident	42 Å²	42	69.1 Å²	69.1	26%	0.258	36%	0.362	S	S	.	.	H	α-helix	trans	-65.2	-38.6	177.3	-55.2	0	0	0	0	111.5	Y469 I476 S477 N482 R483 I484	Y469-T480 VanDerWaalsContact OH-CG2 3.31Å; Y469-T480 WeakPolarHBondContact OH-CG2 3.29Å; I476-T480 HydrophobicContact CG2-CG2 4.15Å; S477-T480 PolarHBondContact O-N 3.2Å; S477-T480 PolarHBondContact OG-N 3.2Å; S477-T480 PolarHBondContact OG-OG1 3.27Å; T480-N482 VanDerWaalsContact C-N 3.3Å; T480-N482 PolarHBondContact O-N 3.38Å; T480-R483 WeakPolarHBondContact O-CB 3.39Å; T480-R483 PolarHBondContact O-N 2.76Å; T480-R483 VanDerWaalsContact O-N 3.13Å; T480-I484 HydrophobicContact CG2-CD1 4.18Å; T480-I484 WeakPolarHBondContact O-CG1 3.48Å; T480-I484 PolarHBondContact O-N 2.76Å
481	R	73.7	Confident	73.5	Confident	39 Å²	39	66 Å²	66	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-61.3	-39	174.8	-161.7	173.3	-171.3	165.3	-0.9	112.2	I476 S477 L478 H479 I484 R485 M860 K862	I476-R481 HydrophobicContact CG2-CB 3.86Å; I476-R481 HydrophobicContact CG2-CG 4.5Å; S477-R481 PolarHBondContact O-N 3.2Å; L478-R481 PolarHBondContact O-N 3.31Å; H479-R481 VanDerWaalsContact C-N 3.34Å; H479-R481 PolarHBondContact O-N 2.98Å; R481-I484 PolarHBondContact O-N 2.74Å; R481-R485 WeakPolarHBondContact O-CG 3.4Å; R481-R485 PolarHBondContact O-N 2.93Å; R481-M860 HydrophobicContact CG-CE 4.05Å; R481-M860 HydrophobicContact CG-SD 3.57Å; R481-M860 VanDerWaalsContact CG-SD 3.57Å; R481-M860 PolarHBondContact NE-SD 3.4Å; R481-M860 VanDerWaalsContact NH2-C 3.34Å; R481-M860 PolarHBondContact NH2-O 3.32Å; R481-K862 PolarHBondContact NH1-O 3.39Å; R481-K862 PolarHBondContact NH2-O 2.99Å
482	N	75.6	Confident	74.8	Confident	33 Å²	33	59.8 Å²	59.8	18%	0.176	32%	0.321	C	S	.	.	H	α-helix	trans	-68.4	-37.5	174.3	-73.2	-24.2	0	0	0	112.3	L478 H479 T480 R485 L486	L478-N482 VanDerWaalsContact O-CG 3.31Å; L478-N482 PolarHBondContact O-N 3.44Å; L478-N482 PolarHBondContact O-ND2 3.5Å; H479-N482 PolarHBondContact O-N 3.24Å; T480-N482 VanDerWaalsContact C-N 3.3Å; T480-N482 PolarHBondContact O-N 3.38Å; N482-R485 PolarHBondContact O-N 3.03Å; N482-L486 WeakPolarHBondContact O-CB 3.45Å; N482-L486 PolarHBondContact O-N 3.1Å
483	R	81.5	Confident	76.2	Confident	166 Å²	166	59.8 Å²	59.8	63%	0.626	32%	0.323	S	S	*	.	H	α-helix	trans	-64.1	-43.4	172.9	-71.4	-178.1	177.2	-175.1	-3.4	111.9	H479 T480 L486 G487	H479-R483 PolarHBondContact NE2-NH2 3.4Å; H479-R483 PolarHBondContact O-N 3.07Å; T480-R483 WeakPolarHBondContact O-CB 3.39Å; T480-R483 PolarHBondContact O-N 2.76Å; T480-R483 VanDerWaalsContact O-N 3.13Å; R483-L486 PolarHBondContact O-N 2.86Å; R483-G487 PolarHBondContact O-N 3Å
484	I	79.8	Confident	77.9	Confident	20 Å²	20	55.6 Å²	55.6	10%	0.103	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-46.8	175.2	-67.9	166.7	0	0	0	110.5	L465 Y469 I476 T480 R481 L486 G487 A488 L859	L465-I484 HydrophobicContact CD1-CG1 4.36Å; L465-I484 HydrophobicContact CD2-CD1 4.19Å; L465-I484 HydrophobicContact CD2-CG1 4.28Å; Y469-I484 HydrophobicContact CE2-CD1 4.15Å; I476-I484 HydrophobicContact CG2-CD1 4.18Å; T480-I484 HydrophobicContact CG2-CD1 4.18Å; T480-I484 WeakPolarHBondContact O-CG1 3.48Å; T480-I484 PolarHBondContact O-N 2.76Å; R481-I484 PolarHBondContact O-N 2.74Å; I484-L486 VanDerWaalsContact C-N 3.33Å; I484-L486 PolarHBondContact O-N 3.33Å; I484-G487 PolarHBondContact O-N 2.9Å; I484-A488 VanDerWaalsContact O-CB 3.31Å; I484-A488 WeakPolarHBondContact O-CB 3.36Å; I484-A488 PolarHBondContact O-N 3.14Å; I484-L859 HydrophobicContact CG2-CD1 4.13Å
485	R	81.5	Confident	79.6	Confident	22 Å²	22	53.5 Å²	53.5	8%	0.083	28%	0.281	C	S	.	.	H	α-helix	trans	-60.3	-40.5	175.9	-78.3	175.4	165.8	162	-7.1	112.7	R481 N482 A488 S489 M860	R481-R485 WeakPolarHBondContact O-CG 3.4Å; R481-R485 PolarHBondContact O-N 2.93Å; N482-R485 PolarHBondContact O-N 3.03Å; R485-A488 PolarHBondContact O-N 3.34Å; R485-S489 WeakPolarHBondContact O-CB 3.2Å; R485-S489 PolarHBondContact O-N 3.45Å; R485-M860 HydrophobicContact CG-CE 4.46Å; R485-M860 HydrophobicContact CG-SD 4.35Å
486	L	82	Confident	80.9	Confident	80 Å²	80	47 Å²	47	42%	0.419	25%	0.251	S	S	.	.	H	α-helix	trans	-64.7	-50.4	177.1	-179.9	66.4	0	0	0	111	N482 R483 I484 A488 S489 I490	N482-L486 WeakPolarHBondContact O-CB 3.45Å; N482-L486 PolarHBondContact O-N 3.1Å; R483-L486 PolarHBondContact O-N 2.86Å; I484-L486 VanDerWaalsContact C-N 3.33Å; I484-L486 PolarHBondContact O-N 3.33Å; L486-A488 PolarHBondContact O-N 3.28Å; L486-S489 PolarHBondContact O-N 2.87Å; L486-I490 HydrophobicContact CD1-CD1 4.46Å; L486-I490 HydrophobicContact CG-CD1 4.19Å; L486-I490 WeakPolarHBondContact O-CG1 3.13Å; L486-I490 PolarHBondContact O-N 3.49Å
487	G	83.4	Confident	82.2	Confident	41 Å²	41	51.1 Å²	51.1	42%	0.423	27%	0.268	S	S	.	.	H	α-helix	trans	-57.6	-38.6	175.9	0	0	0	0	0	111.7	R483 I484 I490 G491	R483-G487 PolarHBondContact O-N 3Å; I484-G487 PolarHBondContact O-N 2.9Å; G487-I490 PolarHBondContact O-N 3.48Å; G487-G491 PolarHBondContact O-N 3.36Å
488	A	83.6	Confident	83.4	Confident	5 Å²	5	48 Å²	48	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-71.1	-38.6	177.8	0	0	0	0	0	114.2	I484 R485 L486 I490 G491 F492 M852 L856	I484-A488 VanDerWaalsContact O-CB 3.31Å; I484-A488 WeakPolarHBondContact O-CB 3.36Å; I484-A488 PolarHBondContact O-N 3.14Å; R485-A488 PolarHBondContact O-N 3.34Å; L486-A488 PolarHBondContact O-N 3.28Å; A488-I490 VanDerWaalsContact C-N 3.32Å; A488-G491 PolarHBondContact O-N 2.71Å; A488-F492 WeakPolarHBondContact O-CD2 3.4Å; A488-F492 PolarHBondContact O-N 2.9Å; A488-M852 HydrophobicContact CB-CE 3.43Å; A488-M852 VanDerWaalsContact CB-CE 3.43Å; A488-L856 HydrophobicContact CB-CD1 3.93Å; A488-L856 HydrophobicContact CB-CD2 3.77Å; A488-L856 HydrophobicContact CB-CG 4.13Å
489	S	85.4	Confident	84.6	Confident	14 Å²	14	44.4 Å²	44.4	10%	0.098	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-43.1	172.2	173.3	0	0	0	0	111.1	S81 R485 L486 F492 C493	S81-S489 PolarHBondContact O-OG 2.93Å; S81-S489 PolarHBondContact OG-O 3.46Å; S81-S489 PolarHBondContact OG-OG 3.41Å; R485-S489 WeakPolarHBondContact O-CB 3.2Å; R485-S489 PolarHBondContact O-N 3.45Å; L486-S489 PolarHBondContact O-N 2.87Å; S489-F492 PolarHBondContact O-N 2.97Å; S489-C493 PolarHBondContact O-N 2.9Å; S489-C493 PolarHBondContact O-SG 3.08Å
490	I	87.6	Confident	85.5	Confident	92 Å²	92	42.4 Å²	42.4	47%	0.472	22%	0.22	S	C	.	.	H	α-helix	trans	-62	-45.7	173.6	-65.2	166.8	0	0	0	110.6	L486 G487 A488 F492 C493 I494	L486-I490 HydrophobicContact CD1-CD1 4.46Å; L486-I490 HydrophobicContact CG-CD1 4.19Å; L486-I490 WeakPolarHBondContact O-CG1 3.13Å; L486-I490 PolarHBondContact O-N 3.49Å; G487-I490 PolarHBondContact O-N 3.48Å; A488-I490 VanDerWaalsContact C-N 3.32Å; I490-F492 VanDerWaalsContact C-N 3.35Å; I490-F492 PolarHBondContact O-N 3.46Å; I490-C493 WeakPolarHBondContact O-CB 3.45Å; I490-C493 PolarHBondContact O-N 3.25Å; I490-C493 VanDerWaalsContact O-N 3.09Å; I490-I494 HydrophobicContact CG2-CD1 3.99Å; I490-I494 WeakPolarHBondContact O-CG1 3.24Å; I490-I494 PolarHBondContact O-N 3.48Å
491	G	87.5	Confident	86.4	Confident	2 Å²	2	42 Å²	42	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-57.2	-44.3	176.1	0	0	0	0	0	112.9	G487 A488 C493 I494 L495	G487-G491 PolarHBondContact O-N 3.36Å; A488-G491 PolarHBondContact O-N 2.71Å; G491-C493 VanDerWaalsContact C-N 3.33Å; G491-C493 PolarHBondContact O-N 2.76Å; G491-I494 PolarHBondContact O-N 3.29Å; G491-L495 VanDerWaalsContact O-CG 3.31Å; G491-L495 WeakPolarHBondContact O-CG 3.36Å; G491-L495 PolarHBondContact O-N 2.85Å
492	F	89	Confident	87.3	Confident	3 Å²	3	40.3 Å²	40.3	1%	0.013	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-35.6	174.5	-72.1	-55.1	0	0	0	113.2	L77 V80 T84 A488 S489 I490 L495 A496 M852 L856	L77-F492 HydrophobicContact CD2-CD1 3.89Å; L77-F492 HydrophobicContact CD2-CE1 4.43Å; V80-F492 HydrophobicContact CG1-CD2 3.88Å; V80-F492 HydrophobicContact CG1-CE1 4.18Å; V80-F492 HydrophobicContact CG1-CE2 3.47Å; V80-F492 VanDerWaalsContact CG1-CE2 3.47Å; V80-F492 HydrophobicContact CG1-CG 4.38Å; V80-F492 HydrophobicContact CG1-CZ 3.65Å; T84-F492 HydrophobicContact CG2-CE2 4.46Å; A488-F492 WeakPolarHBondContact O-CD2 3.4Å; A488-F492 PolarHBondContact O-N 2.9Å; S489-F492 PolarHBondContact O-N 2.97Å; I490-F492 VanDerWaalsContact C-N 3.35Å; I490-F492 PolarHBondContact O-N 3.46Å; F492-L495 HydrophobicContact CD1-CD1 4.27Å; F492-L495 PolarHBondContact O-N 3.22Å; F492-A496 WeakPolarHBondContact O-CB 3.44Å; F492-A496 PolarHBondContact O-N 2.92Å; F492-M852 HydrophobicContact CD1-CB 4.44Å; F492-M852 HydrophobicContact CE1-CB 3.63Å; F492-M852 HydrophobicContact CE1-CG 4.48Å; F492-M852 HydrophobicContact CZ-CB 3.77Å; F492-L856 HydrophobicContact CE2-CD1 3.38Å; F492-L856 HydrophobicContact CZ-CD1 3.65Å
493	C	88.7	Confident	88.1	Confident	67 Å²	67	39.5 Å²	39.5	45%	0.453	21%	0.208	S	C	.	.	H	α-helix	trans	-65.3	-39.8	173.6	-66.7	0	0	0	0	111.9	S81 S489 I490 G491 A496 F497	S81-C493 PolarHBondContact OG-SG 3.37Å; S81-C493 VanDerWaalsContact OG-SG 3.39Å; S489-C493 PolarHBondContact O-N 2.9Å; S489-C493 PolarHBondContact O-SG 3.08Å; I490-C493 WeakPolarHBondContact O-CB 3.45Å; I490-C493 PolarHBondContact O-N 3.25Å; I490-C493 VanDerWaalsContact O-N 3.09Å; G491-C493 VanDerWaalsContact C-N 3.33Å; G491-C493 PolarHBondContact O-N 2.76Å; C493-A496 WeakPolarHBondContact O-CB 3.48Å; C493-A496 PolarHBondContact O-N 3.25Å; C493-F497 PolarHBondContact O-N 2.97Å
494	I	90.5	Very high	88.6	Confident	40 Å²	40	35.8 Å²	35.8	21%	0.205	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-42	175.2	-65.1	165.6	0	0	0	110.5	F451 I455 I458 I490 G491 A496 F497 S498	F451-I494 HydrophobicContact CD2-CG2 4.36Å; F451-I494 HydrophobicContact CE2-CG2 3.82Å; I455-I494 HydrophobicContact CD1-CG2 3.65Å; I458-I494 HydrophobicContact CD1-CD1 3.87Å; I490-I494 HydrophobicContact CG2-CD1 3.99Å; I490-I494 WeakPolarHBondContact O-CG1 3.24Å; I490-I494 PolarHBondContact O-N 3.48Å; G491-I494 PolarHBondContact O-N 3.29Å; I494-A496 VanDerWaalsContact C-N 3.31Å; I494-A496 PolarHBondContact O-N 3Å; I494-F497 PolarHBondContact O-N 2.89Å; I494-S498 WeakPolarHBondContact O-CB 3.34Å; I494-S498 PolarHBondContact O-N 3.47Å
495	L	90.9	Very high	89.2	Confident	7 Å²	7	35.9 Å²	35.9	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-35.5	175	-65.1	168.7	0	0	0	111.9	L77 G491 F492 F497 S498 I499 T845 T849 M852	L77-L495 HydrophobicContact CD1-CB 4.06Å; G491-L495 VanDerWaalsContact O-CG 3.31Å; G491-L495 WeakPolarHBondContact O-CG 3.36Å; G491-L495 PolarHBondContact O-N 2.85Å; F492-L495 HydrophobicContact CD1-CD1 4.27Å; F492-L495 PolarHBondContact O-N 3.22Å; L495-F497 VanDerWaalsContact C-N 3.35Å; L495-S498 WeakPolarHBondContact O-CB 3.42Å; L495-S498 PolarHBondContact O-N 3.35Å; L495-I499 PolarHBondContact O-N 2.91Å; L495-T845 HydrophobicContact CB-CG2 4.45Å; L495-T849 HydrophobicContact CB-CG2 4.34Å; L495-T849 HydrophobicContact CD1-CG2 3.84Å; L495-M852 HydrophobicContact CD1-CG 4.14Å
496	A	91.8	Very high	89.6	Confident	7 Å²	7	35.6 Å²	35.6	6%	0.058	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-39.7	173.3	0	0	0	0	0	111.7	T74 L77 F492 C493 I494 I499 I500	T74-A496 HydrophobicContact CG2-CB 4.26Å; L77-A496 HydrophobicContact CB-CB 4.17Å; L77-A496 HydrophobicContact CD1-CB 4.25Å; F492-A496 WeakPolarHBondContact O-CB 3.44Å; F492-A496 PolarHBondContact O-N 2.92Å; C493-A496 WeakPolarHBondContact O-CB 3.48Å; C493-A496 PolarHBondContact O-N 3.25Å; I494-A496 VanDerWaalsContact C-N 3.31Å; I494-A496 PolarHBondContact O-N 3Å; A496-I499 VanDerWaalsContact O-CG2 3.22Å; A496-I499 WeakPolarHBondContact O-CG2 3.36Å; A496-I500 WeakPolarHBondContact O-CD1 3.27Å; A496-I500 WeakPolarHBondContact O-CG1 3.46Å; A496-I500 PolarHBondContact O-N 2.88Å
497	F	91.2	Very high	90	Very high	115 Å²	115	32.8 Å²	32.8	50%	0.504	18%	0.184	S	C	.	.	H	α-helix	trans	-66.7	-39.9	172.5	-174.2	-108.8	0	0	0	112.1	C493 I494 L495 I499 I500 L501	C493-F497 PolarHBondContact O-N 2.97Å; I494-F497 PolarHBondContact O-N 2.89Å; L495-F497 VanDerWaalsContact C-N 3.35Å; F497-I499 PolarHBondContact O-N 2.95Å; F497-I500 PolarHBondContact O-N 3.47Å; F497-L501 HydrophobicContact CD1-CD1 3.8Å; F497-L501 HydrophobicContact CD1-CG 4.23Å; F497-L501 HydrophobicContact CE1-CD1 3.37Å; F497-L501 HydrophobicContact CE1-CD2 4.38Å; F497-L501 HydrophobicContact CE1-CG 3.9Å; F497-L501 HydrophobicContact CZ-CD1 3.97Å; F497-L501 HydrophobicContact CZ-CD2 4.13Å; F497-L501 HydrophobicContact CZ-CG 4.09Å; F497-L501 PolarHBondContact O-N 2.9Å
498	S	91.9	Very high	90.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-44.1	177.7	-175	0	0	0	0	113.1	I494 L495 L501 A502 F841 T845	I494-S498 WeakPolarHBondContact O-CB 3.34Å; I494-S498 PolarHBondContact O-N 3.47Å; L495-S498 WeakPolarHBondContact O-CB 3.42Å; L495-S498 PolarHBondContact O-N 3.35Å; S498-L501 PolarHBondContact O-N 2.94Å; S498-A502 WeakPolarHBondContact O-CB 3.23Å; S498-A502 PolarHBondContact O-N 2.69Å; S498-F841 PolarHBondContact OG-O 2.9Å; S498-T845 WeakPolarHBondContact CB-OG1 3.41Å; S498-T845 PolarHBondContact OG-OG1 3.49Å
499	I	93.9	Very high	90.6	Very high	22 Å²	22	34.6 Å²	34.6	11%	0.113	18%	0.182	C	C	.	.	H	α-helix	trans	-70.6	-33	179.2	-168	61.9	0	0	0	112.4	S70 W73 T74 L495 A496 F497 A502 C503 T845	S70-I499 PolarHBondContact OG-O 3.49Å; W73-I499 HydrophobicContact CB-CG1 4.47Å; W73-I499 HydrophobicContact CG-CG1 4.47Å; T74-I499 VanDerWaalsContact OG1-CG2 3.3Å; T74-I499 WeakPolarHBondContact OG1-CG2 3.28Å; L495-I499 PolarHBondContact O-N 2.91Å; A496-I499 VanDerWaalsContact O-CG2 3.22Å; A496-I499 WeakPolarHBondContact O-CG2 3.36Å; F497-I499 PolarHBondContact O-N 2.95Å; I499-A502 HydrophobicContact CD1-CB 4.35Å; I499-A502 PolarHBondContact O-N 3.48Å; I499-C503 WeakPolarHBondContact O-CB 3.28Å; I499-C503 PolarHBondContact O-N 2.82Å; I499-T845 HydrophobicContact CB-CG2 3.82Å; I499-T845 HydrophobicContact CD1-CG2 4.35Å; I499-T845 HydrophobicContact CG1-CG2 4.44Å
500	I	92.9	Very high	90.7	Very high	73 Å²	73	34 Å²	34	37%	0.374	18%	0.178	S	C	.	.	H	α-helix	trans	-62.7	-48.4	172.2	-66.2	166.9	0	0	0	109.5	T74 A496 F497 A502 C503 L504	T74-I500 HydrophobicContact CG2-CD1 4.11Å; T74-I500 HydrophobicContact CG2-CG1 4.35Å; A496-I500 WeakPolarHBondContact O-CD1 3.27Å; A496-I500 WeakPolarHBondContact O-CG1 3.46Å; A496-I500 PolarHBondContact O-N 2.88Å; F497-I500 PolarHBondContact O-N 3.47Å; I500-A502 PolarHBondContact O-N 3.24Å; I500-C503 WeakPolarHBondContact O-CB 3.49Å; I500-C503 PolarHBondContact O-N 2.91Å; I500-L504 HydrophobicContact CG2-CD1 4.19Å; I500-L504 WeakPolarHBondContact O-CG 3.3Å; I500-L504 PolarHBondContact O-N 3.32Å
501	L	92	Very high	90.6	Very high	33 Å²	33	30.3 Å²	30.3	17%	0.173	16%	0.158	C	C	.	.	H	α-helix	trans	-60.6	-43.8	175.4	-72.1	-177.8	0	0	0	112.1	F497 S498 C503 L504 F505 F841	F497-L501 HydrophobicContact CD1-CD1 3.8Å; F497-L501 HydrophobicContact CD1-CG 4.23Å; F497-L501 HydrophobicContact CE1-CD1 3.37Å; F497-L501 HydrophobicContact CE1-CD2 4.38Å; F497-L501 HydrophobicContact CE1-CG 3.9Å; F497-L501 HydrophobicContact CZ-CD1 3.97Å; F497-L501 HydrophobicContact CZ-CD2 4.13Å; F497-L501 HydrophobicContact CZ-CG 4.09Å; F497-L501 PolarHBondContact O-N 2.9Å; S498-L501 PolarHBondContact O-N 2.94Å; L501-C503 VanDerWaalsContact C-N 3.29Å; L501-C503 PolarHBondContact O-N 3.01Å; L501-L504 PolarHBondContact O-N 3.11Å; L501-F505 HydrophobicContact CB-CD2 4.37Å; L501-F505 HydrophobicContact CB-CE2 4.31Å; L501-F505 HydrophobicContact CD2-CE2 4.47Å; L501-F505 WeakPolarHBondContact O-CD2 3.29Å; L501-F505 PolarHBondContact O-N 3.23Å; L501-F841 HydrophobicContact CD1-CE1 4.21Å; L501-F841 HydrophobicContact CD1-CZ 4.23Å
502	A	92.8	Very high	90.6	Very high	5 Å²	5	33.6 Å²	33.6	4%	0.041	18%	0.175	C	C	.	.	H	α-helix	trans	-56	-47	175.3	0	0	0	0	0	110.9	S498 I499 I500 F505 Y506 W838 F841	S498-A502 WeakPolarHBondContact O-CB 3.23Å; S498-A502 PolarHBondContact O-N 2.69Å; I499-A502 HydrophobicContact CD1-CB 4.35Å; I499-A502 PolarHBondContact O-N 3.48Å; I500-A502 PolarHBondContact O-N 3.24Å; A502-F505 PolarHBondContact O-N 3.42Å; A502-Y506 VanDerWaalsContact O-CB 3.29Å; A502-Y506 WeakPolarHBondContact O-CB 3.32Å; A502-Y506 PolarHBondContact O-N 3.35Å; A502-W838 WeakPolarHBondContact O-CB 3.33Å; A502-F841 HydrophobicContact CB-CB 3.61Å
503	C	92.5	Very high	90.5	Very high	15 Å²	15	34.3 Å²	34.3	10%	0.101	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-45.5	177.9	-169.2	0	0	0	0	111.6	S70 I499 I500 L501 F505 Y506 L507	S70-C503 WeakPolarHBondContact OG-CB 3.39Å; I499-C503 WeakPolarHBondContact O-CB 3.28Å; I499-C503 PolarHBondContact O-N 2.82Å; I500-C503 WeakPolarHBondContact O-CB 3.49Å; I500-C503 PolarHBondContact O-N 2.91Å; L501-C503 VanDerWaalsContact C-N 3.29Å; L501-C503 PolarHBondContact O-N 3.01Å; C503-F505 PolarHBondContact O-N 3.32Å; C503-Y506 PolarHBondContact O-N 3.43Å; C503-L507 VanDerWaalsContact O-CG 3.26Å; C503-L507 WeakPolarHBondContact O-CG 3.2Å; C503-L507 PolarHBondContact O-N 3.16Å
504	L	92.1	Very high	90.2	Very high	88 Å²	88	31.1 Å²	31.1	46%	0.461	16%	0.156	S	C	.	.	H	α-helix	trans	-60.5	-46.6	177.1	-71.1	173.3	0	0	0	112.3	I500 L501 Y506 L507 I508	I500-L504 HydrophobicContact CG2-CD1 4.19Å; I500-L504 WeakPolarHBondContact O-CG 3.3Å; I500-L504 PolarHBondContact O-N 3.32Å; L501-L504 PolarHBondContact O-N 3.11Å; L504-Y506 VanDerWaalsContact C-N 3.32Å; L504-Y506 PolarHBondContact O-N 3.25Å; L504-L507 PolarHBondContact O-N 3.42Å; L504-I508 WeakPolarHBondContact O-CG1 3.09Å; L504-I508 PolarHBondContact O-N 2.92Å
505	F	91.9	Very high	89.7	Confident	23 Å²	23	29.3 Å²	29.3	10%	0.101	15%	0.147	C	C	.	.	H	α-helix	trans	-66.6	-33.7	177.1	-74.9	-60.5	0	0	0	112.7	F444 L501 A502 C503 G509 L834 F837 W838 F841	F444-F505 AromaticContact CE2-CZ 3.77Å; F444-F505 HydrophobicContact CE2-CZ 3.77Å; F444-F505 HydrophobicContact CZ-CE1 4.09Å; F444-F505 HydrophobicContact CZ-CE2 4.41Å; F444-F505 AromaticContact CZ-CZ 3.5Å; F444-F505 HydrophobicContact CZ-CZ 3.5Å; L501-F505 HydrophobicContact CB-CD2 4.37Å; L501-F505 HydrophobicContact CB-CE2 4.31Å; L501-F505 HydrophobicContact CD2-CE2 4.47Å; L501-F505 WeakPolarHBondContact O-CD2 3.29Å; L501-F505 PolarHBondContact O-N 3.23Å; A502-F505 PolarHBondContact O-N 3.42Å; C503-F505 PolarHBondContact O-N 3.32Å; F505-G509 WeakPolarHBondContact O-CA 3.41Å; F505-G509 PolarHBondContact O-N 3.49Å; F505-L834 HydrophobicContact CD1-CD2 3.79Å; F505-L834 HydrophobicContact CE1-CD2 3.91Å; F505-F837 HydrophobicContact CB-CB 4.29Å; F505-F837 HydrophobicContact CD1-CB 4.3Å; F505-F837 HydrophobicContact CD2-CB 4.12Å; F505-F837 HydrophobicContact CG-CB 3.98Å; F505-W838 HydrophobicContact CB-CB 3.7Å; F505-F841 AromaticContact CD2-CD2 3.88Å; F505-F841 HydrophobicContact CD2-CD2 3.88Å; F505-F841 AromaticContact CD2-CE2 3.77Å; F505-F841 HydrophobicContact CD2-CE2 3.77Å; F505-F841 HydrophobicContact CE2-CD2 4.21Å; F505-F841 AromaticContact CE2-CE2 3.63Å; F505-F841 HydrophobicContact CE2-CE2 3.63Å; F505-F841 HydrophobicContact CE2-CZ 4.44Å
506	Y	90.9	Very high	89.1	Confident	15 Å²	15	30.4 Å²	30.4	6%	0.059	16%	0.159	C	C	.	.	H	α-helix	trans	-67.3	-41.7	174.3	173.6	-108.6	0	0	0	111.3	V12 A15 Y63 S66 A502 C503 L504 G510 W838	V12-Y506 HydrophobicContact CG2-CD2 4.25Å; V12-Y506 HydrophobicContact CG2-CE2 3.88Å; A15-Y506 VanDerWaalsContact CB-OH 3.26Å; A15-Y506 WeakPolarHBondContact CB-OH 3.39Å; Y63-Y506 AromaticContact CD1-CD1 3.93Å; Y63-Y506 HydrophobicContact CD1-CD1 3.93Å; Y63-Y506 AromaticContact CD1-CE1 3.33Å; Y63-Y506 HydrophobicContact CD1-CE1 3.33Å; Y63-Y506 AromaticContact CD1-CZ 3.78Å; Y63-Y506 HydrophobicContact CE1-CD1 4.28Å; Y63-Y506 AromaticContact CE1-CE1 3.74Å; Y63-Y506 HydrophobicContact CE1-CE1 3.74Å; Y63-Y506 HydrophobicContact CE1-CE2 4.32Å; Y63-Y506 AromaticContact CE1-CZ 3.74Å; Y63-Y506 HydrophobicContact CG-CE1 4.43Å; S66-Y506 VanDerWaalsContact CB-CE1 3.42Å; S66-Y506 VanDerWaalsContact OG-CD1 3.26Å; S66-Y506 WeakPolarHBondContact OG-CD1 3.18Å; S66-Y506 WeakPolarHBondContact OG-CE1 3.42Å; A502-Y506 VanDerWaalsContact O-CB 3.29Å; A502-Y506 WeakPolarHBondContact O-CB 3.32Å; A502-Y506 PolarHBondContact O-N 3.35Å; C503-Y506 PolarHBondContact O-N 3.43Å; L504-Y506 VanDerWaalsContact C-N 3.32Å; L504-Y506 PolarHBondContact O-N 3.25Å; Y506-G510 WeakPolarHBondContact O-CA 3.48Å; Y506-G510 PolarHBondContact O-N 3.48Å; Y506-W838 AromaticContact CD2-CD2 3.73Å; Y506-W838 HydrophobicContact CD2-CD2 3.73Å; Y506-W838 AromaticContact CD2-CE2 3.61Å; Y506-W838 HydrophobicContact CD2-CE3 4.07Å; Y506-W838 HydrophobicContact CD2-CG 4.19Å; Y506-W838 HydrophobicContact CD2-CH2 4.26Å; Y506-W838 AromaticContact CD2-CZ2 3.91Å; Y506-W838 HydrophobicContact CD2-CZ2 3.91Å; Y506-W838 HydrophobicContact CD2-CZ3 4.32Å; Y506-W838 AromaticContact CD2-NE1 3.88Å; Y506-W838 HydrophobicContact CE2-CH2 4.46Å; Y506-W838 HydrophobicContact CE2-CZ2 4.21Å; Y506-W838 HydrophobicContact CG-CD2 4.27Å; Y506-W838 HydrophobicContact CG-CE3 4.47Å; Y506-W838 HydrophobicContact CG-CG 4.47Å
507	L	89.9	Confident	88.7	Confident	22 Å²	22	30.5 Å²	30.5	12%	0.115	16%	0.16	C	C	.	.	H	α-helix	trans	-65.8	-45.9	176.9	-69.4	173.5	0	0	0	111.4	Y58 Y63 I67 C503 L504 Y511	Y58-L507 HydrophobicContact CD1-CD2 3.95Å; Y58-L507 HydrophobicContact CD2-CD2 4.44Å; Y58-L507 HydrophobicContact CE1-CB 4.3Å; Y58-L507 HydrophobicContact CE1-CD2 3.87Å; Y58-L507 HydrophobicContact CE2-CB 4.46Å; Y58-L507 HydrophobicContact CE2-CD2 4.38Å; Y58-L507 HydrophobicContact CG-CD2 4.24Å; Y58-L507 PolarHBondContact OH-O 3.41Å; Y63-L507 HydrophobicContact CD1-CD2 3.91Å; Y63-L507 HydrophobicContact CG-CD2 4.17Å; I67-L507 HydrophobicContact CD1-CD1 4.18Å; I67-L507 HydrophobicContact CD1-CD2 3.99Å; I67-L507 HydrophobicContact CG1-CD1 4.07Å; I67-L507 HydrophobicContact CG1-CD2 4.08Å; C503-L507 VanDerWaalsContact O-CG 3.26Å; C503-L507 WeakPolarHBondContact O-CG 3.2Å; C503-L507 PolarHBondContact O-N 3.16Å; L504-L507 PolarHBondContact O-N 3.42Å; L507-Y511 WeakPolarHBondContact O-CB 3.27Å; L507-Y511 PolarHBondContact O-N 3.09Å; L507-Y511 VanDerWaalsContact O-N 3.12Å
508	I	90.3	Very high	88.1	Confident	84 Å²	84	25.6 Å²	25.6	43%	0.431	14%	0.138	S	C	.	.	H	α-helix	trans	-74	-58.1	-178.4	-62.9	167.3	0	0	0	110.8	L504 G510 Y511 L512 L834	L504-I508 WeakPolarHBondContact O-CG1 3.09Å; L504-I508 PolarHBondContact O-N 2.92Å; I508-G510 VanDerWaalsContact C-N 3.34Å; I508-G510 PolarHBondContact O-N 3.23Å; I508-Y511 PolarHBondContact O-N 3.34Å; I508-L512 HydrophobicContact CG2-CD1 4Å; I508-L512 WeakPolarHBondContact O-CB 3.46Å; I508-L512 VanDerWaalsContact O-CG 3.27Å; I508-L512 WeakPolarHBondContact O-CG 3.45Å; I508-L512 PolarHBondContact O-N 3.13Å; I508-L834 HydrophobicContact CG2-CD1 4.28Å
509	G	88.2	Confident	87.2	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.3	-33.6	-177.4	0	0	0	0	0	113	F505 Y513 N835	F505-G509 WeakPolarHBondContact O-CA 3.41Å; F505-G509 PolarHBondContact O-N 3.49Å; G509-Y513 WeakPolarHBondContact O-CB 3.21Å; G509-Y513 PolarHBondContact O-N 2.84Å; G509-Y513 VanDerWaalsContact O-N 3.12Å; G509-N835 PolarHBondContact O-ND2 3.27Å; G509-N835 VanDerWaalsContact O-ND2 3.09Å; G509-N835 PolarHBondContact O-OD1 2.76Å
510	G	87.3	Confident	86.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-49.2	174.7	0	0	0	0	0	111.8	V12 Y63 Y506 I508 Y513 T514	V12-G510 WeakPolarHBondContact CG1-O 3.19Å; Y63-G510 PolarHBondContact OH-O 2.93Å; Y63-G510 VanDerWaalsContact OH-O 3.07Å; Y506-G510 WeakPolarHBondContact O-CA 3.48Å; Y506-G510 PolarHBondContact O-N 3.48Å; I508-G510 VanDerWaalsContact C-N 3.34Å; I508-G510 PolarHBondContact O-N 3.23Å; G510-Y513 WeakPolarHBondContact O-CB 3.47Å; G510-Y513 PolarHBondContact O-N 3.17Å; G510-T514 PolarHBondContact O-N 2.88Å; G510-T514 PolarHBondContact O-OG1 2.91Å
511	Y	86.8	Confident	85.1	Confident	15 Å²	15	26 Å²	26	6%	0.059	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-48.6	177.6	-179.8	-90.5	0	0	0	111.7	I23 H53 I54 T57 Y58 Y63 L507 I508 Y513 T514 E515	I23-Y511 HydrophobicContact CD1-CE1 4.49Å; H53-Y511 PolarHBondContact CD2-OH 3.09Å; I54-Y511 HydrophobicContact CB-CE2 4.39Å; I54-Y511 HydrophobicContact CG1-CE1 4.12Å; I54-Y511 HydrophobicContact CG1-CE2 3.97Å; I54-Y511 WeakPolarHBondContact CG1-OH 3.06Å; I54-Y511 HydrophobicContact CG2-CE2 4.45Å; T57-Y511 HydrophobicContact CG2-CD2 4.2Å; T57-Y511 HydrophobicContact CG2-CE2 4.1Å; Y58-Y511 AromaticContact CE1-CD2 3.89Å; Y58-Y511 HydrophobicContact CE1-CD2 3.89Å; Y58-Y511 HydrophobicContact CE1-CG 4.28Å; Y63-Y511 PolarHBondContact OH-N 3.44Å; L507-Y511 WeakPolarHBondContact O-CB 3.27Å; L507-Y511 PolarHBondContact O-N 3.09Å; L507-Y511 VanDerWaalsContact O-N 3.12Å; I508-Y511 PolarHBondContact O-N 3.34Å; Y511-Y513 PolarHBondContact O-N 3.38Å; Y511-T514 PolarHBondContact O-N 2.84Å; Y511-T514 PolarHBondContact O-OG1 2.88Å; Y511-E515 HydrophobicContact CD1-CB 4.41Å; Y511-E515 HydrophobicContact CD2-CG 3.86Å; Y511-E515 HydrophobicContact CE1-CB 4.14Å; Y511-E515 HydrophobicContact CE1-CG 4.35Å; Y511-E515 HydrophobicContact CE2-CB 4.31Å; Y511-E515 HydrophobicContact CE2-CG 3.64Å; Y511-E515 HydrophobicContact CG-CG 4.31Å; Y511-E515 VanDerWaalsContact O-CB 3.27Å; Y511-E515 WeakPolarHBondContact O-CB 3.33Å; Y511-E515 PolarHBondContact O-N 3.29Å
512	L	87.6	Confident	83.6	Confident	72 Å²	72	26.6 Å²	26.6	38%	0.377	15%	0.147	S	C	.	.	I	π-helix	trans	-59.8	-33.4	177.7	-71.1	172.9	0	0	0	112.3	I508 G516 C517 V831 L834	I508-L512 HydrophobicContact CG2-CD1 4Å; I508-L512 WeakPolarHBondContact O-CB 3.46Å; I508-L512 VanDerWaalsContact O-CG 3.27Å; I508-L512 WeakPolarHBondContact O-CG 3.45Å; I508-L512 PolarHBondContact O-N 3.13Å; L512-G516 VanDerWaalsContact O-CA 3.28Å; L512-G516 WeakPolarHBondContact O-CA 3.36Å; L512-G516 PolarHBondContact O-N 3.4Å; L512-G516 VanDerWaalsContact O-N 3.09Å; L512-C517 PolarHBondContact O-N 2.93Å; L512-V831 HydrophobicContact CB-CG1 4.28Å; L512-V831 HydrophobicContact CB-CG2 3.79Å; L512-V831 HydrophobicContact CD1-CG2 4.34Å; L512-L834 HydrophobicContact CD1-CD1 4.29Å
513	Y	87	Confident	82	Confident	18 Å²	18	34.5 Å²	34.5	7%	0.071	18%	0.184	C	C	.	.	I	π-helix	trans	-70.8	-51.3	174.8	179.3	-102.9	0	0	0	112.4	K9 V12 G509 G510 Y511 C517 R518 V831	K9-Y513 HydrophobicContact CB-CE1 4.35Å; K9-Y513 HydrophobicContact CB-CE2 4.39Å; K9-Y513 HydrophobicContact CD-CE2 4.03Å; K9-Y513 HydrophobicContact CG-CD2 4.31Å; K9-Y513 HydrophobicContact CG-CE2 3.82Å; V12-Y513 HydrophobicContact CB-CD1 4.1Å; V12-Y513 HydrophobicContact CG1-CD1 3.57Å; V12-Y513 HydrophobicContact CG1-CE1 4.39Å; V12-Y513 HydrophobicContact CG1-CG 4.36Å; G509-Y513 WeakPolarHBondContact O-CB 3.21Å; G509-Y513 PolarHBondContact O-N 2.84Å; G509-Y513 VanDerWaalsContact O-N 3.12Å; G510-Y513 WeakPolarHBondContact O-CB 3.47Å; G510-Y513 PolarHBondContact O-N 3.17Å; Y511-Y513 PolarHBondContact O-N 3.38Å; Y513-C517 HydrophobicContact CD2-CB 4.19Å; Y513-C517 PolarHBondContact O-N 3.25Å; Y513-R518 VanDerWaalsContact O-CB 3.3Å; Y513-R518 WeakPolarHBondContact O-CB 3.28Å; Y513-R518 PolarHBondContact O-N 3.24Å; Y513-V831 HydrophobicContact CD2-CG1 4.32Å; Y513-V831 HydrophobicContact CG-CG1 4.47Å
514	T	80.7	Confident	80.4	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-71.5	-39.1	-175.2	53.6	0	0	0	0	113.2	V12 Q16 Y63 G510 Y511 R518 Y519	V12-T514 HydrophobicContact CG1-CG2 3.52Å; Q16-T514 HydrophobicContact CB-CG2 4.16Å; Q16-T514 PolarHBondContact OE1-OG1 2.94Å; Y63-T514 WeakPolarHBondContact OH-CG2 3.47Å; Y63-T514 PolarHBondContact OH-OG1 2.96Å; G510-T514 PolarHBondContact O-N 2.88Å; G510-T514 PolarHBondContact O-OG1 2.91Å; Y511-T514 PolarHBondContact O-N 2.84Å; Y511-T514 PolarHBondContact O-OG1 2.88Å; T514-R518 PolarHBondContact O-NE 3.01Å; T514-Y519 WeakPolarHBondContact O-CE2 3.34Å
515	E	80	Confident	78.8	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.009	20%	0.195	C	C	.	.	I	π-helix	trans	-95	-26	-173.4	-66.7	-65.4	111.6	0	0	113.4	Q16 G22 I23 H53 Y511	Q16-E515 PolarHBondContact NE2-OE1 3.39Å; Q16-E515 PolarHBondContact OE1-OE1 3.02Å; G22-E515 VanDerWaalsContact CA-CD 3.49Å; G22-E515 WeakPolarHBondContact CA-OE2 3.28Å; I23-E515 HydrophobicContact CB-CB 4.47Å; I23-E515 PolarHBondContact N-OE2 2.94Å; H53-E515 IonicContact NE2-OE2 3.98Å; H53-E515 PolarHBondContact NE2-OE2 3.14Å; Y511-E515 HydrophobicContact CD1-CB 4.41Å; Y511-E515 HydrophobicContact CD2-CG 3.86Å; Y511-E515 HydrophobicContact CE1-CB 4.14Å; Y511-E515 HydrophobicContact CE1-CG 4.35Å; Y511-E515 HydrophobicContact CE2-CB 4.31Å; Y511-E515 HydrophobicContact CE2-CG 3.64Å; Y511-E515 HydrophobicContact CG-CG 4.31Å; Y511-E515 VanDerWaalsContact O-CB 3.27Å; Y511-E515 WeakPolarHBondContact O-CB 3.33Å; Y511-E515 PolarHBondContact O-N 3.29Å
516	G	79.3	Confident	77.4	Confident	29 Å²	29	39.3 Å²	39.3	30%	0.299	21%	0.21	S	C	.	.	I	π-helix	trans	-104.2	-71.7	178.7	0	0	0	0	0	112.4	L512 R518 V520	L512-G516 VanDerWaalsContact O-CA 3.28Å; L512-G516 WeakPolarHBondContact O-CA 3.36Å; L512-G516 PolarHBondContact O-N 3.4Å; L512-G516 VanDerWaalsContact O-N 3.09Å; G516-R518 PolarHBondContact O-N 3.14Å; G516-V520 WeakPolarHBondContact O-CG2 3.34Å
517	C	84.1	Confident	76.2	Confident	10 Å²	10	41.2 Å²	41.2	7%	0.068	22%	0.22	C	C	.	.	I	π-helix	trans	-72.5	-31.4	-166.4	-66.9	0	0	0	0	115.1	L512 Y513 Y519 V520 N521 C827	L512-C517 PolarHBondContact O-N 2.93Å; Y513-C517 HydrophobicContact CD2-CB 4.19Å; Y513-C517 PolarHBondContact O-N 3.25Å; C517-Y519 VanDerWaalsContact C-N 3.31Å; C517-Y519 PolarHBondContact O-N 2.91Å; C517-V520 PolarHBondContact O-N 3.47Å; C517-N521 PolarHBondContact O-N 3.45Å; C517-C827 VanDerWaalsContact CA-SG 3.52Å; C517-C827 HydrophobicContact CB-CB 3.78Å; C517-C827 WeakPolarHBondContact CB-SG 3.49Å; C517-C827 WeakPolarHBondContact SG-CA 3.28Å; C517-C827 WeakPolarHBondContact SG-CB 3.22Å; C517-C827 CovalentContact SG-SG 2.03Å; C517-C827 PolarHBondContact SG-SG 2.88Å
518	R	78.9	Confident	75.1	Confident	12 Å²	12	45.2 Å²	45.2	5%	0.045	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-39.3	-174.7	-177.6	173	71.4	172.9	2.6	112.4	Q16 P17 Y513 T514 G516	Q16-R518 PolarHBondContact O-NH1 3.39Å; P17-R518 PolarHBondContact O-NH2 3.15Å; Y513-R518 VanDerWaalsContact O-CB 3.3Å; Y513-R518 WeakPolarHBondContact O-CB 3.28Å; Y513-R518 PolarHBondContact O-N 3.24Å; T514-R518 PolarHBondContact O-NE 3.01Å; G516-R518 PolarHBondContact O-N 3.14Å
519	Y	72.6	Confident	73.9	Confident	14 Å²	14	43.5 Å²	43.5	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-88.2	-12.7	-173.2	-56.6	-71.5	0	0	0	114.6	G21 T514 C517 V547	G21-Y519 VanDerWaalsContact C-CE2 3.5Å; T514-Y519 WeakPolarHBondContact O-CE2 3.34Å; C517-Y519 VanDerWaalsContact C-N 3.31Å; C517-Y519 PolarHBondContact O-N 2.91Å; Y519-V547 HydrophobicContact CD1-CG2 3.91Å; Y519-V547 HydrophobicContact CD2-CG2 4.37Å; Y519-V547 HydrophobicContact CG-CG2 3.65Å
520	V	72.9	Confident	73	Confident	40 Å²	40	47.5 Å²	47.5	24%	0.242	26%	0.258	C	S	.	.	H	α-helix	trans	-94.2	-7.4	176.7	-172.4	0	0	0	0	110.5	G516 C517 P522 L585 N823	G516-V520 WeakPolarHBondContact O-CG2 3.34Å; C517-V520 PolarHBondContact O-N 3.47Å; V520-P522 WeakPolarHBondContact O-CD 3.45Å; V520-L585 HydrophobicContact CG1-CD1 3.94Å; V520-L585 WeakPolarHBondContact O-CD1 3.24Å; V520-N823 HydrophobicContact CG1-CB 4.48Å
521	N	69.3	Low	72	Confident	48 Å²	48	50.9 Å²	50.9	26%	0.257	28%	0.276	S	S	.	.			trans	-87.8	115.8	176.9	-171.1	-8.5	0	0	0	110.8	C517 E523 Q524	C517-N521 PolarHBondContact O-N 3.45Å; N521-E523 PolarHBondContact O-N 3.22Å; N521-E523 PolarHBondContact OD1-N 3.39Å; N521-Q524 PolarHBondContact O-N 2.92Å
522	P	60.5	Low	70.9	Confident	47 Å²	47	55.1 Å²	55.1	31%	0.305	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.3	-176.7	26.5	-34.9	0	0	0	114.3	V520 Q524 F545	V520-P522 WeakPolarHBondContact O-CD 3.45Å; P522-Q524 PolarHBondContact O-N 2.68Å; P522-F545 HydrophobicContact CB-CE1 4.27Å; P522-F545 HydrophobicContact CB-CE2 4.1Å; P522-F545 HydrophobicContact CB-CZ 3.47Å; P522-F545 VanDerWaalsContact CB-CZ 3.47Å; P522-F545 VanDerWaalsContact O-CE1 3.3Å; P522-F545 WeakPolarHBondContact O-CE1 3.46Å
523	E	59.4	Low	69.9	Low	171 Å²	171	52.2 Å²	52.2	80%	0.799	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-11	-179.2	-63.3	-178	170.2	0	0	113.6	N521	N521-E523 PolarHBondContact O-N 3.22Å; N521-E523 PolarHBondContact OD1-N 3.39Å
524	Q	58.3	Low	68.7	Low	68 Å²	68	55 Å²	55	32%	0.318	30%	0.297	S	S	.	.	S	Bend	trans	-116.2	112.1	-169.1	-60.7	-167.1	-12.9	0	0	112.4	N521 P522	N521-Q524 PolarHBondContact O-N 2.92Å; P522-Q524 PolarHBondContact O-N 2.68Å
525	N	58.1	Low	67.8	Low	90 Å²	90	59.8 Å²	59.8	48%	0.481	32%	0.322	S	S	.	.			trans	63.9	62.1	164.7	-56.7	-30.5	0	0	0	116.2	I527 P546	N525-I527 PolarHBondContact O-N 2.89Å; N525-P546 VanDerWaalsContact O-CD 3.22Å; N525-P546 WeakPolarHBondContact O-CD 3.31Å; N525-P546 WeakPolarHBondContact O-CG 3.48Å
526	V	64	Low	67.2	Low	68 Å²	68	65.4 Å²	65.4	41%	0.412	35%	0.348	S	S	.	.			trans	-63.7	126.7	159.5	-164.6	0	0	0	0	108.4	A543 F545	V526-A543 HydrophobicContact CB-CB 4.49Å; V526-A543 HydrophobicContact CG1-CB 3.34Å; V526-F545 HydrophobicContact CG2-CD1 4.4Å; V526-F545 HydrophobicContact CG2-CE1 3.88Å
527	I	65.8	Low	66.7	Low	55 Å²	55	70.3 Å²	70.3	28%	0.282	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.6	176.9	48.7	171	0	0	0	109	N525 I529 M544 P546 A549	N525-I527 PolarHBondContact O-N 2.89Å; I527-I529 HydrophobicContact CB-CD1 3.98Å; I527-I529 HydrophobicContact CD1-CD1 3.35Å; I527-I529 HydrophobicContact CG1-CD1 3.39Å; I527-I529 PolarHBondContact O-N 3.46Å; I527-M544 WeakPolarHBondContact CG1-O 3.48Å; I527-M544 PolarHBondContact N-O 2.89Å; I527-M544 PolarHBondContact O-N 3.11Å; I527-P546 HydrophobicContact CD1-CB 4Å; I527-P546 HydrophobicContact CD1-CG 3.97Å; I527-P546 HydrophobicContact CG1-CG 4.01Å; I527-P546 HydrophobicContact CG2-CG 4.24Å; I527-A549 HydrophobicContact CD1-CB 4.38Å
528	N	66.8	Low	66.1	Low	107 Å²	107	74.8 Å²	74.8	57%	0.572	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	109.9	173.4	-69.5	-11.9	0	0	0	108.4	R542	N528-R542 CarbonylContact C-O 3.5Å; N528-R542 WeakPolarHBondContact CA-O 3.31Å
529	I	65.5	Low	65.9	Low	47 Å²	47	82.7 Å²	82.7	24%	0.241	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	128.6	167.6	-77.2	81.2	0	0	0	108.7	I527 D531 Q541 R542 M544	I527-I529 HydrophobicContact CB-CD1 3.98Å; I527-I529 HydrophobicContact CD1-CD1 3.35Å; I527-I529 HydrophobicContact CG1-CD1 3.39Å; I527-I529 PolarHBondContact O-N 3.46Å; I529-D531 HydrophobicContact CG2-CB 4.45Å; I529-D531 PolarHBondContact O-N 3.42Å; I529-Q541 WeakPolarHBondContact O-CA 3.32Å; I529-R542 PolarHBondContact N-O 2.98Å; I529-R542 PolarHBondContact O-N 3.25Å; I529-M544 HydrophobicContact CB-CE 3.57Å; I529-M544 HydrophobicContact CB-CG 4.43Å; I529-M544 HydrophobicContact CD1-CE 3.21Å; I529-M544 HydrophobicContact CD1-CG 3.56Å; I529-M544 HydrophobicContact CD1-SD 4.17Å; I529-M544 HydrophobicContact CG1-CE 3.21Å; I529-M544 HydrophobicContact CG1-CG 4.4Å; I529-M544 HydrophobicContact CG2-CE 3.88Å
530	T	68	Low	65.8	Low	85 Å²	85	84.6 Å²	84.6	52%	0.521	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	105.8	162.9	43	0	0	0	0	108.3	I540 Q541	T530-I540 WeakPolarHBondContact CA-O 3.08Å; T530-Q541 HydrophobicContact CG2-CG 3.49Å; T530-Q541 VanDerWaalsContact CG2-CG 3.49Å
531	D	66.7	Low	65.5	Low	71 Å²	71	89.2 Å²	89.2	38%	0.38	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	145.5	172.2	-153.9	2.5	0	0	0	109.3	I529 D533 Y539 I540 R578	I529-D531 HydrophobicContact CG2-CB 4.45Å; I529-D531 PolarHBondContact O-N 3.42Å; D531-D533 PolarHBondContact O-N 3.02Å; D531-Y539 WeakPolarHBondContact O-CA 3.41Å; D531-I540 PolarHBondContact N-O 3.48Å; D531-I540 PolarHBondContact O-N 3.41Å; D531-R578 IonicContact OD2-NH1 3.57Å
532	Y	64.4	Low	65.4	Low	103 Å²	103	91 Å²	91	40%	0.404	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	117.5	176.2	-176.6	-104.3	0	0	0	108.3	P534 Y539	Y532-P534 WeakPolarHBondContact O-CD 3.43Å; Y532-Y539 HydrophobicContact CD2-CD1 4.13Å; Y532-Y539 HydrophobicContact CD2-CD2 4.31Å; Y532-Y539 AromaticContact CD2-CE1 3.87Å; Y532-Y539 HydrophobicContact CD2-CE1 3.87Å; Y532-Y539 HydrophobicContact CD2-CE2 4.06Å; Y532-Y539 HydrophobicContact CD2-CG 4.34Å; Y532-Y539 AromaticContact CD2-CZ 3.83Å; Y532-Y539 HydrophobicContact CE2-CE2 4.49Å; Y532-Y539 HydrophobicContact CG-CE1 4.35Å
533	D	65.1	Low	65.6	Low	11 Å²	11	91.3 Å²	91.3	6%	0.059	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	108.8	173.9	-173	-10.7	0	0	0	109.2	D531 I535 H536 H537 N538 I540	D531-D533 PolarHBondContact O-N 3.02Å; D533-I535 PolarHBondContact O-N 3.32Å; D533-I535 WeakPolarHBondContact OD1-CB 3.48Å; D533-I535 PolarHBondContact OD1-N 2.97Å; D533-H536 PolarHBondContact O-N 2.91Å; D533-H536 IonicContact OD2-CE1 3.37Å; D533-H536 IonicContact OD2-CG 2.83Å; D533-H536 IonicContact OD2-ND1 3.69Å; D533-H536 PolarHBondContact OD2-ND1 3.07Å; D533-H537 WeakPolarHBondContact O-CA 3.48Å; D533-H537 PolarHBondContact O-N 2.91Å; D533-N538 WeakPolarHBondContact CB-O 3.49Å; D533-N538 PolarHBondContact N-O 3.37Å; D533-N538 PolarHBondContact O-N 3.19Å; D533-I540 HydrophobicContact CB-CD1 3.48Å; D533-I540 VanDerWaalsContact CB-CD1 3.48Å; D533-I540 HydrophobicContact CB-CG1 3.83Å; D533-I540 WeakPolarHBondContact OD2-CD1 3.39Å
534	P	62.1	Low	66	Low	76 Å²	76	85.1 Å²	85.1	49%	0.494	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.8	179.5	28.1	-34.3	0	0	0	112.3	Y532 H537	Y532-P534 WeakPolarHBondContact O-CD 3.43Å; P534-H537 PolarHBondContact O-CE1 2.87Å; P534-H537 VanDerWaalsContact O-CE1 3.25Å; P534-H537 PolarHBondContact O-ND1 2.99Å
535	I	62.1	Low	66.7	Low	101 Å²	101	82.1 Å²	82.1	52%	0.518	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-49.6	-178.2	-57.4	174.5	0	0	0	109.5	D533 H537 R602	D533-I535 PolarHBondContact O-N 3.32Å; D533-I535 WeakPolarHBondContact OD1-CB 3.48Å; D533-I535 PolarHBondContact OD1-N 2.97Å; I535-H537 PolarHBondContact O-ND1 3.32Å; I535-R602 HydrophobicContact CD1-CG 4Å
536	H	67.6	Low	67.3	Low	121 Å²	121	78.5 Å²	78.5	56%	0.56	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-0.4	-177.8	-60.9	93.6	0	0	0	113.7	D533 N538	D533-H536 PolarHBondContact O-N 2.91Å; D533-H536 IonicContact OD2-CE1 3.37Å; D533-H536 IonicContact OD2-CG 2.83Å; D533-H536 IonicContact OD2-ND1 3.69Å; D533-H536 PolarHBondContact OD2-ND1 3.07Å; H536-N538 HydrophobicContact CB-CB 4.45Å; H536-N538 PolarHBondContact O-N 3.41Å; H536-N538 VanDerWaalsContact O-N 3.09Å
537	H	68.8	Low	67.8	Low	132 Å²	132	75.3 Å²	75.3	61%	0.611	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	29.5	-175.7	-65.3	68.8	0	0	0	113.5	D533 P534 I535	D533-H537 WeakPolarHBondContact O-CA 3.48Å; D533-H537 PolarHBondContact O-N 2.91Å; P534-H537 PolarHBondContact O-CE1 2.87Å; P534-H537 VanDerWaalsContact O-CE1 3.25Å; P534-H537 PolarHBondContact O-ND1 2.99Å; I535-H537 PolarHBondContact O-ND1 3.32Å
538	N	71.4	Confident	68.4	Low	104 Å²	104	72.7 Å²	72.7	56%	0.556	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	150.5	-173.1	-80.8	-22.9	0	0	0	111	D533 H536 I540	D533-N538 WeakPolarHBondContact CB-O 3.49Å; D533-N538 PolarHBondContact N-O 3.37Å; D533-N538 PolarHBondContact O-N 3.19Å; H536-N538 HydrophobicContact CB-CB 4.45Å; H536-N538 PolarHBondContact O-N 3.41Å; H536-N538 VanDerWaalsContact O-N 3.09Å; N538-I540 PolarHBondContact O-N 2.91Å
539	Y	74.2	Confident	68.8	Low	178 Å²	178	68.5 Å²	68.5	70%	0.698	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	119.9	170.4	-68.6	-83.2	0	0	0	109.8	D531 Y532	D531-Y539 WeakPolarHBondContact O-CA 3.41Å; Y532-Y539 HydrophobicContact CD2-CD1 4.13Å; Y532-Y539 HydrophobicContact CD2-CD2 4.31Å; Y532-Y539 AromaticContact CD2-CE1 3.87Å; Y532-Y539 HydrophobicContact CD2-CE1 3.87Å; Y532-Y539 HydrophobicContact CD2-CE2 4.06Å; Y532-Y539 HydrophobicContact CD2-CG 4.34Å; Y532-Y539 AromaticContact CD2-CZ 3.83Å; Y532-Y539 HydrophobicContact CE2-CE2 4.49Å; Y532-Y539 HydrophobicContact CG-CE1 4.35Å
540	I	71.3	Confident	69.3	Low	54 Å²	54	68.9 Å²	68.9	28%	0.277	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.7	177.2	-55.5	-175.9	0	0	0	108.1	T530 D531 D533 N538 R542	T530-I540 WeakPolarHBondContact CA-O 3.08Å; D531-I540 PolarHBondContact N-O 3.48Å; D531-I540 PolarHBondContact O-N 3.41Å; D533-I540 HydrophobicContact CB-CD1 3.48Å; D533-I540 VanDerWaalsContact CB-CD1 3.48Å; D533-I540 HydrophobicContact CB-CG1 3.83Å; D533-I540 WeakPolarHBondContact OD2-CD1 3.39Å; N538-I540 PolarHBondContact O-N 2.91Å; I540-R542 HydrophobicContact CG2-CG 3.99Å; I540-R542 PolarHBondContact O-N 3.32Å
541	Q	66	Low	70	Confident	137 Å²	137	65.7 Å²	65.7	64%	0.64	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	115	166.3	-77.8	-174.4	-1.7	0	0	108.9	I529 T530	I529-Q541 WeakPolarHBondContact O-CA 3.32Å; T530-Q541 HydrophobicContact CG2-CG 3.49Å; T530-Q541 VanDerWaalsContact CG2-CG 3.49Å
542	R	67.9	Low	70.6	Confident	85 Å²	85	63.3 Å²	63.3	32%	0.321	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.3	173.4	-66.7	-173.3	-179	-156.8	-1.3	109.7	N528 I529 I540 M544 D599	N528-R542 CarbonylContact C-O 3.5Å; N528-R542 WeakPolarHBondContact CA-O 3.31Å; I529-R542 PolarHBondContact N-O 2.98Å; I529-R542 PolarHBondContact O-N 3.25Å; I540-R542 HydrophobicContact CG2-CG 3.99Å; I540-R542 PolarHBondContact O-N 3.32Å; R542-M544 PolarHBondContact O-N 3.29Å; R542-D599 IonicContact NH1-OD2 3.84Å; R542-D599 PolarHBondContact NH1-OD2 3.36Å
543	A	64.1	Low	71.3	Confident	54 Å²	54	61.1 Å²	61.1	45%	0.446	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	109.9	171.5	0	0	0	0	0	107	V526	V526-A543 HydrophobicContact CB-CB 4.49Å; V526-A543 HydrophobicContact CG1-CB 3.34Å
544	M	67.6	Low	72.1	Confident	40 Å²	40	61.6 Å²	61.6	20%	0.197	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	158.1	177	63.1	163	175.8	0	0	112.4	I527 I529 R542 A549	I527-M544 WeakPolarHBondContact CG1-O 3.48Å; I527-M544 PolarHBondContact N-O 2.89Å; I527-M544 PolarHBondContact O-N 3.11Å; I529-M544 HydrophobicContact CB-CE 3.57Å; I529-M544 HydrophobicContact CB-CG 4.43Å; I529-M544 HydrophobicContact CD1-CE 3.21Å; I529-M544 HydrophobicContact CD1-CG 3.56Å; I529-M544 HydrophobicContact CD1-SD 4.17Å; I529-M544 HydrophobicContact CG1-CE 3.21Å; I529-M544 HydrophobicContact CG1-CG 4.4Å; I529-M544 HydrophobicContact CG2-CE 3.88Å; R542-M544 PolarHBondContact O-N 3.29Å; M544-A549 VanDerWaalsContact CE-CA 3.45Å; M544-A549 HydrophobicContact CE-CB 3.12Å; M544-A549 VanDerWaalsContact SD-CA 3.59Å; M544-A549 HydrophobicContact SD-CB 3.71Å
545	F	72.2	Confident	73.1	Confident	6 Å²	6	59.2 Å²	59.2	3%	0.026	30%	0.298	C	S	.	.			trans	-70.3	141.8	172.3	-71.4	-49.4	0	0	0	110.6	P522 V526 V547 D548 A549 Y582	P522-F545 HydrophobicContact CB-CE1 4.27Å; P522-F545 HydrophobicContact CB-CE2 4.1Å; P522-F545 HydrophobicContact CB-CZ 3.47Å; P522-F545 VanDerWaalsContact CB-CZ 3.47Å; P522-F545 VanDerWaalsContact O-CE1 3.3Å; P522-F545 WeakPolarHBondContact O-CE1 3.46Å; V526-F545 HydrophobicContact CG2-CD1 4.4Å; V526-F545 HydrophobicContact CG2-CE1 3.88Å; F545-V547 PolarHBondContact O-N 3.28Å; F545-D548 HydrophobicContact CB-CB 4.44Å; F545-D548 PolarHBondContact O-N 3.42Å; F545-D548 VanDerWaalsContact O-N 3.07Å; F545-A549 PolarHBondContact O-N 3.46Å; F545-Y582 AromaticContact CD2-CD2 3.59Å; F545-Y582 HydrophobicContact CD2-CD2 3.59Å; F545-Y582 HydrophobicContact CD2-CG 4.09Å; F545-Y582 AromaticContact CE2-CD2 3.26Å; F545-Y582 HydrophobicContact CE2-CD2 3.26Å; F545-Y582 HydrophobicContact CE2-CE2 4.16Å; F545-Y582 AromaticContact CE2-CG 3.97Å; F545-Y582 HydrophobicContact CE2-CG 3.97Å; F545-Y582 HydrophobicContact CG-CD2 4.43Å; F545-Y582 AromaticContact CZ-CD2 3.86Å; F545-Y582 HydrophobicContact CZ-CD2 3.86Å; F545-Y582 HydrophobicContact CZ-CE2 4.36Å
546	P	70.9	Confident	74	Confident	13 Å²	13	58.2 Å²	58.2	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-53.3	-37.8	176.4	-26.4	32.7	0	0	0	113.4	N525 I527 A549 H550	N525-P546 VanDerWaalsContact O-CD 3.22Å; N525-P546 WeakPolarHBondContact O-CD 3.31Å; N525-P546 WeakPolarHBondContact O-CG 3.48Å; I527-P546 HydrophobicContact CD1-CB 4Å; I527-P546 HydrophobicContact CD1-CG 3.97Å; I527-P546 HydrophobicContact CG1-CG 4.01Å; I527-P546 HydrophobicContact CG2-CG 4.24Å; P546-A549 VanDerWaalsContact O-CB 3.24Å; P546-A549 WeakPolarHBondContact O-CB 3.48Å; P546-A549 PolarHBondContact O-N 2.81Å; P546-H550 PolarHBondContact O-CD2 3.03Å; P546-H550 PolarHBondContact O-N 3.38Å
547	V	74.9	Confident	74.6	Confident	1 Å²	1	62 Å²	62	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-71	-39.5	178.3	173.7	0	0	0	0	112.1	I24 Y519 F545 A549 H550 I551 I581	I24-V547 HydrophobicContact CB-CG1 4.35Å; I24-V547 HydrophobicContact CD1-CG1 4.1Å; I24-V547 HydrophobicContact CG2-CG1 3.89Å; Y519-V547 HydrophobicContact CD1-CG2 3.91Å; Y519-V547 HydrophobicContact CD2-CG2 4.37Å; Y519-V547 HydrophobicContact CG-CG2 3.65Å; F545-V547 PolarHBondContact O-N 3.28Å; V547-A549 PolarHBondContact O-N 2.81Å; V547-H550 PolarHBondContact O-N 3.01Å; V547-H550 VanDerWaalsContact O-N 3.12Å; V547-I551 HydrophobicContact CG1-CD1 3.66Å; V547-I551 HydrophobicContact CG1-CG1 4.11Å; V547-I551 WeakPolarHBondContact O-CG1 3.33Å; V547-I551 PolarHBondContact O-N 2.71Å; V547-I581 HydrophobicContact CB-CD1 4.08Å; V547-I581 HydrophobicContact CG1-CD1 3.37Å
548	D	79.1	Confident	75.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-33.1	173.8	-79.2	-19.5	0	0	0	111.2	F545 H550 I551 N552 P580 I581 Y582	F545-D548 HydrophobicContact CB-CB 4.44Å; F545-D548 PolarHBondContact O-N 3.42Å; F545-D548 VanDerWaalsContact O-N 3.07Å; D548-H550 VanDerWaalsContact C-N 3.32Å; D548-H550 PolarHBondContact O-N 3.39Å; D548-I551 PolarHBondContact O-N 3.29Å; D548-N552 WeakPolarHBondContact O-CB 3.45Å; D548-N552 VanDerWaalsContact O-CG 3.25Å; D548-N552 PolarHBondContact O-N 3.45Å; D548-N552 PolarHBondContact O-ND2 3.33Å; D548-P580 WeakPolarHBondContact OD1-CD 3.35Å; D548-I581 WeakPolarHBondContact OD1-CB 3.47Å; D548-I581 PolarHBondContact OD1-N 2.93Å; D548-Y582 WeakPolarHBondContact OD2-CA 3.36Å; D548-Y582 WeakPolarHBondContact OD2-CB 3.49Å; D548-Y582 PolarHBondContact OD2-N 2.88Å
549	A	75.1	Confident	75.9	Confident	19 Å²	19	55.6 Å²	55.6	16%	0.157	27%	0.269	C	S	.	.	H	α-helix	trans	-57.2	-45.6	171.7	0	0	0	0	0	112.5	I527 M544 F545 P546 V547 A553	I527-A549 HydrophobicContact CD1-CB 4.38Å; M544-A549 VanDerWaalsContact CE-CA 3.45Å; M544-A549 HydrophobicContact CE-CB 3.12Å; M544-A549 VanDerWaalsContact SD-CA 3.59Å; M544-A549 HydrophobicContact SD-CB 3.71Å; F545-A549 PolarHBondContact O-N 3.46Å; P546-A549 VanDerWaalsContact O-CB 3.24Å; P546-A549 WeakPolarHBondContact O-CB 3.48Å; P546-A549 PolarHBondContact O-N 2.81Å; V547-A549 PolarHBondContact O-N 2.81Å; A549-A553 WeakPolarHBondContact O-CB 3.33Å; A549-A553 PolarHBondContact O-N 2.95Å
550	H	76.2	Confident	76.3	Confident	55 Å²	55	51.6 Å²	51.6	26%	0.255	26%	0.264	S	S	.	.	H	α-helix	trans	-72	-40.7	179	-71.5	-64.7	0	0	0	112.5	T25 P546 V547 D548 N552 A553 F554	T25-H550 HydrophobicContact CG2-CB 4.03Å; T25-H550 PolarHBondContact OG1-CD2 2.73Å; P546-H550 PolarHBondContact O-CD2 3.03Å; P546-H550 PolarHBondContact O-N 3.38Å; V547-H550 PolarHBondContact O-N 3.01Å; V547-H550 VanDerWaalsContact O-N 3.12Å; D548-H550 VanDerWaalsContact C-N 3.32Å; D548-H550 PolarHBondContact O-N 3.39Å; H550-N552 VanDerWaalsContact C-N 3.34Å; H550-A553 PolarHBondContact O-N 3.36Å; H550-F554 WeakPolarHBondContact O-CB 3.41Å; H550-F554 PolarHBondContact O-N 3.18Å
551	I	81.5	Confident	76.8	Confident	19 Å²	19	49.8 Å²	49.8	10%	0.097	26%	0.257	C	S	.	.	H	α-helix	trans	-60.4	-47.6	174.5	-68.1	169.5	0	0	0	109.4	L28 V547 D548 A553 F554 I555 P580 I581	L28-I551 HydrophobicContact CD1-CG1 3.73Å; V547-I551 HydrophobicContact CG1-CD1 3.66Å; V547-I551 HydrophobicContact CG1-CG1 4.11Å; V547-I551 WeakPolarHBondContact O-CG1 3.33Å; V547-I551 PolarHBondContact O-N 2.71Å; D548-I551 PolarHBondContact O-N 3.29Å; I551-A553 PolarHBondContact O-N 3.47Å; I551-F554 WeakPolarHBondContact O-CB 3.2Å; I551-F554 PolarHBondContact O-N 2.86Å; I551-I555 HydrophobicContact CG2-CD1 3.53Å; I551-I555 HydrophobicContact CG2-CG1 4.15Å; I551-I555 WeakPolarHBondContact O-CB 3.16Å; I551-I555 VanDerWaalsContact O-CG1 3.28Å; I551-I555 WeakPolarHBondContact O-CG1 3.11Å; I551-I555 PolarHBondContact O-N 3.27Å; I551-P580 HydrophobicContact CD1-CG 3.89Å; I551-P580 HydrophobicContact CG2-CG 3.87Å; I551-I581 HydrophobicContact CD1-CD1 4Å; I551-I581 HydrophobicContact CD1-CG1 4.11Å
552	N	79.9	Confident	77.6	Confident	21 Å²	21	45.1 Å²	45.1	11%	0.112	24%	0.236	C	C	.	.	H	α-helix	trans	-56.6	-50.4	174.9	-84.4	-52.3	0	0	0	112.4	D548 H550 F554 I555 N556 R578	D548-N552 WeakPolarHBondContact O-CB 3.45Å; D548-N552 VanDerWaalsContact O-CG 3.25Å; D548-N552 PolarHBondContact O-N 3.45Å; D548-N552 PolarHBondContact O-ND2 3.33Å; H550-N552 VanDerWaalsContact C-N 3.34Å; N552-F554 VanDerWaalsContact C-N 3.26Å; N552-F554 PolarHBondContact O-N 2.94Å; N552-I555 PolarHBondContact O-N 3.41Å; N552-N556 WeakPolarHBondContact O-CB 3.45Å; N552-N556 PolarHBondContact O-N 2.84Å; N552-N556 PolarHBondContact O-ND2 3.44Å; N552-R578 PolarHBondContact ND2-O 2.99Å; N552-R578 WeakPolarHBondContact OD1-CA 3.48Å; N552-R578 WeakPolarHBondContact OD1-CB 3.39Å; N552-R578 WeakPolarHBondContact OD1-CG 3.42Å; N552-R578 PolarHBondContact OD1-O 3.47Å
553	A	78.4	Confident	78.2	Confident	57 Å²	57	44.1 Å²	44.1	47%	0.471	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-39.7	178.8	0	0	0	0	0	111.7	A549 H550 I551 R557	A549-A553 WeakPolarHBondContact O-CB 3.33Å; A549-A553 PolarHBondContact O-N 2.95Å; H550-A553 PolarHBondContact O-N 3.36Å; I551-A553 PolarHBondContact O-N 3.47Å; A553-R557 VanDerWaalsContact O-CB 3.25Å; A553-R557 WeakPolarHBondContact O-CB 3.34Å; A553-R557 PolarHBondContact O-N 2.81Å
554	F	82.2	Confident	78.9	Confident	21 Å²	21	45.4 Å²	45.4	9%	0.092	24%	0.242	C	C	.	.	H	α-helix	trans	-66.8	-47.7	176.1	177.4	-93.5	0	0	0	112.3	L28 I32 I34 H550 I551 N552 R557 N558	L28-F554 HydrophobicContact CB-CB 4.45Å; L28-F554 HydrophobicContact CB-CD1 4.39Å; L28-F554 HydrophobicContact CB-CD2 3.91Å; L28-F554 HydrophobicContact CB-CE2 4.26Å; L28-F554 HydrophobicContact CB-CG 3.98Å; L28-F554 HydrophobicContact CD2-CD1 3.77Å; L28-F554 HydrophobicContact CD2-CE1 3.95Å; L28-F554 HydrophobicContact CD2-CG 4.19Å; L28-F554 WeakPolarHBondContact O-CE2 3.32Å; I32-F554 HydrophobicContact CB-CZ 4.25Å; I32-F554 HydrophobicContact CG2-CZ 4.18Å; I34-F554 HydrophobicContact CD1-CE1 3.92Å; I34-F554 HydrophobicContact CD1-CZ 3.6Å; I34-F554 HydrophobicContact CG1-CZ 4.44Å; H550-F554 WeakPolarHBondContact O-CB 3.41Å; H550-F554 PolarHBondContact O-N 3.18Å; I551-F554 WeakPolarHBondContact O-CB 3.2Å; I551-F554 PolarHBondContact O-N 2.86Å; N552-F554 VanDerWaalsContact C-N 3.26Å; N552-F554 PolarHBondContact O-N 2.94Å; F554-R557 PolarHBondContact O-N 2.72Å; F554-N558 WeakPolarHBondContact CE2-ND2 3.47Å; F554-N558 PolarHBondContact O-N 3.04Å; F554-N558 VanDerWaalsContact O-N 3.14Å; F554-N558 PolarHBondContact O-ND2 3.29Å
555	I	83.3	Confident	79.4	Confident	25 Å²	25	46.2 Å²	46.2	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-50.9	178.7	-68.1	173.2	0	0	0	109.5	I551 N552 R557 N558 W559 I562 H576 I577	I551-I555 HydrophobicContact CG2-CD1 3.53Å; I551-I555 HydrophobicContact CG2-CG1 4.15Å; I551-I555 WeakPolarHBondContact O-CB 3.16Å; I551-I555 VanDerWaalsContact O-CG1 3.28Å; I551-I555 WeakPolarHBondContact O-CG1 3.11Å; I551-I555 PolarHBondContact O-N 3.27Å; N552-I555 PolarHBondContact O-N 3.41Å; I555-R557 VanDerWaalsContact C-N 3.31Å; I555-R557 PolarHBondContact O-N 3.34Å; I555-N558 CarbonylContact O-C 3.57Å; I555-N558 PolarHBondContact O-N 2.99Å; I555-N558 VanDerWaalsContact O-N 3.08Å; I555-W559 HydrophobicContact CG2-CE3 3.63Å; I555-W559 HydrophobicContact CG2-CZ3 3.97Å; I555-W559 WeakPolarHBondContact O-CA 3.34Å; I555-W559 WeakPolarHBondContact O-CB 3.26Å; I555-W559 PolarHBondContact O-N 2.81Å; I555-I562 HydrophobicContact CG2-CD1 4.34Å; I555-H576 WeakPolarHBondContact CG2-NE2 3.39Å; I555-I577 VanDerWaalsContact CD1-O 3.3Å; I555-I577 WeakPolarHBondContact CD1-O 3.48Å
556	N	82	Confident	79.7	Confident	80 Å²	80	47.1 Å²	47.1	43%	0.428	26%	0.255	S	S	.	.	H	α-helix	trans	-55.5	-44.9	178.5	-74.9	-27	0	0	0	112.1	N552 N558 H576	N552-N556 WeakPolarHBondContact O-CB 3.45Å; N552-N556 PolarHBondContact O-N 2.84Å; N552-N556 PolarHBondContact O-ND2 3.44Å; N556-N558 VanDerWaalsContact C-N 3.29Å; N556-N558 PolarHBondContact O-N 3.49Å; N556-H576 PolarHBondContact OD1-CE1 3.3Å; N556-H576 PolarHBondContact OD1-NE2 3.23Å; N556-H576 VanDerWaalsContact OD1-NE2 3.14Å
557	R	80.5	Confident	79.7	Confident	202 Å²	202	49.9 Å²	49.9	76%	0.762	27%	0.274	S	S	*	.	H	α-helix	trans	-64	-34.5	179.3	-179	177.9	177.4	-172.8	-1.1	112.7	A553 F554 I555	A553-R557 VanDerWaalsContact O-CB 3.25Å; A553-R557 WeakPolarHBondContact O-CB 3.34Å; A553-R557 PolarHBondContact O-N 2.81Å; F554-R557 PolarHBondContact O-N 2.72Å; I555-R557 VanDerWaalsContact C-N 3.31Å; I555-R557 PolarHBondContact O-N 3.34Å
558	N	83.4	Confident	79.7	Confident	37 Å²	37	57 Å²	57	20%	0.198	31%	0.307	C	S	.	.	H	α-helix	trans	-107.1	5.5	-173.7	-63	-77	0	0	0	113.8	I34 F554 I555 N556 P560 A561 I562	I34-N558 HydrophobicContact CD1-CB 3.46Å; I34-N558 VanDerWaalsContact CD1-CB 3.46Å; F554-N558 WeakPolarHBondContact CE2-ND2 3.47Å; F554-N558 PolarHBondContact O-N 3.04Å; F554-N558 VanDerWaalsContact O-N 3.14Å; F554-N558 PolarHBondContact O-ND2 3.29Å; I555-N558 CarbonylContact O-C 3.57Å; I555-N558 PolarHBondContact O-N 2.99Å; I555-N558 VanDerWaalsContact O-N 3.08Å; N556-N558 VanDerWaalsContact C-N 3.29Å; N556-N558 PolarHBondContact O-N 3.49Å; N558-P560 VanDerWaalsContact C-CD 3.47Å; N558-A561 PolarHBondContact O-N 3.44Å; N558-I562 HydrophobicContact CB-CD1 4.3Å; N558-I562 WeakPolarHBondContact O-CG1 3.37Å; N558-I562 PolarHBondContact O-N 2.94Å
559	W	83.5	Confident	79.1	Confident	64 Å²	64	65.4 Å²	65.4	24%	0.242	34%	0.344	C	S	.	.	H	α-helix	trans	-52.4	-45.2	-173.3	-170.2	-115.1	0	0	0	113.8	I555 A561 I562 V563 I574 H576	I555-W559 HydrophobicContact CG2-CE3 3.63Å; I555-W559 HydrophobicContact CG2-CZ3 3.97Å; I555-W559 WeakPolarHBondContact O-CA 3.34Å; I555-W559 WeakPolarHBondContact O-CB 3.26Å; I555-W559 PolarHBondContact O-N 2.81Å; W559-A561 VanDerWaalsContact C-N 3.27Å; W559-A561 PolarHBondContact O-N 2.98Å; W559-I562 HydrophobicContact CE3-CB 4.37Å; W559-I562 HydrophobicContact CE3-CD1 4.3Å; W559-I562 HydrophobicContact CE3-CG2 4.31Å; W559-I562 HydrophobicContact CZ3-CG2 4.14Å; W559-I562 PolarHBondContact O-N 3.38Å; W559-I562 VanDerWaalsContact O-N 3.13Å; W559-V563 HydrophobicContact CD2-CG2 4.17Å; W559-V563 HydrophobicContact CG-CG2 4.38Å; W559-V563 HydrophobicContact CZ2-CG2 4.08Å; W559-V563 WeakPolarHBondContact O-CG2 3.32Å; W559-V563 PolarHBondContact O-N 3.29Å; W559-I574 HydrophobicContact CH2-CB 4.13Å; W559-I574 HydrophobicContact CH2-CG2 4.21Å; W559-H576 AromaticContact CD2-CD2 3.92Å; W559-H576 AromaticContact CE3-CD2 3.59Å; W559-H576 VanDerWaalsContact CH2-CA 3.47Å; W559-H576 HydrophobicContact CH2-CB 3.8Å; W559-H576 AromaticContact CH2-CD2 3.85Å; W559-H576 HydrophobicContact CZ2-CB 3.78Å; W559-H576 HydrophobicContact CZ3-CB 4.4Å; W559-H576 AromaticContact CZ3-CD2 3.56Å
560	P	82.1	Confident	78.6	Confident	93 Å²	93	67.2 Å²	67.2	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-58.7	-37.5	178.2	-24.4	35.2	0	0	0	113.5	N558 T564	N558-P560 VanDerWaalsContact C-CD 3.47Å; P560-T564 WeakPolarHBondContact O-CB 3.41Å; P560-T564 PolarHBondContact O-N 3.36Å; P560-T564 PolarHBondContact O-OG1 2.97Å
561	A	82.4	Confident	78.1	Confident	16 Å²	16	73.7 Å²	73.7	13%	0.132	39%	0.386	C	S	.	.	H	α-helix	trans	-75	-36.2	178.6	0	0	0	0	0	111.9	I34 N558 W559 T564 M565	I34-A561 HydrophobicContact CG2-CB 3.32Å; N558-A561 PolarHBondContact O-N 3.44Å; W559-A561 VanDerWaalsContact C-N 3.27Å; W559-A561 PolarHBondContact O-N 2.98Å; A561-T564 PolarHBondContact O-N 3.3Å; A561-M565 WeakPolarHBondContact O-CE 3.49Å; A561-M565 PolarHBondContact O-N 2.91Å
562	I	81.6	Confident	77.2	Confident	40 Å²	40	77.6 Å²	77.6	21%	0.205	41%	0.405	C	S	.	.	H	α-helix	trans	-61.1	-47.4	173.5	-65.2	168.8	0	0	0	110.3	I34 I555 N558 W559 T564 M565 A566 I574	I34-I562 HydrophobicContact CD1-CG1 4.31Å; I555-I562 HydrophobicContact CG2-CD1 4.34Å; N558-I562 HydrophobicContact CB-CD1 4.3Å; N558-I562 WeakPolarHBondContact O-CG1 3.37Å; N558-I562 PolarHBondContact O-N 2.94Å; W559-I562 HydrophobicContact CE3-CB 4.37Å; W559-I562 HydrophobicContact CE3-CD1 4.3Å; W559-I562 HydrophobicContact CE3-CG2 4.31Å; W559-I562 HydrophobicContact CZ3-CG2 4.14Å; W559-I562 PolarHBondContact O-N 3.38Å; W559-I562 VanDerWaalsContact O-N 3.13Å; I562-T564 VanDerWaalsContact C-N 3.34Å; I562-T564 PolarHBondContact O-N 3.36Å; I562-M565 PolarHBondContact O-N 2.95Å; I562-A566 PolarHBondContact O-N 3.27Å; I562-I574 HydrophobicContact CG2-CD1 3.82Å
563	V	80.7	Confident	76.6	Confident	64 Å²	64	78.7 Å²	78.7	39%	0.388	41%	0.413	S	S	.	.	H	α-helix	trans	-59.1	-45.3	175.2	173.8	0	0	0	0	111	W559 M565 A566 S567	W559-V563 HydrophobicContact CD2-CG2 4.17Å; W559-V563 HydrophobicContact CG-CG2 4.38Å; W559-V563 HydrophobicContact CZ2-CG2 4.08Å; W559-V563 WeakPolarHBondContact O-CG2 3.32Å; W559-V563 PolarHBondContact O-N 3.29Å; V563-M565 VanDerWaalsContact C-N 3.34Å; V563-M565 PolarHBondContact O-N 3.47Å; V563-A566 PolarHBondContact O-N 2.94Å; V563-S567 WeakPolarHBondContact O-CB 3.39Å; V563-S567 PolarHBondContact O-N 3.49Å
564	T	80.3	Confident	76.3	Confident	80 Å²	80	78.6 Å²	78.6	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-60.6	-42.1	177.7	-54.1	0	0	0	0	111.8	P560 A561 I562 S567	P560-T564 WeakPolarHBondContact O-CB 3.41Å; P560-T564 PolarHBondContact O-N 3.36Å; P560-T564 PolarHBondContact O-OG1 2.97Å; A561-T564 PolarHBondContact O-N 3.3Å; I562-T564 VanDerWaalsContact C-N 3.34Å; I562-T564 PolarHBondContact O-N 3.36Å; T564-S567 PolarHBondContact O-OG 2.9Å
565	M	77.3	Confident	76.1	Confident	57 Å²	57	79 Å²	79	28%	0.281	41%	0.409	S	S	.	.	H	α-helix	trans	-67.4	-45.1	177.3	-77.7	-177	-78.3	0	0	112.5	I34 P35 A561 I562 V563 S567 Q568 F569	I34-M565 HydrophobicContact CB-CE 4.24Å; I34-M565 HydrophobicContact CG1-CE 4.21Å; I34-M565 HydrophobicContact CG2-CE 3.39Å; P35-M565 HydrophobicContact CG-CG 4.35Å; P35-M565 HydrophobicContact CG-SD 3.82Å; A561-M565 WeakPolarHBondContact O-CE 3.49Å; A561-M565 PolarHBondContact O-N 2.91Å; I562-M565 PolarHBondContact O-N 2.95Å; V563-M565 VanDerWaalsContact C-N 3.34Å; V563-M565 PolarHBondContact O-N 3.47Å; M565-S567 VanDerWaalsContact C-N 3.29Å; M565-S567 PolarHBondContact O-N 2.75Å; M565-Q568 VanDerWaalsContact O-CB 3.28Å; M565-Q568 WeakPolarHBondContact O-CB 3.25Å; M565-Q568 PolarHBondContact O-N 3.13Å; M565-Q568 VanDerWaalsContact O-N 3.16Å; M565-F569 VanDerWaalsContact O-CD2 3.31Å; M565-F569 WeakPolarHBondContact O-CD2 3.25Å
566	A	77.7	Confident	75.8	Confident	26 Å²	26	78.8 Å²	78.8	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-70.3	-27.7	-178.7	0	0	0	0	0	113.4	I562 V563 Q568 F569 S570 I574	I562-A566 PolarHBondContact O-N 3.27Å; V563-A566 PolarHBondContact O-N 2.94Å; A566-Q568 PolarHBondContact O-N 2.93Å; A566-F569 PolarHBondContact O-N 2.97Å; A566-S570 PolarHBondContact O-N 3.06Å; A566-I574 HydrophobicContact CB-CD1 3.04Å; A566-I574 HydrophobicContact CB-CG1 3.34Å
567	S	72.8	Confident	75.8	Confident	71 Å²	71	77.8 Å²	77.8	50%	0.497	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.9	173.3	74.9	0	0	0	0	113	V563 T564 M565 S570	V563-S567 WeakPolarHBondContact O-CB 3.39Å; V563-S567 PolarHBondContact O-N 3.49Å; T564-S567 PolarHBondContact O-OG 2.9Å; M565-S567 VanDerWaalsContact C-N 3.29Å; M565-S567 PolarHBondContact O-N 2.75Å; S567-S570 WeakPolarHBondContact CA-O 3.48Å
568	Q	73.2	Confident	75.6	Confident	149 Å²	149	70 Å²	70	70%	0.696	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-25.7	173.7	-57.5	179.3	-8.4	0	0	113.1	M565 A566	M565-Q568 VanDerWaalsContact O-CB 3.28Å; M565-Q568 WeakPolarHBondContact O-CB 3.25Å; M565-Q568 PolarHBondContact O-N 3.13Å; M565-Q568 VanDerWaalsContact O-N 3.16Å; A566-Q568 PolarHBondContact O-N 2.93Å
569	F	66.7	Low	75.4	Confident	177 Å²	177	69.1 Å²	69.1	78%	0.776	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-29.4	-175.6	-63.3	-77.4	0	0	0	112.8	M565 A566	M565-F569 VanDerWaalsContact O-CD2 3.31Å; M565-F569 WeakPolarHBondContact O-CD2 3.25Å; A566-F569 PolarHBondContact O-N 2.97Å
570	S	65.4	Low	75.3	Confident	57 Å²	57	67.3 Å²	67.3	40%	0.399	37%	0.365	S	S	.	.			trans	-152.6	145.4	-178.4	-173.5	0	0	0	0	111.2	A566 S567 M572	A566-S570 PolarHBondContact O-N 3.06Å; S567-S570 WeakPolarHBondContact CA-O 3.48Å; S570-M572 VanDerWaalsContact OG-CB 3.3Å; S570-M572 WeakPolarHBondContact OG-CB 3.19Å; S570-M572 PolarHBondContact OG-N 3.09Å
571	H	64.5	Low	75.4	Confident	192 Å²	192	64.3 Å²	64.3	89%	0.889	34%	0.344	S	S	*	.	S	Bend	trans	-79.5	-10.1	169.3	-63.2	26.9	0	0	0	111.3
572	M	63.3	Low	75.4	Confident	101 Å²	101	66.3 Å²	66.3	50%	0.498	35%	0.348	S	S	.	.	S	Bend	trans	-73.7	133.2	178.9	-168.6	173.8	-78.1	0	0	110.2	S570	S570-M572 VanDerWaalsContact OG-CB 3.3Å; S570-M572 WeakPolarHBondContact OG-CB 3.19Å; S570-M572 PolarHBondContact OG-N 3.09Å
573	P	67	Low	75.6	Confident	44 Å²	44	64.4 Å²	64.4	29%	0.286	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-62.8	141	177	6.8	-5.3	0	0	0	110.8	F604 T608	P573-F604 HydrophobicContact CB-CE2 4.25Å; P573-F604 HydrophobicContact CB-CZ 4.44Å; P573-F604 HydrophobicContact CG-CE2 4.25Å; P573-F604 HydrophobicContact CG-CZ 3.94Å; P573-T608 HydrophobicContact CG-CG2 4.13Å; P573-T608 WeakPolarHBondContact CG-OG1 3.03Å
574	I	73	Confident	76.1	Confident	55 Å²	55	63.6 Å²	63.6	28%	0.282	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-80.1	127.1	177.9	-40.6	170.2	0	0	0	108.9	W559 I562 A566	W559-I574 HydrophobicContact CH2-CB 4.13Å; W559-I574 HydrophobicContact CH2-CG2 4.21Å; I562-I574 HydrophobicContact CG2-CD1 3.82Å; A566-I574 HydrophobicContact CB-CD1 3.04Å; A566-I574 HydrophobicContact CB-CG1 3.34Å
575	P	77.2	Confident	76.3	Confident	30 Å²	30	60.6 Å²	60.6	20%	0.195	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-67.9	136.1	170.6	30.5	-35	0	0	0	110.6	I577 L595 F604	P575-I577 PolarHBondContact O-N 2.73Å; P575-I577 VanDerWaalsContact O-N 3.14Å; P575-L595 HydrophobicContact CB-CD2 4.33Å; P575-L595 HydrophobicContact CG-CD2 3.85Å; P575-F604 HydrophobicContact CB-CD2 3.85Å; P575-F604 HydrophobicContact CB-CE2 4.37Å
576	H	78.5	Confident	76.6	Confident	19 Å²	19	61.8 Å²	61.8	9%	0.088	32%	0.317	C	S	.	.			trans	-78.7	98.3	-177	-176.2	-142.9	0	0	0	110.8	I555 N556 W559 R578 S600 D603	I555-H576 WeakPolarHBondContact CG2-NE2 3.39Å; N556-H576 PolarHBondContact OD1-CE1 3.3Å; N556-H576 PolarHBondContact OD1-NE2 3.23Å; N556-H576 VanDerWaalsContact OD1-NE2 3.14Å; W559-H576 AromaticContact CD2-CD2 3.92Å; W559-H576 AromaticContact CE3-CD2 3.59Å; W559-H576 VanDerWaalsContact CH2-CA 3.47Å; W559-H576 HydrophobicContact CH2-CB 3.8Å; W559-H576 AromaticContact CH2-CD2 3.85Å; W559-H576 HydrophobicContact CZ2-CB 3.78Å; W559-H576 HydrophobicContact CZ3-CB 4.4Å; W559-H576 AromaticContact CZ3-CD2 3.56Å; H576-R578 PolarHBondContact O-N 3.45Å; H576-S600 VanDerWaalsContact O-CA 3.3Å; H576-S600 WeakPolarHBondContact O-CA 3.37Å; H576-S600 WeakPolarHBondContact O-CB 3.46Å; H576-D603 IonicContact ND1-OD2 2.74Å
577	I	80.7	Confident	77.1	Confident	60 Å²	60	61.7 Å²	61.7	31%	0.308	31%	0.313	S	S	.	.			trans	-74	124.3	179.1	-65.7	167.5	0	0	0	109.6	I555 P575 P580 M598	I555-I577 VanDerWaalsContact CD1-O 3.3Å; I555-I577 WeakPolarHBondContact CD1-O 3.48Å; P575-I577 PolarHBondContact O-N 2.73Å; P575-I577 VanDerWaalsContact O-N 3.14Å; I577-P580 HydrophobicContact CG2-CB 4.05Å; I577-P580 HydrophobicContact CG2-CG 4.32Å; I577-M598 HydrophobicContact CD1-SD 4.02Å; I577-M598 HydrophobicContact CG1-CB 4.44Å; I577-M598 HydrophobicContact CG1-SD 4.13Å; I577-M598 HydrophobicContact CG2-CB 4.1Å; I577-M598 HydrophobicContact CG2-CG 4.33Å; I577-M598 HydrophobicContact CG2-SD 4.12Å
578	R	76.4	Confident	78	Confident	38 Å²	38	58.3 Å²	58.3	14%	0.143	29%	0.289	C	S	.	.			trans	-107.9	-45.5	-178.3	-72.2	174.4	174.5	-124.7	14.3	113.9	D531 N552 H576 P580 M598 D599 R602 D603	D531-R578 IonicContact OD2-NH1 3.57Å; N552-R578 PolarHBondContact ND2-O 2.99Å; N552-R578 WeakPolarHBondContact OD1-CA 3.48Å; N552-R578 WeakPolarHBondContact OD1-CB 3.39Å; N552-R578 WeakPolarHBondContact OD1-CG 3.42Å; N552-R578 PolarHBondContact OD1-O 3.47Å; H576-R578 PolarHBondContact O-N 3.45Å; R578-P580 VanDerWaalsContact C-CD 3.48Å; R578-P580 VanDerWaalsContact O-CD 3.29Å; R578-P580 WeakPolarHBondContact O-CD 3.24Å; R578-M598 PolarHBondContact N-O 3.28Å; R578-M598 VanDerWaalsContact N-O 3.07Å; R578-D599 HydrophobicContact CB-CB 4.43Å; R578-R602 VanDerWaalsContact CZ-CZ 3.47Å; R578-D603 IonicContact CZ-OD2 3.58Å; R578-D603 IonicContact NE-OD2 3.88Å; R578-D603 PolarHBondContact NE-OD2 3.48Å; R578-D603 IonicContact NH2-OD1 3.89Å; R578-D603 IonicContact NH2-OD2 3.21Å; R578-D603 PolarHBondContact NH2-OD2 2.87Å
579	S	78.5	Confident	78.8	Confident	18 Å²	18	55.6 Å²	55.6	13%	0.126	28%	0.277	C	S	.	.			trans	-124.9	71.2	-172.8	56.6	0	0	0	0	110.9	G583 M598	S579-G583 WeakPolarHBondContact O-CA 3.44Å; S579-G583 PolarHBondContact O-N 2.86Å; S579-M598 PolarHBondContact N-O 2.89Å
580	P	83.3	Confident	79.9	Confident	27 Å²	27	51.7 Å²	51.7	18%	0.175	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-39.7	-176.7	25.6	-32.7	0	0	0	112.3	D548 I551 I577 R578 I584	D548-P580 WeakPolarHBondContact OD1-CD 3.35Å; I551-P580 HydrophobicContact CD1-CG 3.89Å; I551-P580 HydrophobicContact CG2-CG 3.87Å; I577-P580 HydrophobicContact CG2-CB 4.05Å; I577-P580 HydrophobicContact CG2-CG 4.32Å; R578-P580 VanDerWaalsContact C-CD 3.48Å; R578-P580 VanDerWaalsContact O-CD 3.29Å; R578-P580 WeakPolarHBondContact O-CD 3.24Å; P580-I584 WeakPolarHBondContact O-CB 3.45Å; P580-I584 WeakPolarHBondContact O-CD1 3.38Å; P580-I584 WeakPolarHBondContact O-CG1 3.26Å; P580-I584 PolarHBondContact O-N 3.48Å
581	I	83.9	Confident	81.1	Confident	30 Å²	30	51.8 Å²	51.8	15%	0.154	26%	0.26	C	S	.	.	H	α-helix	trans	-75.5	-50.4	-177.5	-60.9	-173	0	0	0	110.3	I24 V547 D548 I551 G583 I584 L585	I24-I581 HydrophobicContact CD1-CD1 4.38Å; V547-I581 HydrophobicContact CB-CD1 4.08Å; V547-I581 HydrophobicContact CG1-CD1 3.37Å; D548-I581 WeakPolarHBondContact OD1-CB 3.47Å; D548-I581 PolarHBondContact OD1-N 2.93Å; I551-I581 HydrophobicContact CD1-CD1 4Å; I551-I581 HydrophobicContact CD1-CG1 4.11Å; I581-G583 VanDerWaalsContact C-N 3.29Å; I581-G583 PolarHBondContact O-N 2.85Å; I581-I584 PolarHBondContact O-N 3.19Å; I581-L585 HydrophobicContact CG2-CD1 3.64Å; I581-L585 HydrophobicContact CG2-CG 4.4Å; I581-L585 WeakPolarHBondContact O-CB 3.22Å; I581-L585 WeakPolarHBondContact O-CG 3.49Å; I581-L585 PolarHBondContact O-N 3.32Å
582	Y	81.2	Confident	82.4	Confident	58 Å²	58	45 Å²	45	23%	0.227	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-40.3	175.2	-176.8	-86.3	0	0	0	111.4	F545 D548 I584 L585 H586 N587	F545-Y582 AromaticContact CD2-CD2 3.59Å; F545-Y582 HydrophobicContact CD2-CD2 3.59Å; F545-Y582 HydrophobicContact CD2-CG 4.09Å; F545-Y582 AromaticContact CE2-CD2 3.26Å; F545-Y582 HydrophobicContact CE2-CD2 3.26Å; F545-Y582 HydrophobicContact CE2-CE2 4.16Å; F545-Y582 AromaticContact CE2-CG 3.97Å; F545-Y582 HydrophobicContact CE2-CG 3.97Å; F545-Y582 HydrophobicContact CG-CD2 4.43Å; F545-Y582 AromaticContact CZ-CD2 3.86Å; F545-Y582 HydrophobicContact CZ-CD2 3.86Å; F545-Y582 HydrophobicContact CZ-CE2 4.36Å; D548-Y582 WeakPolarHBondContact OD2-CA 3.36Å; D548-Y582 WeakPolarHBondContact OD2-CB 3.49Å; D548-Y582 PolarHBondContact OD2-N 2.88Å; Y582-I584 PolarHBondContact O-N 3.17Å; Y582-L585 PolarHBondContact O-N 3.34Å; Y582-H586 HydrophobicContact CD1-CB 4.2Å; Y582-H586 HydrophobicContact CD2-CB 4.33Å; Y582-H586 HydrophobicContact CE1-CB 4.04Å; Y582-H586 AromaticContact CE1-CD2 3.66Å; Y582-H586 HydrophobicContact CE2-CB 4.15Å; Y582-H586 HydrophobicContact CG-CB 4.32Å; Y582-H586 AromaticContact CZ-CD2 3.32Å; Y582-H586 AromaticContact CZ-CG 3.79Å; Y582-H586 WeakPolarHBondContact O-CA 3.41Å; Y582-H586 WeakPolarHBondContact O-CB 3.46Å; Y582-H586 PolarHBondContact O-N 2.84Å; Y582-H586 PolarHBondContact OH-CD2 2.94Å; Y582-H586 PolarHBondContact OH-NE2 2.81Å; Y582-N587 WeakPolarHBondContact CE1-OD1 3.22Å; Y582-N587 PolarHBondContact O-N 3.46Å
583	G	87.1	Confident	83.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	I	π-helix	trans	-58.5	-48.3	177.8	0	0	0	0	0	111.9	S579 I581 N587 C588 A597	S579-G583 WeakPolarHBondContact O-CA 3.44Å; S579-G583 PolarHBondContact O-N 2.86Å; I581-G583 VanDerWaalsContact C-N 3.29Å; I581-G583 PolarHBondContact O-N 2.85Å; G583-N587 CarbonylContact O-C 3.37Å; G583-N587 WeakPolarHBondContact O-CB 3.44Å; G583-N587 PolarHBondContact O-N 3.26Å; G583-N587 VanDerWaalsContact O-N 3.16Å; G583-C588 PolarHBondContact O-N 3.07Å; G583-C588 PolarHBondContact O-SG 3.5Å; G583-A597 WeakPolarHBondContact CA-O 3.31Å
584	I	89.3	Confident	85	Confident	47 Å²	47	39.2 Å²	39.2	24%	0.241	20%	0.197	C	C	.	.	I	π-helix	trans	-70.8	-40.5	178.6	-67.5	168.2	0	0	0	112.2	P580 I581 Y582 C588 M598 Y816 A819	P580-I584 WeakPolarHBondContact O-CB 3.45Å; P580-I584 WeakPolarHBondContact O-CD1 3.38Å; P580-I584 WeakPolarHBondContact O-CG1 3.26Å; P580-I584 PolarHBondContact O-N 3.48Å; I581-I584 PolarHBondContact O-N 3.19Å; Y582-I584 PolarHBondContact O-N 3.17Å; I584-C588 WeakPolarHBondContact O-CB 3.36Å; I584-M598 HydrophobicContact CD1-CE 4.12Å; I584-M598 HydrophobicContact CG1-CE 4.14Å; I584-Y816 WeakPolarHBondContact O-CA 3.36Å; I584-Y816 WeakPolarHBondContact O-CB 3.38Å; I584-A819 HydrophobicContact CG2-CB 3.66Å
585	L	85.8	Confident	85.8	Confident	16 Å²	16	38.3 Å²	38.3	8%	0.084	19%	0.193	C	C	.	.	I	π-helix	trans	-87.4	-16.5	-173.1	-66.7	177	0	0	0	114.5	V520 I581 Y582 Y816 A819	V520-L585 HydrophobicContact CG1-CD1 3.94Å; V520-L585 WeakPolarHBondContact O-CD1 3.24Å; I581-L585 HydrophobicContact CG2-CD1 3.64Å; I581-L585 HydrophobicContact CG2-CG 4.4Å; I581-L585 WeakPolarHBondContact O-CB 3.22Å; I581-L585 WeakPolarHBondContact O-CG 3.49Å; I581-L585 PolarHBondContact O-N 3.32Å; Y582-L585 PolarHBondContact O-N 3.34Å; L585-Y816 WeakPolarHBondContact O-CD2 3.44Å; L585-Y816 VanDerWaalsContact O-CE2 3.3Å; L585-Y816 WeakPolarHBondContact O-CE2 3.34Å; L585-A819 HydrophobicContact CD2-CB 3.72Å
586	H	83.7	Confident	86.4	Confident	82 Å²	82	40.8 Å²	40.8	38%	0.38	20%	0.202	S	C	.	.	I	π-helix	trans	-126.2	-61.1	-177.3	-166.2	71	0	0	0	112	Y582 C588 H589	Y582-H586 HydrophobicContact CD1-CB 4.2Å; Y582-H586 HydrophobicContact CD2-CB 4.33Å; Y582-H586 HydrophobicContact CE1-CB 4.04Å; Y582-H586 AromaticContact CE1-CD2 3.66Å; Y582-H586 HydrophobicContact CE2-CB 4.15Å; Y582-H586 HydrophobicContact CG-CB 4.32Å; Y582-H586 AromaticContact CZ-CD2 3.32Å; Y582-H586 AromaticContact CZ-CG 3.79Å; Y582-H586 WeakPolarHBondContact O-CA 3.41Å; Y582-H586 WeakPolarHBondContact O-CB 3.46Å; Y582-H586 PolarHBondContact O-N 2.84Å; Y582-H586 PolarHBondContact OH-CD2 2.94Å; Y582-H586 PolarHBondContact OH-NE2 2.81Å; H586-C588 VanDerWaalsContact C-N 3.31Å; H586-C588 PolarHBondContact O-N 3.06Å; H586-H589 VanDerWaalsContact O-CB 3.23Å; H586-H589 WeakPolarHBondContact O-CB 3.31Å; H586-H589 PolarHBondContact O-N 3.37Å
587	N	87.7	Confident	86.9	Confident	24 Å²	24	39.9 Å²	39.9	13%	0.128	20%	0.197	C	C	.	.	I	π-helix	trans	-68.1	-32	-174.3	-64.7	-21.5	0	0	0	112.9	Y582 G583 H589 D590 Q592 A597	Y582-N587 WeakPolarHBondContact CE1-OD1 3.22Å; Y582-N587 PolarHBondContact O-N 3.46Å; G583-N587 CarbonylContact O-C 3.37Å; G583-N587 WeakPolarHBondContact O-CB 3.44Å; G583-N587 PolarHBondContact O-N 3.26Å; G583-N587 VanDerWaalsContact O-N 3.16Å; N587-H589 VanDerWaalsContact C-N 3.3Å; N587-D590 PolarHBondContact O-N 2.67Å; N587-Q592 WeakPolarHBondContact O-CG 3.32Å; N587-Q592 PolarHBondContact O-N 3.06Å; N587-A597 HydrophobicContact CB-CB 3.69Å; N587-A597 PolarHBondContact ND2-O 2.9Å
588	C	92	Very high	87.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.9	173.7	-70.1	0	0	0	0	113.1	G583 I584 H586 D590 N591 C812 Y813	G583-C588 PolarHBondContact O-N 3.07Å; G583-C588 PolarHBondContact O-SG 3.5Å; I584-C588 WeakPolarHBondContact O-CB 3.36Å; H586-C588 VanDerWaalsContact C-N 3.31Å; H586-C588 PolarHBondContact O-N 3.06Å; C588-D590 PolarHBondContact O-N 3.4Å; C588-N591 WeakPolarHBondContact O-CA 3.3Å; C588-N591 PolarHBondContact O-N 2.96Å; C588-C812 WeakPolarHBondContact CA-SG 3.41Å; C588-C812 HydrophobicContact CB-CB 3.9Å; C588-C812 WeakPolarHBondContact CB-O 3.48Å; C588-C812 WeakPolarHBondContact CB-SG 3.38Å; C588-C812 WeakPolarHBondContact SG-CB 3.2Å; C588-C812 CovalentContact SG-SG 2.03Å; C588-C812 PolarHBondContact SG-SG 2.84Å; C588-Y813 WeakPolarHBondContact O-CA 3.37Å; C588-Y813 PolarHBondContact O-N 2.96Å
589	H	90.7	Very high	87.7	Confident	93 Å²	93	38.5 Å²	38.5	43%	0.431	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-37.8	170.8	171.5	-84.7	0	0	0	110.6	H586 N587 N591 Y813 Y816	H586-H589 VanDerWaalsContact O-CB 3.23Å; H586-H589 WeakPolarHBondContact O-CB 3.31Å; H586-H589 PolarHBondContact O-N 3.37Å; N587-H589 VanDerWaalsContact C-N 3.3Å; H589-N591 PolarHBondContact O-N 3.17Å; H589-Y813 WeakPolarHBondContact O-CD2 3.4Å; H589-Y816 HydrophobicContact CB-CD1 4.25Å; H589-Y816 HydrophobicContact CB-CD2 3.95Å; H589-Y816 HydrophobicContact CB-CE1 4.33Å; H589-Y816 HydrophobicContact CB-CE2 4.02Å; H589-Y816 HydrophobicContact CB-CG 4.06Å; H589-Y816 AromaticContact CD2-CE1 3.61Å; H589-Y816 AromaticContact CD2-CZ 3.63Å
590	D	89.1	Confident	88.1	Confident	95 Å²	95	37.7 Å²	37.7	51%	0.508	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	10.5	175	-60	-18.5	0	0	0	113.1	N587 C588 Q592	N587-D590 PolarHBondContact O-N 2.67Å; C588-D590 PolarHBondContact O-N 3.4Å; D590-Q592 HydrophobicContact CB-CG 4.35Å; D590-Q592 PolarHBondContact O-N 3.35Å
591	N	91	Very high	88.2	Confident	59 Å²	59	37.7 Å²	37.7	32%	0.316	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	36.1	177.7	-160	36.9	0	0	0	114.2	C588 H589 Q811 C812 Y813	C588-N591 WeakPolarHBondContact O-CA 3.3Å; C588-N591 PolarHBondContact O-N 2.96Å; H589-N591 PolarHBondContact O-N 3.17Å; N591-Q811 PolarHBondContact ND2-OE1 2.8Å; N591-Q811 WeakPolarHBondContact OD1-CB 3.45Å; N591-C812 PolarHBondContact OD1-N 3.32Å; N591-Y813 WeakPolarHBondContact OD1-CB 3.45Å; N591-Y813 PolarHBondContact OD1-N 2.71Å; N591-Y813 VanDerWaalsContact OD1-N 3.08Å
592	Q	91	Very high	87.9	Confident	50 Å²	50	39.2 Å²	39.2	23%	0.234	19%	0.19	C	C	.	.			trans	-65	158.4	172.5	-62	179.9	18.6	0	0	110.7	N587 D590 A597 Q811 C812	N587-Q592 WeakPolarHBondContact O-CG 3.32Å; N587-Q592 PolarHBondContact O-N 3.06Å; D590-Q592 HydrophobicContact CB-CG 4.35Å; D590-Q592 PolarHBondContact O-N 3.35Å; Q592-A597 HydrophobicContact CB-CB 4.28Å; Q592-Q811 WeakPolarHBondContact O-CA 3.09Å; Q592-C812 PolarHBondContact O-N 3.44Å; Q592-C812 PolarHBondContact O-SG 3.36Å
593	G	91.6	Very high	87.5	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.01	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-63.4	143.4	169.8	0	0	0	0	0	110.6	L595 Q596 A597 S807 V809	G593-L595 PolarHBondContact O-N 2.94Å; G593-L595 VanDerWaalsContact O-N 3.15Å; G593-Q596 WeakPolarHBondContact O-CA 3.35Å; G593-Q596 WeakPolarHBondContact O-CB 3.16Å; G593-Q596 PolarHBondContact O-N 3.3Å; G593-A597 PolarHBondContact O-N 2.9Å; G593-S807 VanDerWaalsContact CA-O 3.3Å; G593-S807 WeakPolarHBondContact CA-O 3.5Å; G593-S807 PolarHBondContact N-O 3.49Å; G593-V809 CarbonylContact C-O 3.45Å; G593-V809 WeakPolarHBondContact CA-O 3.49Å
594	I	92.8	Very high	87.1	Confident	22 Å²	22	40.4 Å²	40.4	11%	0.113	20%	0.199	C	C	.	.	H	α-helix	trans	-55.2	-38.8	-171	-170.3	58.8	0	0	0	113.2	A597 M598 V809 G810 C812 L815	I594-A597 PolarHBondContact O-N 3.48Å; I594-M598 HydrophobicContact CD1-CE 3.53Å; I594-M598 HydrophobicContact CD1-CG 4.43Å; I594-M598 HydrophobicContact CD1-SD 4.13Å; I594-M598 HydrophobicContact CG1-CE 4.04Å; I594-M598 HydrophobicContact CG1-SD 4.13Å; I594-M598 WeakPolarHBondContact O-CB 3.3Å; I594-M598 WeakPolarHBondContact O-CG 3.39Å; I594-M598 PolarHBondContact O-N 3.36Å; I594-V809 PolarHBondContact N-O 3Å; I594-G810 PolarHBondContact N-O 3.04Å; I594-G810 VanDerWaalsContact N-O 3.17Å; I594-C812 HydrophobicContact CB-CB 4.29Å; I594-C812 HydrophobicContact CD1-CB 3.82Å; I594-L815 HydrophobicContact CD1-CD1 3.75Å
595	L	90	Very high	86.6	Confident	36 Å²	36	42.1 Å²	42.1	19%	0.188	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-36.7	178.7	-64.3	-179.4	0	0	0	112.2	P575 G593 S600 I601 M806	P575-L595 HydrophobicContact CB-CD2 4.33Å; P575-L595 HydrophobicContact CG-CD2 3.85Å; G593-L595 PolarHBondContact O-N 2.94Å; G593-L595 VanDerWaalsContact O-N 3.15Å; L595-S600 VanDerWaalsContact C-OG 3.32Å; L595-S600 WeakPolarHBondContact CA-OG 3.38Å; L595-S600 WeakPolarHBondContact CB-OG 3.47Å; L595-S600 WeakPolarHBondContact CD2-OG 3.3Å; L595-S600 WeakPolarHBondContact O-CB 3.45Å; L595-S600 PolarHBondContact O-N 3.35Å; L595-S600 PolarHBondContact O-OG 2.97Å; L595-I601 HydrophobicContact CB-CD1 4.32Å; L595-I601 HydrophobicContact CB-CG1 4.01Å; L595-M806 HydrophobicContact CD1-CB 4.21Å; L595-M806 HydrophobicContact CD1-CG 4.3Å; L595-M806 HydrophobicContact CD1-SD 4.1Å
596	Q	90.3	Very high	86.4	Confident	81 Å²	81	41.8 Å²	41.8	38%	0.379	21%	0.206	S	C	.	.	H	α-helix	trans	-71.1	-44.3	174.2	-175.5	173.7	14.9	0	0	110.9	G593 M598 D599 I601 S807	G593-Q596 WeakPolarHBondContact O-CA 3.35Å; G593-Q596 WeakPolarHBondContact O-CB 3.16Å; G593-Q596 PolarHBondContact O-N 3.3Å; Q596-M598 PolarHBondContact O-N 2.9Å; Q596-D599 PolarHBondContact O-N 3.5Å; Q596-I601 HydrophobicContact CB-CD1 3.77Å; Q596-I601 HydrophobicContact CG-CD1 4.49Å; Q596-S807 PolarHBondContact OE1-O 3.47Å
597	A	89.5	Confident	86.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.3	-35.3	178.7	0	0	0	0	0	111.7	G583 N587 Q592 G593 I594 D599	G583-A597 WeakPolarHBondContact CA-O 3.31Å; N587-A597 HydrophobicContact CB-CB 3.69Å; N587-A597 PolarHBondContact ND2-O 2.9Å; Q592-A597 HydrophobicContact CB-CB 4.28Å; G593-A597 PolarHBondContact O-N 2.9Å; I594-A597 PolarHBondContact O-N 3.48Å; A597-D599 VanDerWaalsContact C-N 3.34Å
598	M	88.9	Confident	85.5	Confident	26 Å²	26	42.3 Å²	42.3	13%	0.128	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	6.2	178.2	-70.9	-179	173.8	0	0	115	I577 R578 S579 I584 I594 Q596 S600	I577-M598 HydrophobicContact CD1-SD 4.02Å; I577-M598 HydrophobicContact CG1-CB 4.44Å; I577-M598 HydrophobicContact CG1-SD 4.13Å; I577-M598 HydrophobicContact CG2-CB 4.1Å; I577-M598 HydrophobicContact CG2-CG 4.33Å; I577-M598 HydrophobicContact CG2-SD 4.12Å; R578-M598 PolarHBondContact N-O 3.28Å; R578-M598 VanDerWaalsContact N-O 3.07Å; S579-M598 PolarHBondContact N-O 2.89Å; I584-M598 HydrophobicContact CD1-CE 4.12Å; I584-M598 HydrophobicContact CG1-CE 4.14Å; I594-M598 HydrophobicContact CD1-CE 3.53Å; I594-M598 HydrophobicContact CD1-CG 4.43Å; I594-M598 HydrophobicContact CD1-SD 4.13Å; I594-M598 HydrophobicContact CG1-CE 4.04Å; I594-M598 HydrophobicContact CG1-SD 4.13Å; I594-M598 WeakPolarHBondContact O-CB 3.3Å; I594-M598 WeakPolarHBondContact O-CG 3.39Å; I594-M598 PolarHBondContact O-N 3.36Å; Q596-M598 PolarHBondContact O-N 2.9Å; M598-S600 PolarHBondContact O-N 3.47Å
599	D	85.2	Confident	84.6	Confident	44 Å²	44	45.3 Å²	45.3	24%	0.235	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	36.3	-174.8	-166.9	29.2	0	0	0	113.3	R542 R578 Q596 A597 R602	R542-D599 IonicContact NH1-OD2 3.84Å; R542-D599 PolarHBondContact NH1-OD2 3.36Å; R578-D599 HydrophobicContact CB-CB 4.43Å; Q596-D599 PolarHBondContact O-N 3.5Å; A597-D599 VanDerWaalsContact C-N 3.34Å; D599-R602 IonicContact OD1-NH2 3.86Å; D599-R602 IonicContact OD2-CZ 2.63Å; D599-R602 IonicContact OD2-NH1 3.2Å; D599-R602 IonicContact OD2-NH2 2.68Å; D599-R602 PolarHBondContact OD2-NH2 3.28Å
600	S	85.9	Confident	83.9	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.007	22%	0.222	C	C	.	.			trans	-96.3	-8.5	-172.1	75.8	0	0	0	0	114.6	H576 L595 M598	H576-S600 VanDerWaalsContact O-CA 3.3Å; H576-S600 WeakPolarHBondContact O-CA 3.37Å; H576-S600 WeakPolarHBondContact O-CB 3.46Å; L595-S600 VanDerWaalsContact C-OG 3.32Å; L595-S600 WeakPolarHBondContact CA-OG 3.38Å; L595-S600 WeakPolarHBondContact CB-OG 3.47Å; L595-S600 WeakPolarHBondContact CD2-OG 3.3Å; L595-S600 WeakPolarHBondContact O-CB 3.45Å; L595-S600 PolarHBondContact O-N 3.35Å; L595-S600 PolarHBondContact O-OG 2.97Å; M598-S600 PolarHBondContact O-N 3.47Å
601	I	84.7	Confident	83.2	Confident	27 Å²	27	41.5 Å²	41.5	14%	0.138	22%	0.215	C	C	.	.	S	Bend	trans	-80.7	-32.1	179.5	-60.6	174.9	0	0	0	111.7	L595 Q596 D603 F604 M606 P803 M806 S807	L595-I601 HydrophobicContact CB-CD1 4.32Å; L595-I601 HydrophobicContact CB-CG1 4.01Å; Q596-I601 HydrophobicContact CB-CD1 3.77Å; Q596-I601 HydrophobicContact CG-CD1 4.49Å; I601-D603 VanDerWaalsContact C-N 3.32Å; I601-D603 PolarHBondContact O-N 3.19Å; I601-F604 PolarHBondContact O-N 2.88Å; I601-M606 HydrophobicContact CG2-CE 3.99Å; I601-P803 HydrophobicContact CG2-CB 3.97Å; I601-M806 HydrophobicContact CD1-CB 3.83Å; I601-M806 HydrophobicContact CG1-CB 3.99Å; I601-S807 VanDerWaalsContact CD1-CA 3.47Å
602	R	77.5	Confident	82.6	Confident	62 Å²	62	42.9 Å²	42.9	23%	0.234	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-44.2	-170.1	-176	-173.9	61.8	-131.9	-63.3	113	I535 R578 D599	I535-R602 HydrophobicContact CD1-CG 4Å; R578-R602 VanDerWaalsContact CZ-CZ 3.47Å; D599-R602 IonicContact OD1-NH2 3.86Å; D599-R602 IonicContact OD2-CZ 2.63Å; D599-R602 IonicContact OD2-NH1 3.2Å; D599-R602 IonicContact OD2-NH2 2.68Å; D599-R602 PolarHBondContact OD2-NH2 3.28Å
603	D	72.9	Confident	82.2	Confident	63 Å²	63	47.7 Å²	47.7	34%	0.337	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	9.6	-174.6	-40.1	-41.8	0	0	0	111.8	H576 R578 I601 D605	H576-D603 IonicContact ND1-OD2 2.74Å; R578-D603 IonicContact CZ-OD2 3.58Å; R578-D603 IonicContact NE-OD2 3.88Å; R578-D603 PolarHBondContact NE-OD2 3.48Å; R578-D603 IonicContact NH2-OD1 3.89Å; R578-D603 IonicContact NH2-OD2 3.21Å; R578-D603 PolarHBondContact NH2-OD2 2.87Å; I601-D603 VanDerWaalsContact C-N 3.32Å; I601-D603 PolarHBondContact O-N 3.19Å; D603-D605 PolarHBondContact O-N 2.94Å
604	F	80.1	Confident	81.5	Confident	20 Å²	20	49.3 Å²	49.3	9%	0.088	26%	0.258	C	S	.	.			trans	-71.9	120.3	178.9	-173.7	-89	0	0	0	109.1	P573 P575 I601 M606 L609 M806	P573-F604 HydrophobicContact CB-CE2 4.25Å; P573-F604 HydrophobicContact CB-CZ 4.44Å; P573-F604 HydrophobicContact CG-CE2 4.25Å; P573-F604 HydrophobicContact CG-CZ 3.94Å; P575-F604 HydrophobicContact CB-CD2 3.85Å; P575-F604 HydrophobicContact CB-CE2 4.37Å; I601-F604 PolarHBondContact O-N 2.88Å; F604-M606 VanDerWaalsContact C-N 3.31Å; F604-M606 HydrophobicContact CB-CE 4.23Å; F604-M606 HydrophobicContact CD1-CE 3.67Å; F604-M606 HydrophobicContact CD1-CG 3.97Å; F604-M606 HydrophobicContact CD1-SD 3.58Å; F604-M606 VanDerWaalsContact CD1-SD 3.58Å; F604-M606 HydrophobicContact CE1-SD 4Å; F604-M606 HydrophobicContact CG-CE 4.27Å; F604-M606 PolarHBondContact O-N 2.73Å; F604-L609 HydrophobicContact CE1-CD1 3.77Å; F604-L609 HydrophobicContact CE1-CD2 4.25Å; F604-L609 HydrophobicContact CE1-CG 3.89Å; F604-L609 HydrophobicContact CZ-CD1 4.42Å; F604-L609 HydrophobicContact CZ-CD2 4.17Å; F604-L609 HydrophobicContact CZ-CG 4.3Å; F604-M806 HydrophobicContact CD1-CE 3.6Å; F604-M806 HydrophobicContact CD1-SD 3.99Å; F604-M806 HydrophobicContact CD2-CE 4.45Å; F604-M806 HydrophobicContact CE1-CE 3.27Å; F604-M806 HydrophobicContact CE1-SD 4.25Å; F604-M806 HydrophobicContact CE2-CE 4.17Å; F604-M806 HydrophobicContact CG-CE 4.19Å; F604-M806 HydrophobicContact CG-SD 4.14Å; F604-M806 HydrophobicContact CZ-CE 3.58Å
605	D	79.2	Confident	81	Confident	83 Å²	83	48.8 Å²	48.8	44%	0.444	26%	0.256	S	S	.	.			trans	-73.3	88.3	176	-174.6	3.2	0	0	0	110.2	D603 T607 T608	D603-D605 PolarHBondContact O-N 2.94Å; D605-T607 VanDerWaalsContact CG-OG1 3.29Å; D605-T607 PolarHBondContact O-N 2.96Å; D605-T607 VanDerWaalsContact O-N 3.17Å; D605-T607 WeakPolarHBondContact OD1-CB 3.35Å; D605-T607 PolarHBondContact OD1-N 3.08Å; D605-T607 VanDerWaalsContact OD1-N 3.08Å; D605-T607 PolarHBondContact OD1-OG1 2.99Å; D605-T607 PolarHBondContact OD2-OG1 2.66Å; D605-T608 HydrophobicContact CB-CG2 4.06Å; D605-T608 PolarHBondContact O-N 3.43Å; D605-T608 PolarHBondContact O-OG1 2.78Å; D605-T608 WeakPolarHBondContact OD2-CG2 3.39Å
606	M	81.3	Confident	80.8	Confident	8 Å²	8	50.5 Å²	50.5	4%	0.039	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-60.2	-23.4	179	-67.7	-73	170.1	0	0	112.4	I601 F604 T608 L609 I798 L799 P803 M806	I601-M606 HydrophobicContact CG2-CE 3.99Å; F604-M606 VanDerWaalsContact C-N 3.31Å; F604-M606 HydrophobicContact CB-CE 4.23Å; F604-M606 HydrophobicContact CD1-CE 3.67Å; F604-M606 HydrophobicContact CD1-CG 3.97Å; F604-M606 HydrophobicContact CD1-SD 3.58Å; F604-M606 VanDerWaalsContact CD1-SD 3.58Å; F604-M606 HydrophobicContact CE1-SD 4Å; F604-M606 HydrophobicContact CG-CE 4.27Å; F604-M606 PolarHBondContact O-N 2.73Å; M606-T608 PolarHBondContact O-N 2.89Å; M606-L609 WeakPolarHBondContact O-CB 3.38Å; M606-L609 PolarHBondContact O-N 3.14Å; M606-L609 VanDerWaalsContact O-N 3.09Å; M606-L609 HydrophobicContact SD-CD1 4.01Å; M606-I798 HydrophobicContact CB-CG2 4.25Å; M606-I798 WeakPolarHBondContact O-CG2 3.33Å; M606-L799 HydrophobicContact CB-CD2 3.9Å; M606-P803 HydrophobicContact CE-CB 4.19Å; M606-P803 HydrophobicContact CE-CG 3.9Å; M606-P803 HydrophobicContact CG-CG 4.2Å; M606-P803 HydrophobicContact SD-CG 4.38Å; M606-M806 HydrophobicContact CE-CB 4.4Å; M606-M806 HydrophobicContact CE-CE 3.93Å; M606-M806 HydrophobicContact CE-CG 3.97Å; M606-M806 HydrophobicContact CE-SD 3.4Å; M606-M806 WeakPolarHBondContact CE-SD 3.43Å; M606-M806 HydrophobicContact SD-CE 3.89Å; M606-M806 HydrophobicContact SD-SD 4.17Å
607	T	76.7	Confident	80.5	Confident	50 Å²	50	54.7 Å²	54.7	31%	0.307	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-64.9	-28.6	-178.6	71.1	0	0	0	0	112.2	D605 L609 N610 E795 L799	D605-T607 VanDerWaalsContact CG-OG1 3.29Å; D605-T607 PolarHBondContact O-N 2.96Å; D605-T607 VanDerWaalsContact O-N 3.17Å; D605-T607 WeakPolarHBondContact OD1-CB 3.35Å; D605-T607 PolarHBondContact OD1-N 3.08Å; D605-T607 VanDerWaalsContact OD1-N 3.08Å; D605-T607 PolarHBondContact OD1-OG1 2.99Å; D605-T607 PolarHBondContact OD2-OG1 2.66Å; T607-L609 PolarHBondContact O-N 2.95Å; T607-N610 WeakPolarHBondContact O-CB 3.28Å; T607-N610 PolarHBondContact O-N 3.24Å; T607-E795 HydrophobicContact CG2-CG 4.22Å; T607-E795 VanDerWaalsContact CG2-OE1 3.28Å; T607-E795 WeakPolarHBondContact CG2-OE1 3.38Å; T607-L799 HydrophobicContact CG2-CD2 4.02Å
608	T	74.2	Confident	80.2	Confident	67 Å²	67	57.4 Å²	57.4	41%	0.411	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-65.3	-17.1	175.7	62.7	0	0	0	0	114.1	P573 D605 M606 N610	P573-T608 HydrophobicContact CG-CG2 4.13Å; P573-T608 WeakPolarHBondContact CG-OG1 3.03Å; D605-T608 HydrophobicContact CB-CG2 4.06Å; D605-T608 PolarHBondContact O-N 3.43Å; D605-T608 PolarHBondContact O-OG1 2.78Å; D605-T608 WeakPolarHBondContact OD2-CG2 3.39Å; M606-T608 PolarHBondContact O-N 2.89Å; T608-N610 PolarHBondContact O-N 3.46Å
609	L	74.7	Confident	80.2	Confident	64 Å²	64	56.4 Å²	56.4	34%	0.335	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-80.1	-5.7	174.7	-61	176.8	0	0	0	112.6	F604 M606 T607 D611 I798 M806	F604-L609 HydrophobicContact CE1-CD1 3.77Å; F604-L609 HydrophobicContact CE1-CD2 4.25Å; F604-L609 HydrophobicContact CE1-CG 3.89Å; F604-L609 HydrophobicContact CZ-CD1 4.42Å; F604-L609 HydrophobicContact CZ-CD2 4.17Å; F604-L609 HydrophobicContact CZ-CG 4.3Å; M606-L609 WeakPolarHBondContact O-CB 3.38Å; M606-L609 PolarHBondContact O-N 3.14Å; M606-L609 VanDerWaalsContact O-N 3.09Å; M606-L609 HydrophobicContact SD-CD1 4.01Å; T607-L609 PolarHBondContact O-N 2.95Å; L609-D611 PolarHBondContact O-N 3.48Å; L609-D611 VanDerWaalsContact O-N 3.14Å; L609-I798 HydrophobicContact CB-CG2 4.13Å; L609-M806 HydrophobicContact CD1-CE 3.66Å
610	N	74.4	Confident	80.4	Confident	39 Å²	39	58.1 Å²	58.1	21%	0.209	29%	0.294	C	S	.	.			trans	-70.8	107.7	174.1	-166.3	9.3	0	0	0	109.3	T607 T608 P612 P791 I798	T607-N610 WeakPolarHBondContact O-CB 3.28Å; T607-N610 PolarHBondContact O-N 3.24Å; T608-N610 PolarHBondContact O-N 3.46Å; N610-P612 VanDerWaalsContact O-CD 3.24Å; N610-P612 WeakPolarHBondContact O-CD 3.29Å; N610-P791 PolarHBondContact ND2-O 2.87Å; N610-I798 HydrophobicContact CB-CD1 3.73Å
611	D	74.6	Confident	80.5	Confident	69 Å²	69	60.2 Å²	60.2	37%	0.369	31%	0.305	S	S	.	.			trans	-83.9	108.6	174.6	-175.3	-7.9	0	0	0	109.5	L609 E613 M614 S615	L609-D611 PolarHBondContact O-N 3.48Å; L609-D611 VanDerWaalsContact O-N 3.14Å; D611-E613 PolarHBondContact O-N 2.96Å; D611-E613 VanDerWaalsContact OD1-CB 3.31Å; D611-E613 WeakPolarHBondContact OD1-CB 3.33Å; D611-E613 PolarHBondContact OD1-N 3.24Å; D611-M614 HydrophobicContact CB-CB 4.16Å; D611-M614 HydrophobicContact CB-CG 4.17Å; D611-M614 PolarHBondContact O-N 3.24Å; D611-M614 WeakPolarHBondContact OD2-CG 3.41Å; D611-S615 PolarHBondContact O-N 2.95Å
612	P	79.9	Confident	80.7	Confident	88 Å²	88	59.2 Å²	59.2	57%	0.571	30%	0.301	S	S	*	.	H	α-helix	trans	-64.1	-30.1	179.7	27.5	-34.2	0	0	0	112	N610 M614 S615 D616	N610-P612 VanDerWaalsContact O-CD 3.24Å; N610-P612 WeakPolarHBondContact O-CD 3.29Å; P612-M614 VanDerWaalsContact C-N 3.34Å; P612-M614 PolarHBondContact O-N 3.32Å; P612-S615 PolarHBondContact O-N 3.45Å; P612-D616 WeakPolarHBondContact O-CB 3.41Å; P612-D616 PolarHBondContact O-N 2.73Å
613	E	81.8	Confident	81.3	Confident	151 Å²	151	58.1 Å²	58.1	71%	0.706	30%	0.298	S	S	*	.	H	α-helix	trans	-65.7	-40.4	-179.6	-169.3	-178	167.4	0	0	110.9	D611 D616 R617	D611-E613 PolarHBondContact O-N 2.96Å; D611-E613 VanDerWaalsContact OD1-CB 3.31Å; D611-E613 WeakPolarHBondContact OD1-CB 3.33Å; D611-E613 PolarHBondContact OD1-N 3.24Å; E613-D616 PolarHBondContact O-N 3.23Å; E613-R617 WeakPolarHBondContact O-CB 3.42Å; E613-R617 PolarHBondContact O-N 3.43Å
614	M	77.9	Confident	82.1	Confident	35 Å²	35	59.5 Å²	59.5	17%	0.172	31%	0.305	C	S	.	.	H	α-helix	trans	-65.6	-46.4	175	-76.8	-69.9	-67.6	0	0	111.7	S399 M403 D611 P612 D616 R617 F618	S399-M614 VanDerWaalsContact OG-CE 3.27Å; S399-M614 WeakPolarHBondContact OG-CE 3.43Å; M403-M614 HydrophobicContact SD-CE 4.29Å; D611-M614 HydrophobicContact CB-CB 4.16Å; D611-M614 HydrophobicContact CB-CG 4.17Å; D611-M614 PolarHBondContact O-N 3.24Å; D611-M614 WeakPolarHBondContact OD2-CG 3.41Å; P612-M614 VanDerWaalsContact C-N 3.34Å; P612-M614 PolarHBondContact O-N 3.32Å; M614-D616 VanDerWaalsContact C-N 3.33Å; M614-D616 PolarHBondContact O-N 2.98Å; M614-R617 PolarHBondContact O-N 2.95Å; M614-F618 HydrophobicContact CE-CE2 3.75Å; M614-F618 HydrophobicContact CE-CZ 4Å; M614-F618 WeakPolarHBondContact O-CD2 3.39Å; M614-F618 PolarHBondContact O-N 2.97Å
615	S	82.4	Confident	82.5	Confident	10 Å²	10	58.6 Å²	58.6	7%	0.07	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-45.9	175.8	-69	0	0	0	0	111.3	D611 P612 R617 F618 I619	D611-S615 PolarHBondContact O-N 2.95Å; P612-S615 PolarHBondContact O-N 3.45Å; S615-R617 PolarHBondContact O-N 3.42Å; S615-F618 PolarHBondContact O-N 3.49Å; S615-I619 WeakPolarHBondContact O-CB 3.31Å; S615-I619 WeakPolarHBondContact O-CD1 3.3Å; S615-I619 WeakPolarHBondContact O-CG1 3.37Å; S615-I619 PolarHBondContact O-N 3.38Å
616	D	85.6	Confident	82.9	Confident	73 Å²	73	55.1 Å²	55.1	39%	0.39	28%	0.283	S	S	.	.	H	α-helix	trans	-63.3	-39.7	177.7	-80.3	-21.8	0	0	0	112.2	P612 E613 M614 I619 N620	P612-D616 WeakPolarHBondContact O-CB 3.41Å; P612-D616 PolarHBondContact O-N 2.73Å; E613-D616 PolarHBondContact O-N 3.23Å; M614-D616 VanDerWaalsContact C-N 3.33Å; M614-D616 PolarHBondContact O-N 2.98Å; D616-I619 PolarHBondContact O-N 2.94Å; D616-N620 WeakPolarHBondContact O-CB 3.23Å; D616-N620 PolarHBondContact O-N 3.03Å; D616-N620 PolarHBondContact O-ND2 2.89Å; D616-N620 VanDerWaalsContact O-ND2 3.11Å
617	R	83.3	Confident	83.3	Confident	169 Å²	169	55.9 Å²	55.9	64%	0.638	29%	0.287	S	S	*	.	H	α-helix	trans	-60.8	-45.6	174.4	-177	179.6	172.4	-168.3	-4.2	111.5	E613 M614 S615 N620 L621	E613-R617 WeakPolarHBondContact O-CB 3.42Å; E613-R617 PolarHBondContact O-N 3.43Å; M614-R617 PolarHBondContact O-N 2.95Å; S615-R617 PolarHBondContact O-N 3.42Å; R617-N620 PolarHBondContact O-N 2.92Å; R617-L621 VanDerWaalsContact O-CB 3.32Å; R617-L621 WeakPolarHBondContact O-CB 3.36Å; R617-L621 PolarHBondContact O-N 2.9Å
618	F	83	Confident	83.8	Confident	57 Å²	57	56.5 Å²	56.5	25%	0.25	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-43.3	176.5	-74.6	-56.2	0	0	0	112	I394 M614 S615 G622	I394-F618 HydrophobicContact CG2-CD1 3.36Å; I394-F618 HydrophobicContact CG2-CE1 3.28Å; M614-F618 HydrophobicContact CE-CE2 3.75Å; M614-F618 HydrophobicContact CE-CZ 4Å; M614-F618 WeakPolarHBondContact O-CD2 3.39Å; M614-F618 PolarHBondContact O-N 2.97Å; S615-F618 PolarHBondContact O-N 3.49Å; F618-G622 PolarHBondContact O-N 2.83Å
619	I	88.7	Confident	84.4	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-48.6	177.5	-70	163.1	0	0	0	110.7	S615 D616 G622 K623 F782 K787 T790 P791	S615-I619 WeakPolarHBondContact O-CB 3.31Å; S615-I619 WeakPolarHBondContact O-CD1 3.3Å; S615-I619 WeakPolarHBondContact O-CG1 3.37Å; S615-I619 PolarHBondContact O-N 3.38Å; D616-I619 PolarHBondContact O-N 2.94Å; I619-G622 PolarHBondContact O-N 3.29Å; I619-K623 WeakPolarHBondContact O-CB 3.47Å; I619-K623 PolarHBondContact O-N 3.34Å; I619-F782 HydrophobicContact CG2-CE1 3.89Å; I619-K787 HydrophobicContact CD1-CG 4.26Å; I619-K787 HydrophobicContact CG2-CB 3.86Å; I619-K787 HydrophobicContact CG2-CD 4.12Å; I619-K787 HydrophobicContact CG2-CG 3.81Å; I619-T790 HydrophobicContact CD1-CG2 4.13Å; I619-T790 HydrophobicContact CG1-CG2 3.9Å; I619-P791 HydrophobicContact CD1-CG 4.46Å
620	N	90.2	Very high	85	Confident	80 Å²	80	51.9 Å²	51.9	43%	0.428	26%	0.263	S	S	.	.	H	α-helix	trans	-64.9	-43.6	-179	-70.9	-30.3	0	0	0	111.6	D616 R617 G622 K623 D624	D616-N620 WeakPolarHBondContact O-CB 3.23Å; D616-N620 PolarHBondContact O-N 3.03Å; D616-N620 PolarHBondContact O-ND2 2.89Å; D616-N620 VanDerWaalsContact O-ND2 3.11Å; R617-N620 PolarHBondContact O-N 2.92Å; N620-G622 PolarHBondContact O-N 3.26Å; N620-K623 WeakPolarHBondContact O-CB 3.43Å; N620-K623 PolarHBondContact O-N 3.47Å; N620-D624 PolarHBondContact O-N 3.33Å
621	L	87	Confident	85.6	Confident	45 Å²	45	57.4 Å²	57.4	24%	0.236	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-41.8	177.1	-173.8	61.4	0	0	0	111.8	K393 I394 R617 K623 D624 I625	K393-L621 HydrophobicContact CB-CD2 4.41Å; K393-L621 WeakPolarHBondContact O-CD2 3.38Å; I394-L621 HydrophobicContact CB-CD2 4.31Å; I394-L621 HydrophobicContact CG1-CD2 3.73Å; I394-L621 HydrophobicContact CG1-CG 4.17Å; R617-L621 VanDerWaalsContact O-CB 3.32Å; R617-L621 WeakPolarHBondContact O-CB 3.36Å; R617-L621 PolarHBondContact O-N 2.9Å; L621-K623 VanDerWaalsContact C-N 3.31Å; L621-K623 PolarHBondContact O-N 2.95Å; L621-D624 PolarHBondContact O-N 3.33Å; L621-I625 HydrophobicContact CD1-CD1 4.42Å; L621-I625 HydrophobicContact CG-CD1 4.14Å; L621-I625 VanDerWaalsContact O-CG1 3.25Å; L621-I625 WeakPolarHBondContact O-CG1 3.14Å; L621-I625 PolarHBondContact O-N 2.8Å
622	G	88.5	Confident	86	Confident	6 Å²	6	59.2 Å²	59.2	6%	0.062	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-39.6	173.8	0	0	0	0	0	112.5	F618 I619 N620 M626	F618-G622 PolarHBondContact O-N 2.83Å; I619-G622 PolarHBondContact O-N 3.29Å; N620-G622 PolarHBondContact O-N 3.26Å; G622-M626 WeakPolarHBondContact O-CB 3.48Å; G622-M626 PolarHBondContact O-N 3.29Å
623	K	90.1	Very high	86.1	Confident	38 Å²	38	55.8 Å²	55.8	17%	0.165	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-45.3	175.5	-170.9	173.1	-173.3	160.2	0	111.9	I619 N620 L621 M626 I627 F782 D783	I619-K623 WeakPolarHBondContact O-CB 3.47Å; I619-K623 PolarHBondContact O-N 3.34Å; N620-K623 WeakPolarHBondContact O-CB 3.43Å; N620-K623 PolarHBondContact O-N 3.47Å; L621-K623 VanDerWaalsContact C-N 3.31Å; L621-K623 PolarHBondContact O-N 2.95Å; K623-M626 HydrophobicContact CG-CE 4.29Å; K623-M626 WeakPolarHBondContact O-CB 3.5Å; K623-M626 PolarHBondContact O-N 3.45Å; K623-I627 HydrophobicContact CG-CD1 4.09Å; K623-I627 VanDerWaalsContact O-CG1 3.25Å; K623-I627 WeakPolarHBondContact O-CG1 3.4Å; K623-I627 PolarHBondContact O-N 3.12Å; K623-F782 HydrophobicContact CB-CD1 4.19Å; K623-F782 HydrophobicContact CB-CE1 3.79Å; K623-F782 HydrophobicContact CB-CZ 4.14Å; K623-F782 HydrophobicContact CD-CD1 4.37Å; K623-F782 HydrophobicContact CG-CD1 4.25Å; K623-F782 HydrophobicContact CG-CE1 4.34Å; K623-D783 VanDerWaalsContact NZ-CG 3.26Å; K623-D783 IonicContact NZ-OD1 2.94Å; K623-D783 PolarHBondContact NZ-OD1 3.28Å; K623-D783 IonicContact NZ-OD2 3.05Å; K623-D783 PolarHBondContact NZ-OD2 2.98Å
624	D	91	Very high	86	Confident	93 Å²	93	52.2 Å²	52.2	50%	0.497	26%	0.257	S	S	.	.	H	α-helix	trans	-62.6	-43.9	178	-71.7	-18.3	0	0	0	111.4	N620 L621 M626 I627 D628	N620-D624 PolarHBondContact O-N 3.33Å; L621-D624 PolarHBondContact O-N 3.33Å; D624-M626 PolarHBondContact O-N 2.85Å; D624-I627 PolarHBondContact O-N 3.29Å; D624-D628 WeakPolarHBondContact O-CB 3.41Å; D624-D628 PolarHBondContact O-N 2.85Å
625	I	87.6	Confident	86	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-42.2	177	-67.9	168.7	0	0	0	111.4	T386 L389 M390 K393 I394 L621 D628 S629	T386-I625 HydrophobicContact CG2-CG2 4.05Å; L389-I625 HydrophobicContact CD2-CG2 4.06Å; L389-I625 HydrophobicContact CG-CG2 4.37Å; M390-I625 HydrophobicContact CB-CD1 4.44Å; M390-I625 HydrophobicContact CE-CB 4.42Å; M390-I625 HydrophobicContact CE-CG2 4.05Å; M390-I625 HydrophobicContact CG-CB 4.32Å; M390-I625 HydrophobicContact CG-CD1 3.92Å; M390-I625 HydrophobicContact CG-CG2 3.7Å; K393-I625 HydrophobicContact CB-CD1 3.86Å; K393-I625 HydrophobicContact CD-CD1 3.88Å; K393-I625 HydrophobicContact CD-CG1 3.92Å; K393-I625 HydrophobicContact CG-CD1 4.44Å; I394-I625 HydrophobicContact CG1-CD1 4.47Å; L621-I625 HydrophobicContact CD1-CD1 4.42Å; L621-I625 HydrophobicContact CG-CD1 4.14Å; L621-I625 VanDerWaalsContact O-CG1 3.25Å; L621-I625 WeakPolarHBondContact O-CG1 3.14Å; L621-I625 PolarHBondContact O-N 2.8Å; I625-D628 PolarHBondContact O-N 3Å; I625-S629 WeakPolarHBondContact O-CB 3.36Å; I625-S629 PolarHBondContact O-N 3.42Å
626	M	88.4	Confident	85.9	Confident	10 Å²	10	54.1 Å²	54.1	5%	0.049	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-47.5	174.2	175.7	-155.7	69.8	0	0	111	F250 G622 K623 D624 D628 S629 L630 A778 V779 F782	F250-M626 HydrophobicContact CD1-SD 4.31Å; F250-M626 HydrophobicContact CE1-CG 3.7Å; F250-M626 HydrophobicContact CE1-SD 3.3Å; F250-M626 WeakPolarHBondContact CE1-SD 3.28Å; F250-M626 HydrophobicContact CE2-SD 4.19Å; F250-M626 HydrophobicContact CZ-CG 4.24Å; F250-M626 HydrophobicContact CZ-SD 3.22Å; F250-M626 WeakPolarHBondContact CZ-SD 3.42Å; G622-M626 WeakPolarHBondContact O-CB 3.48Å; G622-M626 PolarHBondContact O-N 3.29Å; K623-M626 HydrophobicContact CG-CE 4.29Å; K623-M626 WeakPolarHBondContact O-CB 3.5Å; K623-M626 PolarHBondContact O-N 3.45Å; D624-M626 PolarHBondContact O-N 2.85Å; M626-D628 VanDerWaalsContact C-N 3.34Å; M626-D628 PolarHBondContact O-N 3.46Å; M626-S629 PolarHBondContact O-N 2.86Å; M626-L630 HydrophobicContact CG-CD1 4.11Å; M626-L630 VanDerWaalsContact O-CG 3.31Å; M626-L630 WeakPolarHBondContact O-CG 3.24Å; M626-L630 PolarHBondContact O-N 3.43Å; M626-A778 HydrophobicContact CE-CB 4.22Å; M626-A778 HydrophobicContact SD-CB 4.11Å; M626-V779 HydrophobicContact CE-CG2 3.88Å; M626-F782 HydrophobicContact CE-CB 4.31Å; M626-F782 HydrophobicContact SD-CB 3.94Å; M626-F782 HydrophobicContact SD-CD2 3.81Å; M626-F782 HydrophobicContact SD-CG 4.14Å
627	I	89.6	Confident	85.6	Confident	24 Å²	24	55.3 Å²	55.3	12%	0.123	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-46.9	178.6	-70.7	167.4	0	0	0	110.5	K623 D624 L630 R631 I775 V779	K623-I627 HydrophobicContact CG-CD1 4.09Å; K623-I627 VanDerWaalsContact O-CG1 3.25Å; K623-I627 WeakPolarHBondContact O-CG1 3.4Å; K623-I627 PolarHBondContact O-N 3.12Å; D624-I627 PolarHBondContact O-N 3.29Å; I627-L630 PolarHBondContact O-N 3.18Å; I627-R631 VanDerWaalsContact O-CG 3.3Å; I627-R631 WeakPolarHBondContact O-CG 3.28Å; I627-R631 PolarHBondContact O-N 3.37Å; I627-I775 HydrophobicContact CG1-CG2 4.14Å; I627-I775 HydrophobicContact CG2-CD1 4.38Å; I627-I775 HydrophobicContact CG2-CG2 4.39Å; I627-V779 HydrophobicContact CD1-CG2 4.07Å; I627-V779 HydrophobicContact CG1-CG2 4.18Å
628	D	88.1	Confident	85.1	Confident	63 Å²	63	47.8 Å²	47.8	34%	0.337	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-44.2	177.8	-77.3	-13.2	0	0	0	111.4	D624 I625 M626 L630 R631 T632	D624-D628 WeakPolarHBondContact O-CB 3.41Å; D624-D628 PolarHBondContact O-N 2.85Å; I625-D628 PolarHBondContact O-N 3Å; M626-D628 VanDerWaalsContact C-N 3.34Å; M626-D628 PolarHBondContact O-N 3.46Å; D628-L630 PolarHBondContact O-N 3.02Å; D628-R631 WeakPolarHBondContact O-CB 3.3Å; D628-R631 PolarHBondContact O-N 3.34Å; D628-R631 IonicContact OD1-NH1 2.74Å; D628-T632 WeakPolarHBondContact O-CG2 3.42Å; D628-T632 PolarHBondContact O-N 2.7Å; D628-T632 VanDerWaalsContact O-N 3.09Å
629	S	86.2	Confident	84.9	Confident	23 Å²	23	45.7 Å²	45.7	16%	0.161	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-51.4	175.8	-170.9	0	0	0	0	110.7	T386 I625 M626 R631 T632 I633	T386-S629 PolarHBondContact OG1-OG 2.9Å; I625-S629 WeakPolarHBondContact O-CB 3.36Å; I625-S629 PolarHBondContact O-N 3.42Å; M626-S629 PolarHBondContact O-N 2.86Å; S629-R631 VanDerWaalsContact C-N 3.31Å; S629-R631 PolarHBondContact O-N 3.04Å; S629-T632 PolarHBondContact O-N 3.46Å; S629-T632 PolarHBondContact O-OG1 2.76Å; S629-I633 VanDerWaalsContact O-CG1 3.3Å; S629-I633 WeakPolarHBondContact O-CG1 3.29Å; S629-I633 PolarHBondContact O-N 3.36Å
630	L	87.1	Confident	84.4	Confident	11 Å²	11	47 Å²	47	6%	0.058	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-32.7	179	-65.6	174.6	0	0	0	114	L254 M626 I627 D628 T632 I633 L774 I775 A778	L254-L630 HydrophobicContact CD2-CD2 3.92Å; M626-L630 HydrophobicContact CG-CD1 4.11Å; M626-L630 VanDerWaalsContact O-CG 3.31Å; M626-L630 WeakPolarHBondContact O-CG 3.24Å; M626-L630 PolarHBondContact O-N 3.43Å; I627-L630 PolarHBondContact O-N 3.18Å; D628-L630 PolarHBondContact O-N 3.02Å; L630-T632 VanDerWaalsContact C-N 3.35Å; L630-I633 HydrophobicContact CD2-CD1 3.83Å; L630-L774 HydrophobicContact CB-CD2 4.45Å; L630-L774 HydrophobicContact CD2-CD2 4.2Å; L630-L774 HydrophobicContact CD2-CG 4.49Å; L630-I775 HydrophobicContact CB-CG1 4.35Å; L630-A778 HydrophobicContact CD1-CB 3.28Å
631	R	86.4	Confident	83.8	Confident	155 Å²	155	50.1 Å²	50.1	59%	0.585	25%	0.252	S	S	*	.	H	α-helix	trans	-66.1	-37.7	173.9	-76.5	173.5	176.4	170.3	-1.2	112.1	I627 D628 S629 I633 I775	I627-R631 VanDerWaalsContact O-CG 3.3Å; I627-R631 WeakPolarHBondContact O-CG 3.28Å; I627-R631 PolarHBondContact O-N 3.37Å; D628-R631 WeakPolarHBondContact O-CB 3.3Å; D628-R631 PolarHBondContact O-N 3.34Å; D628-R631 IonicContact OD1-NH1 2.74Å; S629-R631 VanDerWaalsContact C-N 3.31Å; S629-R631 PolarHBondContact O-N 3.04Å; R631-I633 VanDerWaalsContact C-N 3.33Å; R631-I775 HydrophobicContact CG-CD1 3.74Å
632	T	84	Confident	83.2	Confident	106 Å²	106	53.4 Å²	53.4	65%	0.65	27%	0.266	S	S	*	.	H	α-helix	trans	-77.5	-16.3	-178.9	62.6	0	0	0	0	114	D628 S629 L630 N634	D628-T632 WeakPolarHBondContact O-CG2 3.42Å; D628-T632 PolarHBondContact O-N 2.7Å; D628-T632 VanDerWaalsContact O-N 3.09Å; S629-T632 PolarHBondContact O-N 3.46Å; S629-T632 PolarHBondContact O-OG1 2.76Å; L630-T632 VanDerWaalsContact C-N 3.35Å; T632-N634 PolarHBondContact O-N 2.89Å; T632-N634 VanDerWaalsContact O-N 3.14Å
633	I	81.6	Confident	82.6	Confident	16 Å²	16	53.7 Å²	53.7	8%	0.082	27%	0.267	C	S	.	.			trans	-62.7	118.2	-178.4	-58.2	-171.9	0	0	0	110.6	S629 L630 R631 M638 M768 K771	S629-I633 VanDerWaalsContact O-CG1 3.3Å; S629-I633 WeakPolarHBondContact O-CG1 3.29Å; S629-I633 PolarHBondContact O-N 3.36Å; L630-I633 HydrophobicContact CD2-CD1 3.83Å; R631-I633 VanDerWaalsContact C-N 3.33Å; I633-M638 HydrophobicContact CD1-CE 4.44Å; I633-M638 HydrophobicContact CG2-CE 3.67Å; I633-M638 HydrophobicContact CG2-SD 4.01Å; I633-M768 HydrophobicContact CG2-CE 3.38Å; I633-K771 WeakPolarHBondContact O-CE 3.41Å; I633-K771 PolarHBondContact O-NZ 3.41Å
634	N	80.3	Confident	81.8	Confident	76 Å²	76	54.5 Å²	54.5	41%	0.406	27%	0.273	S	S	.	.			trans	-94.4	118.3	168.3	-170.4	-3.4	0	0	0	110.3	T632 D636 E637 M638	T632-N634 PolarHBondContact O-N 2.89Å; T632-N634 VanDerWaalsContact O-N 3.14Å; N634-D636 VanDerWaalsContact C-N 3.34Å; N634-D636 PolarHBondContact OD1-N 3.21Å; N634-D636 VanDerWaalsContact OD1-N 3.12Å; N634-E637 HydrophobicContact CB-CB 3.94Å; N634-E637 PolarHBondContact O-N 3.39Å; N634-M638 PolarHBondContact O-N 2.95Å
635	V	77.5	Confident	81	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-67.8	-38.3	-179	-176.5	0	0	0	0	111.4	E637 M638 F639 K765 M768 N769	V635-E637 PolarHBondContact O-N 2.93Å; V635-M638 PolarHBondContact O-N 2.99Å; V635-F639 PolarHBondContact O-N 2.67Å; V635-K765 HydrophobicContact CG1-CB 4.03Å; V635-K765 HydrophobicContact CG1-CG 3.6Å; V635-M768 HydrophobicContact CB-CB 4.46Å; V635-M768 HydrophobicContact CG1-CB 4.41Å; V635-M768 HydrophobicContact CG2-CB 3.24Å; V635-M768 HydrophobicContact CG2-CE 4.21Å; V635-M768 HydrophobicContact CG2-CG 4.39Å; V635-M768 HydrophobicContact CG2-SD 4.4Å; V635-N769 WeakPolarHBondContact CG2-OD1 3.26Å
636	D	80.1	Confident	80.4	Confident	86 Å²	86	56.6 Å²	56.6	46%	0.46	28%	0.28	S	S	.	.	H	α-helix	trans	-70.4	-19.7	-179.5	-65.2	-33.5	0	0	0	111.7	N634 P640	N634-D636 VanDerWaalsContact C-N 3.34Å; N634-D636 PolarHBondContact OD1-N 3.21Å; N634-D636 VanDerWaalsContact OD1-N 3.12Å; D636-P640 WeakPolarHBondContact O-CA 3.48Å
637	E	78.9	Confident	79.7	Confident	98 Å²	98	56.3 Å²	56.3	46%	0.458	28%	0.279	S	S	.	.	H	α-helix	trans	-81.3	-40	172.9	-162.5	-176.7	169.3	0	0	111.3	L378 N634 V635	L378-E637 HydrophobicContact CD2-CB 4.03Å; L378-E637 HydrophobicContact CD2-CG 3.69Å; N634-E637 HydrophobicContact CB-CB 3.94Å; N634-E637 PolarHBondContact O-N 3.39Å; V635-E637 PolarHBondContact O-N 2.93Å
638	M	74	Confident	78.9	Confident	11 Å²	11	57.2 Å²	57.2	5%	0.054	29%	0.29	C	S	.	.	H	α-helix	trans	-69.2	-37.5	175.6	-77.9	-173.3	-179.3	0	0	113.1	G375 L378 I633 N634 V635 M768	G375-M638 WeakPolarHBondContact CA-O 3.19Å; L378-M638 HydrophobicContact CD2-CB 4.43Å; L378-M638 HydrophobicContact CD2-CG 3.73Å; L378-M638 HydrophobicContact CG-CG 4.34Å; I633-M638 HydrophobicContact CD1-CE 4.44Å; I633-M638 HydrophobicContact CG2-CE 3.67Å; I633-M638 HydrophobicContact CG2-SD 4.01Å; N634-M638 PolarHBondContact O-N 2.95Å; V635-M638 PolarHBondContact O-N 2.99Å; M638-M768 HydrophobicContact SD-CE 3.75Å
639	F	78.3	Confident	78.2	Confident	13 Å²	13	55.9 Å²	55.9	6%	0.057	28%	0.282	C	S	.	.	S	Bend	trans	-134	74.4	-175.6	-56.4	-70.6	0	0	0	110	F264 V635 L761 L764 K765	F264-F639 HydrophobicContact CE1-CE1 4.2Å; F264-F639 HydrophobicContact CE1-CZ 4.14Å; V635-F639 PolarHBondContact O-N 2.67Å; F639-L761 HydrophobicContact CD1-CD2 3.52Å; F639-L761 HydrophobicContact CD2-CD2 4.38Å; F639-L761 HydrophobicContact CE1-CD2 3.55Å; F639-L761 HydrophobicContact CE2-CD2 4.41Å; F639-L761 HydrophobicContact CG-CD2 3.95Å; F639-L761 HydrophobicContact CZ-CD2 4.01Å; F639-L764 HydrophobicContact CD2-CD2 4.38Å; F639-L764 HydrophobicContact CE2-CD2 3.47Å; F639-L764 VanDerWaalsContact CE2-CD2 3.47Å; F639-L764 HydrophobicContact CE2-CG 4.42Å; F639-L764 HydrophobicContact CZ-CD2 3.7Å; F639-K765 WeakPolarHBondContact O-CE 3.26Å; F639-K765 PolarHBondContact O-NZ 3.42Å
640	P	76.7	Confident	77.5	Confident	33 Å²	33	55.3 Å²	55.3	21%	0.214	28%	0.278	C	S	.	.			trans	-60.8	159.9	-176.2	25.8	-33.8	0	0	0	111.9	D636 E642 T643	D636-P640 WeakPolarHBondContact O-CA 3.48Å; P640-E642 WeakPolarHBondContact CB-OE2 3.15Å; P640-E642 PolarHBondContact O-N 2.86Å; P640-T643 WeakPolarHBondContact CD-OG1 3.29Å; P640-T643 WeakPolarHBondContact CG-OG1 3.39Å; P640-T643 WeakPolarHBondContact O-CA 3.01Å; P640-T643 WeakPolarHBondContact O-CB 3.28Å; P640-T643 PolarHBondContact O-N 2.84Å; P640-T643 PolarHBondContact O-OG1 3.35Å
641	K	78	Confident	76.8	Confident	144 Å²	144	56.7 Å²	56.7	63%	0.626	29%	0.289	S	S	*	.	H	α-helix	trans	-61.2	-32.9	-176.9	-71.1	-177.4	179.7	177	0	111.7	T643 D644 E645	K641-T643 PolarHBondContact O-N 3.33Å; K641-D644 PolarHBondContact O-N 2.96Å; K641-E645 PolarHBondContact O-N 3.31Å; K641-E645 VanDerWaalsContact O-N 3.07Å
642	E	74.7	Confident	76.3	Confident	115 Å²	115	57.4 Å²	57.4	54%	0.537	29%	0.292	S	S	.	.	H	α-helix	trans	-56.4	-34.7	173.1	-64.2	77.7	-175.3	0	0	111.2	P640 N646	P640-E642 WeakPolarHBondContact CB-OE2 3.15Å; P640-E642 PolarHBondContact O-N 2.86Å; E642-N646 VanDerWaalsContact O-CB 3.23Å; E642-N646 WeakPolarHBondContact O-CB 3.06Å; E642-N646 PolarHBondContact O-N 3.09Å; E642-N646 PolarHBondContact O-ND2 3.28Å; E642-N646 VanDerWaalsContact O-ND2 3.15Å
643	T	75.5	Confident	75.9	Confident	12 Å²	12	52.8 Å²	52.8	7%	0.074	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-43.7	174.3	-54.2	0	0	0	0	111.2	P640 K641 E645 N646 L647	P640-T643 WeakPolarHBondContact CD-OG1 3.29Å; P640-T643 WeakPolarHBondContact CG-OG1 3.39Å; P640-T643 WeakPolarHBondContact O-CA 3.01Å; P640-T643 WeakPolarHBondContact O-CB 3.28Å; P640-T643 PolarHBondContact O-N 2.84Å; P640-T643 PolarHBondContact O-OG1 3.35Å; K641-T643 PolarHBondContact O-N 3.33Å; T643-E645 PolarHBondContact O-N 2.7Å; T643-N646 PolarHBondContact O-N 3.4Å; T643-L647 HydrophobicContact CG2-CD1 4.18Å; T643-L647 HydrophobicContact CG2-CG 4.35Å; T643-L647 WeakPolarHBondContact O-CB 3.15Å; T643-L647 WeakPolarHBondContact O-CG 3.2Å; T643-L647 PolarHBondContact O-N 3.24Å
644	D	75.1	Confident	75.7	Confident	55 Å²	55	52.7 Å²	52.7	29%	0.294	26%	0.263	S	S	.	.	H	α-helix	trans	-64.5	-41.8	178.7	-66	-24.7	0	0	0	111.5	K641 L647 A648 K765	K641-D644 PolarHBondContact O-N 2.96Å; D644-L647 PolarHBondContact O-N 2.93Å; D644-A648 WeakPolarHBondContact O-CB 3.42Å; D644-A648 PolarHBondContact O-N 3.49Å; D644-K765 VanDerWaalsContact CG-NZ 3.27Å; D644-K765 IonicContact OD1-NZ 3.73Å; D644-K765 PolarHBondContact OD1-NZ 3.34Å; D644-K765 IonicContact OD2-NZ 2.75Å; D644-K765 PolarHBondContact OD2-NZ 3.38Å
645	E	72.8	Confident	75.5	Confident	115 Å²	115	55.3 Å²	55.3	54%	0.537	28%	0.277	S	S	.	.	H	α-helix	trans	-63.6	-44.2	175.7	-68.8	-175.6	-171.8	0	0	111.8	K641 T643 A648 M649	K641-E645 PolarHBondContact O-N 3.31Å; K641-E645 VanDerWaalsContact O-N 3.07Å; T643-E645 PolarHBondContact O-N 2.7Å; E645-A648 PolarHBondContact O-N 3.33Å; E645-M649 WeakPolarHBondContact O-CB 3.03Å; E645-M649 PolarHBondContact O-N 3.41Å
646	N	74.5	Confident	75.4	Confident	23 Å²	23	56.5 Å²	56.5	12%	0.123	28%	0.282	C	S	.	.	H	α-helix	trans	-68.5	-36.5	178.8	-69.9	-21.2	0	0	0	111.8	Q363 Q371 E642 T643 M649 A650	Q363-N646 PolarHBondContact NE2-ND2 3.31Å; Q363-N646 PolarHBondContact NE2-OD1 3.44Å; Q371-N646 PolarHBondContact OE1-ND2 2.98Å; E642-N646 VanDerWaalsContact O-CB 3.23Å; E642-N646 WeakPolarHBondContact O-CB 3.06Å; E642-N646 PolarHBondContact O-N 3.09Å; E642-N646 PolarHBondContact O-ND2 3.28Å; E642-N646 VanDerWaalsContact O-ND2 3.15Å; T643-N646 PolarHBondContact O-N 3.4Å; N646-M649 PolarHBondContact O-N 2.97Å; N646-A650 WeakPolarHBondContact O-CB 3.35Å; N646-A650 PolarHBondContact O-N 2.78Å
647	L	74.9	Confident	75.2	Confident	4 Å²	4	54 Å²	54	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-46.1	171.6	-73.1	176.9	0	0	0	111.1	L270 L372 T643 D644 M649 A650 S651 V754 L757 Q758 L761	L270-L647 HydrophobicContact CD2-CD2 3.14Å; L372-L647 HydrophobicContact CD2-CD2 4.35Å; T643-L647 HydrophobicContact CG2-CD1 4.18Å; T643-L647 HydrophobicContact CG2-CG 4.35Å; T643-L647 WeakPolarHBondContact O-CB 3.15Å; T643-L647 WeakPolarHBondContact O-CG 3.2Å; T643-L647 PolarHBondContact O-N 3.24Å; D644-L647 PolarHBondContact O-N 2.93Å; L647-M649 PolarHBondContact O-N 3.41Å; L647-A650 WeakPolarHBondContact O-CB 3.5Å; L647-A650 PolarHBondContact O-N 2.88Å; L647-A650 VanDerWaalsContact O-N 3.15Å; L647-S651 PolarHBondContact O-N 3.44Å; L647-V754 HydrophobicContact CB-CG1 4.34Å; L647-V754 WeakPolarHBondContact O-CG1 3.26Å; L647-L757 HydrophobicContact CD1-CD2 4.11Å; L647-L757 HydrophobicContact CD1-CG 4.16Å; L647-L757 HydrophobicContact CD2-CD2 3.6Å; L647-L757 HydrophobicContact CD2-CG 4.43Å; L647-Q758 HydrophobicContact CB-CG 4.12Å; L647-Q758 HydrophobicContact CD1-CG 4.32Å; L647-L761 HydrophobicContact CD1-CD1 3.31Å
648	A	73.6	Confident	75.1	Confident	42 Å²	42	52.1 Å²	52.1	35%	0.347	26%	0.263	S	S	.	.	H	α-helix	trans	-59.7	-38	176.4	0	0	0	0	0	111.7	D644 E645 S651	D644-A648 WeakPolarHBondContact O-CB 3.42Å; D644-A648 PolarHBondContact O-N 3.49Å; E645-A648 PolarHBondContact O-N 3.33Å; A648-S651 PolarHBondContact O-OG 3.04Å
649	M	71.3	Confident	75.4	Confident	35 Å²	35	56.5 Å²	56.5	17%	0.172	29%	0.287	C	S	.	.	H	α-helix	trans	-70.1	-39.2	175	-171.6	173	177.2	0	0	112.7	L357 R361 E645 N646 L647 S651 R652	L357-M649 HydrophobicContact CB-CE 4.17Å; L357-M649 HydrophobicContact CD2-CE 3.2Å; L357-M649 HydrophobicContact CG-CE 4.26Å; R361-M649 HydrophobicContact CG-CE 4.45Å; E645-M649 WeakPolarHBondContact O-CB 3.03Å; E645-M649 PolarHBondContact O-N 3.41Å; N646-M649 PolarHBondContact O-N 2.97Å; L647-M649 PolarHBondContact O-N 3.41Å; M649-S651 PolarHBondContact O-N 2.82Å; M649-R652 WeakPolarHBondContact O-CA 3.42Å; M649-R652 VanDerWaalsContact O-CB 3.32Å; M649-R652 WeakPolarHBondContact O-CB 3.38Å; M649-R652 PolarHBondContact O-N 3.3Å
650	A	73	Confident	75.7	Confident	11 Å²	11	56.1 Å²	56.1	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-59.3	-31.5	177.3	0	0	0	0	0	111.9	L270 V274 N646 L647 R652 L653 V754	L270-A650 HydrophobicContact CD1-CB 4.29Å; V274-A650 HydrophobicContact CG2-CB 4.39Å; N646-A650 WeakPolarHBondContact O-CB 3.35Å; N646-A650 PolarHBondContact O-N 2.78Å; L647-A650 WeakPolarHBondContact O-CB 3.5Å; L647-A650 PolarHBondContact O-N 2.88Å; L647-A650 VanDerWaalsContact O-N 3.15Å; A650-R652 PolarHBondContact O-N 3.28Å; A650-L653 HydrophobicContact CB-CD1 4.38Å; A650-L653 VanDerWaalsContact O-CB 3.24Å; A650-L653 WeakPolarHBondContact O-CB 3.46Å; A650-L653 PolarHBondContact O-N 3.24Å; A650-V754 HydrophobicContact CB-CG2 4.28Å
651	S	72.9	Confident	76.1	Confident	40 Å²	40	59.1 Å²	59.1	28%	0.28	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-30.3	173.1	75.4	0	0	0	0	113.5	L647 A648 M649 L653 D654	L647-S651 PolarHBondContact O-N 3.44Å; A648-S651 PolarHBondContact O-OG 3.04Å; M649-S651 PolarHBondContact O-N 2.82Å; S651-L653 PolarHBondContact O-N 3.19Å; S651-D654 PolarHBondContact O-N 3.46Å
652	R	74.3	Confident	76.4	Confident	170 Å²	170	56.9 Å²	56.9	64%	0.642	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-74.8	-12.3	176	-58	-176	178.8	178.4	-0.6	112.4	M649 A650 D654 D655	M649-R652 WeakPolarHBondContact O-CA 3.42Å; M649-R652 VanDerWaalsContact O-CB 3.32Å; M649-R652 WeakPolarHBondContact O-CB 3.38Å; M649-R652 PolarHBondContact O-N 3.3Å; A650-R652 PolarHBondContact O-N 3.28Å; R652-D654 PolarHBondContact O-N 3.07Å; R652-D655 WeakPolarHBondContact O-CB 3.34Å; R652-D655 PolarHBondContact O-N 2.91Å
653	L	76.4	Confident	76.9	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.052	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-66.3	-19.7	175.6	-65.3	172.1	0	0	0	112.2	V274 L277 L354 L357 A650 S651 D655 F656	V274-L653 HydrophobicContact CB-CD1 4.38Å; V274-L653 HydrophobicContact CG1-CD1 3.84Å; V274-L653 HydrophobicContact CG2-CD1 3.81Å; L277-L653 HydrophobicContact CD2-CB 3.86Å; L277-L653 HydrophobicContact CD2-CD1 4.43Å; L277-L653 HydrophobicContact CD2-CD2 4.24Å; L277-L653 HydrophobicContact CD2-CG 4.41Å; L354-L653 HydrophobicContact CD1-CD2 3.96Å; L357-L653 HydrophobicContact CD1-CD2 4Å; A650-L653 HydrophobicContact CB-CD1 4.38Å; A650-L653 VanDerWaalsContact O-CB 3.24Å; A650-L653 WeakPolarHBondContact O-CB 3.46Å; A650-L653 PolarHBondContact O-N 3.24Å; S651-L653 PolarHBondContact O-N 3.19Å; L653-D655 PolarHBondContact O-N 2.85Å; L653-F656 HydrophobicContact CD2-CD2 4.27Å; L653-F656 HydrophobicContact CD2-CE2 4.39Å; L653-F656 WeakPolarHBondContact O-CD2 3.2Å; L653-F656 PolarHBondContact O-N 3.37Å; L653-F656 VanDerWaalsContact O-N 3.1Å
654	D	77.5	Confident	77.5	Confident	14 Å²	14	54.6 Å²	54.6	8%	0.075	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-60.9	-28.3	173.8	-80.7	7.3	0	0	0	113.1	S651 R652 F656 I657 K749 I750 A751	S651-D654 PolarHBondContact O-N 3.46Å; R652-D654 PolarHBondContact O-N 3.07Å; D654-F656 PolarHBondContact O-N 3.46Å; D654-I657 WeakPolarHBondContact O-CB 3.34Å; D654-I657 PolarHBondContact O-N 3.34Å; D654-K749 VanDerWaalsContact OD2-CB 3.28Å; D654-K749 WeakPolarHBondContact OD2-CB 3.47Å; D654-I750 WeakPolarHBondContact OD1-CA 3.12Å; D654-I750 WeakPolarHBondContact OD1-CB 3.32Å; D654-I750 PolarHBondContact OD1-N 2.86Å; D654-I750 PolarHBondContact OD2-N 2.8Å; D654-A751 PolarHBondContact OD1-N 2.87Å; D654-A751 WeakPolarHBondContact OD2-CB 3.16Å; D654-A751 PolarHBondContact OD2-N 3.35Å
655	D	75	Confident	78.1	Confident	130 Å²	130	55.6 Å²	55.6	70%	0.695	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-66.2	-18.1	178.4	-65.9	-22.3	0	0	0	112	R652 L653	R652-D655 WeakPolarHBondContact O-CB 3.34Å; R652-D655 PolarHBondContact O-N 2.91Å; L653-D655 PolarHBondContact O-N 2.85Å
656	F	75.9	Confident	78.7	Confident	26 Å²	26	55.7 Å²	55.7	11%	0.114	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-94.5	-8	176.3	-53.8	-83.9	0	0	0	113.3	F350 A353 L354 L357 L653 D654 V658 Y660	F350-F656 HydrophobicContact CB-CD1 4.31Å; F350-F656 WeakPolarHBondContact O-CD1 3.39Å; A353-F656 HydrophobicContact CB-CD1 4.44Å; A353-F656 HydrophobicContact CB-CE1 3.51Å; A353-F656 HydrophobicContact CB-CZ 4.29Å; L354-F656 HydrophobicContact CB-CD1 4.49Å; L354-F656 HydrophobicContact CD1-CB 3.67Å; L354-F656 HydrophobicContact CD1-CD1 3.67Å; L354-F656 HydrophobicContact CD1-CD2 3.48Å; L354-F656 VanDerWaalsContact CD1-CD2 3.48Å; L354-F656 HydrophobicContact CD1-CE1 4.17Å; L354-F656 HydrophobicContact CD1-CE2 4.01Å; L354-F656 HydrophobicContact CD1-CG 3.28Å; L354-F656 HydrophobicContact CD1-CZ 4.33Å; L357-F656 HydrophobicContact CD1-CD2 4.3Å; L357-F656 HydrophobicContact CD1-CE1 4.37Å; L357-F656 HydrophobicContact CD1-CE2 3.27Å; L357-F656 HydrophobicContact CD1-CZ 3.32Å; L357-F656 HydrophobicContact CG-CZ 4.46Å; L653-F656 HydrophobicContact CD2-CD2 4.27Å; L653-F656 HydrophobicContact CD2-CE2 4.39Å; L653-F656 WeakPolarHBondContact O-CD2 3.2Å; L653-F656 PolarHBondContact O-N 3.37Å; L653-F656 VanDerWaalsContact O-N 3.1Å; D654-F656 PolarHBondContact O-N 3.46Å; F656-V658 PolarHBondContact O-N 3.08Å; F656-Y660 PolarHBondContact O-OH 3.09Å
657	I	76.7	Confident	79.4	Confident	32 Å²	32	55.2 Å²	55.2	16%	0.164	28%	0.283	C	S	.	.			trans	-80	74.5	170.8	-54	179.3	0	0	0	107.8	D654 Y660 K748 I750	D654-I657 WeakPolarHBondContact O-CB 3.34Å; D654-I657 PolarHBondContact O-N 3.34Å; I657-Y660 WeakPolarHBondContact CA-OH 3.5Å; I657-Y660 HydrophobicContact CG2-CE2 4.14Å; I657-K748 WeakPolarHBondContact CD1-O 3.43Å; I657-I750 HydrophobicContact CD1-CG1 4.34Å
658	V	76.8	Confident	80	Confident	59 Å²	59	55.7 Å²	55.7	36%	0.358	29%	0.287	S	S	.	.			trans	-84.5	174.6	177.5	-63.2	0	0	0	0	111.1	F350 F656 Y660	F350-V658 HydrophobicContact CB-CG2 4.4Å; F350-V658 HydrophobicContact CD1-CG2 3.77Å; F350-V658 HydrophobicContact CE1-CG2 4.28Å; F350-V658 HydrophobicContact CG-CG2 4.19Å; F656-V658 PolarHBondContact O-N 3.08Å; V658-Y660 VanDerWaalsContact C-N 3.26Å; V658-Y660 HydrophobicContact CG2-CD1 3.99Å; V658-Y660 HydrophobicContact CG2-CE1 3.88Å; V658-Y660 VanDerWaalsContact O-CD2 3.25Å; V658-Y660 WeakPolarHBondContact O-CD2 3.2Å; V658-Y660 PolarHBondContact O-N 3.36Å
659	N	79.2	Confident	80.5	Confident	103 Å²	103	61.6 Å²	61.6	55%	0.551	30%	0.304	S	S	*	.			trans	-69.9	85.6	170.7	-172.6	0.6	0	0	0	110.2	E661 E662	N659-E661 PolarHBondContact O-N 2.86Å; N659-E661 VanDerWaalsContact O-N 3.12Å; N659-E661 VanDerWaalsContact OD1-CB 3.31Å; N659-E661 WeakPolarHBondContact OD1-CB 3.26Å; N659-E661 PolarHBondContact OD1-N 2.77Å; N659-E662 HydrophobicContact CB-CB 4.34Å; N659-E662 WeakPolarHBondContact O-CB 3.16Å; N659-E662 PolarHBondContact O-N 3.16Å
660	Y	85.9	Confident	81.2	Confident	5 Å²	5	61 Å²	61	2%	0.02	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-25.9	-179.7	-60.1	-70	0	0	0	112.4	F350 F656 I657 V658 E662 V663 R664 L741 L744	F350-Y660 HydrophobicContact CD2-CE1 4.31Å; F350-Y660 HydrophobicContact CE1-CD1 4.22Å; F350-Y660 HydrophobicContact CE1-CE1 4.19Å; F350-Y660 AromaticContact CE2-CE1 3.91Å; F350-Y660 HydrophobicContact CE2-CE1 3.91Å; F350-Y660 HydrophobicContact CZ-CD1 4.05Å; F350-Y660 AromaticContact CZ-CE1 3.84Å; F350-Y660 HydrophobicContact CZ-CE1 3.84Å; F656-Y660 PolarHBondContact O-OH 3.09Å; I657-Y660 WeakPolarHBondContact CA-OH 3.5Å; I657-Y660 HydrophobicContact CG2-CE2 4.14Å; V658-Y660 VanDerWaalsContact C-N 3.26Å; V658-Y660 HydrophobicContact CG2-CD1 3.99Å; V658-Y660 HydrophobicContact CG2-CE1 3.88Å; V658-Y660 VanDerWaalsContact O-CD2 3.25Å; V658-Y660 WeakPolarHBondContact O-CD2 3.2Å; V658-Y660 PolarHBondContact O-N 3.36Å; Y660-E662 VanDerWaalsContact C-N 3.27Å; Y660-E662 PolarHBondContact O-N 2.85Å; Y660-V663 PolarHBondContact O-N 3.41Å; Y660-V663 VanDerWaalsContact O-N 3.17Å; Y660-R664 VanDerWaalsContact O-CG 3.26Å; Y660-R664 WeakPolarHBondContact O-CG 3.41Å; Y660-R664 PolarHBondContact O-N 2.97Å; Y660-L741 HydrophobicContact CD1-CD2 3.81Å; Y660-L741 HydrophobicContact CG-CD2 4.45Å; Y660-L744 HydrophobicContact CD1-CB 4.22Å; Y660-L744 HydrophobicContact CD1-CD1 4.49Å; Y660-L744 HydrophobicContact CD2-CB 4.04Å; Y660-L744 HydrophobicContact CE1-CB 4.04Å; Y660-L744 HydrophobicContact CE1-CD1 4.05Å; Y660-L744 HydrophobicContact CE2-CB 3.79Å; Y660-L744 WeakPolarHBondContact CE2-O 3.48Å; Y660-L744 HydrophobicContact CG-CB 4.21Å
661	E	84	Confident	81.9	Confident	96 Å²	96	60.5 Å²	60.5	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-33.7	176.1	-158.8	61.1	-157	0	0	112.3	N659 R664 S665	N659-E661 PolarHBondContact O-N 2.86Å; N659-E661 VanDerWaalsContact O-N 3.12Å; N659-E661 VanDerWaalsContact OD1-CB 3.31Å; N659-E661 WeakPolarHBondContact OD1-CB 3.26Å; N659-E661 PolarHBondContact OD1-N 2.77Å; E661-R664 VanDerWaalsContact CD-NH1 3.27Å; E661-R664 PolarHBondContact O-N 2.97Å; E661-R664 IonicContact OE1-CZ 3.24Å; E661-R664 IonicContact OE1-NH1 3.72Å; E661-R664 PolarHBondContact OE1-NH1 2.76Å; E661-R664 WeakPolarHBondContact OE2-CD 3.42Å; E661-R664 IonicContact OE2-CZ 3.9Å; E661-R664 IonicContact OE2-NE 2.89Å; E661-R664 IonicContact OE2-NH1 3.14Å; E661-R664 PolarHBondContact OE2-NH1 3.46Å; E661-S665 WeakPolarHBondContact O-CB 3.46Å; E661-S665 PolarHBondContact O-N 3.3Å
662	E	84.4	Confident	82.6	Confident	98 Å²	98	58.6 Å²	58.6	46%	0.458	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-43.3	174.2	-169.2	-171.4	154.7	0	0	110.8	N659 Y660 S665 K666	N659-E662 HydrophobicContact CB-CB 4.34Å; N659-E662 WeakPolarHBondContact O-CB 3.16Å; N659-E662 PolarHBondContact O-N 3.16Å; Y660-E662 VanDerWaalsContact C-N 3.27Å; Y660-E662 PolarHBondContact O-N 2.85Å; E662-S665 PolarHBondContact O-N 3.35Å; E662-S665 PolarHBondContact O-OG 3.3Å; E662-K666 WeakPolarHBondContact O-CG 3.42Å; E662-K666 PolarHBondContact O-N 3.49Å; E662-K666 IonicContact OE1-NZ 2.71Å; E662-K666 PolarHBondContact OE1-NZ 2.96Å
663	V	85.3	Confident	83.1	Confident	24 Å²	24	50.7 Å²	50.7	15%	0.145	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-43.5	177.5	-176.3	0	0	0	0	110.6	P346 F350 Y660 S665 K666 L667 L741	P346-V663 HydrophobicContact CG-CG1 4.29Å; F350-V663 HydrophobicContact CE1-CG2 4.25Å; Y660-V663 PolarHBondContact O-N 3.41Å; Y660-V663 VanDerWaalsContact O-N 3.17Å; V663-S665 VanDerWaalsContact C-N 3.3Å; V663-S665 PolarHBondContact O-N 3.32Å; V663-K666 PolarHBondContact O-N 2.8Å; V663-K666 VanDerWaalsContact O-N 3.09Å; V663-L667 PolarHBondContact O-N 2.99Å; V663-L741 HydrophobicContact CG1-CD1 4.17Å
664	R	89	Confident	83.3	Confident	54 Å²	54	51 Å²	51	20%	0.204	26%	0.258	C	S	.	.	H	α-helix	trans	-57.3	-42.8	175.5	-69.2	176.6	72.2	-140.7	-5.6	111.9	Y660 E661 K666 L667 D738 L741 I742	Y660-R664 VanDerWaalsContact O-CG 3.26Å; Y660-R664 WeakPolarHBondContact O-CG 3.41Å; Y660-R664 PolarHBondContact O-N 2.97Å; E661-R664 VanDerWaalsContact CD-NH1 3.27Å; E661-R664 PolarHBondContact O-N 2.97Å; E661-R664 IonicContact OE1-CZ 3.24Å; E661-R664 IonicContact OE1-NH1 3.72Å; E661-R664 PolarHBondContact OE1-NH1 2.76Å; E661-R664 WeakPolarHBondContact OE2-CD 3.42Å; E661-R664 IonicContact OE2-CZ 3.9Å; E661-R664 IonicContact OE2-NE 2.89Å; E661-R664 IonicContact OE2-NH1 3.14Å; E661-R664 PolarHBondContact OE2-NH1 3.46Å; R664-K666 PolarHBondContact O-N 2.9Å; R664-L667 WeakPolarHBondContact O-CB 3.32Å; R664-L667 PolarHBondContact O-N 2.88Å; R664-L667 VanDerWaalsContact O-N 3.17Å; R664-D738 WeakPolarHBondContact CG-OD1 3.21Å; R664-D738 IonicContact CZ-OD1 3.72Å; R664-D738 IonicContact CZ-OD2 2.76Å; R664-D738 IonicContact NE-OD1 2.84Å; R664-D738 PolarHBondContact NE-OD1 3.15Å; R664-D738 IonicContact NE-OD2 2.88Å; R664-D738 IonicContact NH2-OD1 3.86Å; R664-D738 PolarHBondContact NH2-OD1 3.36Å; R664-D738 IonicContact NH2-OD2 3.68Å; R664-D738 PolarHBondContact NH2-OD2 2.97Å; R664-L741 HydrophobicContact CG-CB 3.66Å; R664-L741 HydrophobicContact CG-CD1 3.66Å; R664-L741 HydrophobicContact CG-CG 4.28Å; R664-I742 VanDerWaalsContact CZ-CG1 3.45Å
665	S	86	Confident	83.2	Confident	77 Å²	77	53.7 Å²	53.7	54%	0.538	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-24.9	179.2	78.4	0	0	0	0	113.7	E661 E662 V663	E661-S665 WeakPolarHBondContact O-CB 3.46Å; E661-S665 PolarHBondContact O-N 3.3Å; E662-S665 PolarHBondContact O-N 3.35Å; E662-S665 PolarHBondContact O-OG 3.3Å; V663-S665 VanDerWaalsContact C-N 3.3Å; V663-S665 PolarHBondContact O-N 3.32Å
666	K	86.9	Confident	82.7	Confident	117 Å²	117	49.3 Å²	49.3	51%	0.509	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-3.1	-179.7	-64.8	175.3	-171.6	171.8	0	113.7	P346 E662 V663 R664	P346-K666 HydrophobicContact CB-CB 4.14Å; P346-K666 HydrophobicContact CG-CB 4.22Å; E662-K666 WeakPolarHBondContact O-CG 3.42Å; E662-K666 PolarHBondContact O-N 3.49Å; E662-K666 IonicContact OE1-NZ 2.71Å; E662-K666 PolarHBondContact OE1-NZ 2.96Å; V663-K666 PolarHBondContact O-N 2.8Å; V663-K666 VanDerWaalsContact O-N 3.09Å; R664-K666 PolarHBondContact O-N 2.9Å
667	L	88.8	Confident	81.9	Confident	12 Å²	12	52.6 Å²	52.6	6%	0.063	27%	0.273	C	S	.	.	S	Bend	trans	-60.9	140	176.1	-68.9	175.1	0	0	0	110.5	M345 P346 V663 R664 K669 I734 I737 D738 L741	M345-L667 HydrophobicContact SD-CD2 3.66Å; P346-L667 HydrophobicContact CG-CD2 4.39Å; V663-L667 PolarHBondContact O-N 2.99Å; R664-L667 WeakPolarHBondContact O-CB 3.32Å; R664-L667 PolarHBondContact O-N 2.88Å; R664-L667 VanDerWaalsContact O-N 3.17Å; L667-K669 PolarHBondContact O-N 3.48Å; L667-I734 HydrophobicContact CB-CG2 4.24Å; L667-I734 HydrophobicContact CD1-CG2 4.34Å; L667-I737 HydrophobicContact CD1-CG2 4.42Å; L667-I737 HydrophobicContact CD2-CG2 3.94Å; L667-D738 HydrophobicContact CD1-CB 3.98Å; L667-L741 HydrophobicContact CD1-CD1 4.25Å
668	P	87.5	Confident	80.9	Confident	14 Å²	14	55.8 Å²	55.8	9%	0.091	30%	0.299	C	S	.	.			trans	-65.4	125.1	-178.1	25.8	-33.2	0	0	0	110.8	F291 T343 Y671 I734	F291-P668 HydrophobicContact CE2-CG 4.1Å; F291-P668 HydrophobicContact CZ-CG 3.79Å; T343-P668 HydrophobicContact CG2-CB 3.74Å; T343-P668 HydrophobicContact CG2-CG 4.44Å; P668-Y671 HydrophobicContact CB-CE1 4.39Å; P668-I734 HydrophobicContact CG-CD1 3.62Å; P668-I734 HydrophobicContact CG-CG1 4.2Å
669	K	83	Confident	79.6	Confident	166 Å²	166	57 Å²	57	72%	0.722	30%	0.303	S	S	*	.			trans	-103.9	-15.3	177.2	-60.9	-179.9	-176.4	175.9	0	113.4	L667	L667-K669 PolarHBondContact O-N 3.48Å
670	T	85.7	Confident	78.5	Confident	22 Å²	22	61.9 Å²	61.9	14%	0.135	32%	0.323	C	S	.	.			trans	-145.5	134.4	-175.9	54.9	0	0	0	0	109.2
671	Y	88.5	Confident	76.9	Confident	1 Å²	1	63.8 Å²	63.8	0%	0.004	34%	0.337	C	S	.	.			trans	-108.7	-7	-177.4	-47.8	-73.8	0	0	0	113.2	F291 F295 R340 T343 P668 V689 F727 L730 D731	F291-Y671 HydrophobicContact CE2-CE1 4.01Å; F291-Y671 HydrophobicContact CZ-CE1 4.12Å; F295-Y671 HydrophobicContact CE2-CD1 4.36Å; R340-Y671 WeakPolarHBondContact CB-O 3.35Å; R340-Y671 PolarHBondContact N-O 3Å; T343-Y671 HydrophobicContact CG2-CD1 3.72Å; T343-Y671 HydrophobicContact CG2-CE1 4.36Å; P668-Y671 HydrophobicContact CB-CE1 4.39Å; Y671-V689 HydrophobicContact CD2-CG2 3.71Å; Y671-V689 HydrophobicContact CE2-CG2 4.26Å; Y671-F727 AromaticContact CD2-CD1 3.69Å; Y671-F727 HydrophobicContact CD2-CD1 3.69Å; Y671-F727 AromaticContact CD2-CE1 3.9Å; Y671-F727 HydrophobicContact CD2-CE1 3.9Å; Y671-F727 HydrophobicContact CE2-CD1 4.33Å; Y671-F727 HydrophobicContact CG-CD1 4.29Å; Y671-F727 HydrophobicContact CG-CE1 4.16Å; Y671-L730 HydrophobicContact CD1-CD1 4.33Å; Y671-L730 HydrophobicContact CE1-CB 4.15Å; Y671-L730 HydrophobicContact CE1-CD1 4.32Å; Y671-L730 HydrophobicContact CE2-CB 4.4Å; Y671-D731 WeakPolarHBondContact CE2-OD1 3.39Å; Y671-D731 PolarHBondContact OH-OD1 3.41Å
672	L	87.8	Confident	75.6	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.7	-169.5	-65.3	171.9	0	0	0	110.8	F302 S338 I339 W687 V689 M692 F727	F302-L672 HydrophobicContact CD2-CD2 4.36Å; F302-L672 HydrophobicContact CE1-CD2 4.48Å; F302-L672 HydrophobicContact CE2-CD2 3.67Å; F302-L672 HydrophobicContact CZ-CD2 3.74Å; S338-L672 WeakPolarHBondContact O-CA 3.36Å; I339-L672 HydrophobicContact CG1-CD2 4.23Å; L672-W687 HydrophobicContact CB-CB 4.06Å; L672-W687 PolarHBondContact O-N 3.34Å; L672-V689 HydrophobicContact CD1-CG2 4.46Å; L672-M692 HydrophobicContact CD1-CB 3.82Å; L672-M692 HydrophobicContact CD1-CG 4Å; L672-M692 HydrophobicContact CD1-SD 3.37Å; L672-M692 WeakPolarHBondContact CD1-SD 3.09Å; L672-F727 HydrophobicContact CD1-CZ 4.01Å; L672-F727 HydrophobicContact CD2-CZ 3.86Å; L672-F727 HydrophobicContact CG-CE1 4.39Å; L672-F727 HydrophobicContact CG-CZ 4Å
673	S	84.5	Confident	74.6	Confident	5 Å²	5	64.9 Å²	64.9	4%	0.035	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.7	171.9	40.3	0	0	0	0	109.3	S338	S338-S673 PolarHBondContact N-O 2.81Å; S338-S673 PolarHBondContact O-N 3.48Å; S338-S673 PolarHBondContact O-OG 3.47Å; S338-S673 PolarHBondContact OG-O 3.1Å; S338-S673 PolarHBondContact OG-OG 2.88Å
674	I	81.4	Confident	73.9	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.087	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.2	169.5	-169.8	175	0	0	0	109.5	T332 N336 T685 W687	T332-I674 HydrophobicContact CG2-CD1 3.77Å; N336-I674 HydrophobicContact CB-CG1 4.17Å; N336-I674 WeakPolarHBondContact O-CA 3.12Å; I674-T685 WeakPolarHBondContact CG2-OG1 3.26Å; I674-T685 PolarHBondContact N-O 2.94Å; I674-T685 PolarHBondContact O-N 3.22Å; I674-W687 HydrophobicContact CB-CD2 4.48Å; I674-W687 HydrophobicContact CD1-CH2 4Å; I674-W687 HydrophobicContact CD1-CZ2 3.95Å; I674-W687 HydrophobicContact CD1-CZ3 4.3Å; I674-W687 HydrophobicContact CG2-CD2 4.35Å; I674-W687 HydrophobicContact CG2-CG 4.31Å
675	Q	75.2	Confident	73.4	Confident	69 Å²	69	70.6 Å²	70.6	32%	0.322	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.4	169.9	-166.9	166.2	0.8	0	0	108.5	N336 Y684	N336-Q675 WeakPolarHBondContact CB-O 3.33Å; N336-Q675 PolarHBondContact O-N 3.35Å; Q675-Y684 HydrophobicContact CB-CD1 4.09Å; Q675-Y684 HydrophobicContact CB-CE1 4Å; Q675-Y684 HydrophobicContact CG-CD1 4.49Å; Q675-Y684 HydrophobicContact CG-CE1 4.17Å
676	S	65.2	Low	73.2	Confident	38 Å²	38	71.2 Å²	71.2	27%	0.266	38%	0.378	S	S	.	.			trans	-65.2	131.5	174.9	-175.1	0	0	0	0	109	S678	S676-S678 PolarHBondContact O-N 3.43Å; S676-S678 VanDerWaalsContact O-N 3.12Å; S676-S678 PolarHBondContact OG-OG 2.89Å
677	P	59.1	Low	72.9	Confident	96 Å²	96	66.3 Å²	66.3	62%	0.623	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.4	178.9	22.1	-29.9	0	0	0	113.5
678	S	55.6	Low	72.8	Confident	99 Å²	99	68.8 Å²	68.8	69%	0.692	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-8.1	-174.3	61.1	0	0	0	0	115.6	S676	S676-S678 PolarHBondContact O-N 3.43Å; S676-S678 VanDerWaalsContact O-N 3.12Å; S676-S678 PolarHBondContact OG-OG 2.89Å
679	D	49.5	Very low	72.9	Confident	84 Å²	84	69.1 Å²	69.1	45%	0.449	38%	0.375	S	S	.	.			trans	-104.2	117.9	-179.3	-82.8	-43	0	0	0	110.9	S681	D679-S681 PolarHBondContact O-N 2.93Å
680	E	55.2	Low	73.1	Confident	206 Å²	206	69 Å²	69	96%	0.963	38%	0.375	S	S	*	.			trans	-71.7	-11.5	165	-71.5	-173.8	165.2	0	0	111.8
681	S	52.2	Low	73.2	Confident	45 Å²	45	73.3 Å²	73.3	32%	0.315	39%	0.391	S	S	.	.	S	Bend	trans	-68	137.6	167	71.8	0	0	0	0	108.5	D679 D683	D679-S681 PolarHBondContact O-N 2.93Å; S681-D683 WeakPolarHBondContact CB-OD2 3.35Å; S681-D683 PolarHBondContact O-N 3.35Å; S681-D683 WeakPolarHBondContact OG-CB 3.43Å; S681-D683 PolarHBondContact OG-OD2 3.45Å
682	T	57.6	Low	73.2	Confident	109 Å²	109	73.2 Å²	73.2	67%	0.669	39%	0.391	S	S	*	.			trans	-65.8	29	170.9	43.2	0	0	0	0	112.7	Y684	T682-Y684 WeakPolarHBondContact O-CD2 3.45Å; T682-Y684 WeakPolarHBondContact O-CE2 3.34Å; T682-Y684 PolarHBondContact O-N 2.79Å; T682-Y684 VanDerWaalsContact O-N 3.11Å
683	D	62.8	Low	73.3	Confident	108 Å²	108	74.4 Å²	74.4	58%	0.578	40%	0.396	S	S	*	.			trans	-78.5	95.2	179.7	-73.5	-35.6	0	0	0	109.8	S681	S681-D683 WeakPolarHBondContact CB-OD2 3.35Å; S681-D683 PolarHBondContact O-N 3.35Å; S681-D683 WeakPolarHBondContact OG-CB 3.43Å; S681-D683 PolarHBondContact OG-OD2 3.45Å
684	Y	70.2	Confident	73.6	Confident	117 Å²	117	78.3 Å²	78.3	46%	0.459	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.4	169.4	-58.9	-80.3	0	0	0	109.6	Q675 T682	Q675-Y684 HydrophobicContact CB-CD1 4.09Å; Q675-Y684 HydrophobicContact CB-CE1 4Å; Q675-Y684 HydrophobicContact CG-CD1 4.49Å; Q675-Y684 HydrophobicContact CG-CE1 4.17Å; T682-Y684 WeakPolarHBondContact O-CD2 3.45Å; T682-Y684 WeakPolarHBondContact O-CE2 3.34Å; T682-Y684 PolarHBondContact O-N 2.79Å; T682-Y684 VanDerWaalsContact O-N 3.11Å
685	T	78.4	Confident	73.9	Confident	80 Å²	80	79.3 Å²	79.3	49%	0.491	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.5	168.8	54.7	0	0	0	0	110.1	I674	I674-T685 WeakPolarHBondContact CG2-OG1 3.26Å; I674-T685 PolarHBondContact N-O 2.94Å; I674-T685 PolarHBondContact O-N 3.22Å
686	L	81.8	Confident	74.7	Confident	91 Å²	91	76.1 Å²	76.1	48%	0.476	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.1	179.1	-64.6	178.6	0	0	0	110.1
687	W	81.5	Confident	75.9	Confident	13 Å²	13	77.5 Å²	77.5	5%	0.049	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.2	-174.5	-124.8	28.2	0	0	0	112.4	T332 V337 L672 I674 M692 L695	T332-W687 HydrophobicContact CG2-CH2 3.35Å; T332-W687 HydrophobicContact CG2-CZ2 4.19Å; T332-W687 HydrophobicContact CG2-CZ3 3.98Å; V337-W687 HydrophobicContact CG2-CE3 4.01Å; V337-W687 HydrophobicContact CG2-CZ3 4.03Å; L672-W687 HydrophobicContact CB-CB 4.06Å; L672-W687 PolarHBondContact O-N 3.34Å; I674-W687 HydrophobicContact CB-CD2 4.48Å; I674-W687 HydrophobicContact CD1-CH2 4Å; I674-W687 HydrophobicContact CD1-CZ2 3.95Å; I674-W687 HydrophobicContact CD1-CZ3 4.3Å; I674-W687 HydrophobicContact CG2-CD2 4.35Å; I674-W687 HydrophobicContact CG2-CG 4.31Å; W687-M692 HydrophobicContact CE3-CB 3.86Å; W687-M692 HydrophobicContact CE3-CG 4.13Å; W687-M692 HydrophobicContact CZ3-CB 3.97Å; W687-M692 HydrophobicContact CZ3-CG 3.91Å; W687-L695 HydrophobicContact CH2-CB 4.48Å; W687-L695 HydrophobicContact CH2-CD1 3.37Å; W687-L695 HydrophobicContact CZ2-CD1 3.11Å
688	P	87.2	Confident	77.3	Confident	64 Å²	64	75.9 Å²	75.9	42%	0.416	40%	0.396	S	S	.	.			trans	-64.2	136.7	167.7	-19.1	31.3	0	0	0	110.4	K690 K691 M692	P688-K690 PolarHBondContact O-N 2.65Å; P688-K690 VanDerWaalsContact O-N 3.16Å; P688-K691 HydrophobicContact CB-CB 4.44Å; P688-K691 WeakPolarHBondContact O-CB 3.48Å; P688-K691 PolarHBondContact O-N 3.22Å; P688-M692 PolarHBondContact O-N 3.21Å
689	V	87.7	Confident	78.8	Confident	21 Å²	21	71.2 Å²	71.2	13%	0.127	36%	0.364	C	S	.	.	H	α-helix	trans	-52.5	-40.4	178	175.4	0	0	0	0	111.6	Y671 L672 K691 M692 W693 F727	Y671-V689 HydrophobicContact CD2-CG2 3.71Å; Y671-V689 HydrophobicContact CE2-CG2 4.26Å; L672-V689 HydrophobicContact CD1-CG2 4.46Å; V689-K691 VanDerWaalsContact C-N 3.3Å; V689-K691 PolarHBondContact O-N 3.31Å; V689-M692 WeakPolarHBondContact O-CB 3.38Å; V689-M692 PolarHBondContact O-N 3.15Å; V689-W693 VanDerWaalsContact CG1-NE1 3.31Å; V689-W693 VanDerWaalsContact O-CD1 3.27Å; V689-W693 PolarHBondContact O-N 3.29Å; V689-F727 HydrophobicContact CG1-CB 4.09Å; V689-F727 HydrophobicContact CG1-CD1 4.39Å; V689-F727 HydrophobicContact CG1-CD2 3.87Å; V689-F727 HydrophobicContact CG1-CE2 4.4Å; V689-F727 HydrophobicContact CG1-CG 3.87Å; V689-F727 HydrophobicContact CG2-CD1 3.76Å; V689-F727 HydrophobicContact CG2-CE1 4Å; V689-F727 HydrophobicContact CG2-CG 4.1Å; V689-F727 HydrophobicContact CG2-CZ 4.5Å
690	K	88	Confident	80.7	Confident	163 Å²	163	69.1 Å²	69.1	71%	0.709	35%	0.35	S	S	*	.	H	α-helix	trans	-58	-38.7	176	-172.4	176.1	-178.3	177.8	0	113.2	P688 W693 N694	P688-K690 PolarHBondContact O-N 2.65Å; P688-K690 VanDerWaalsContact O-N 3.16Å; K690-W693 PolarHBondContact O-N 2.8Å; K690-N694 VanDerWaalsContact O-CG 3.26Å; K690-N694 PolarHBondContact O-N 2.91Å; K690-N694 VanDerWaalsContact O-N 3.09Å; K690-N694 PolarHBondContact O-OD1 3.32Å
691	K	87.6	Confident	82.2	Confident	113 Å²	113	63.1 Å²	63.1	49%	0.491	33%	0.327	S	S	.	.	H	α-helix	trans	-70.6	-40.3	179.9	-173.8	171.5	174.6	-177.6	0	111.1	P688 V689 N694 L695	P688-K691 HydrophobicContact CB-CB 4.44Å; P688-K691 WeakPolarHBondContact O-CB 3.48Å; P688-K691 PolarHBondContact O-N 3.22Å; V689-K691 VanDerWaalsContact C-N 3.3Å; V689-K691 PolarHBondContact O-N 3.31Å; K691-N694 PolarHBondContact O-N 2.95Å; K691-L695 HydrophobicContact CG-CD1 4.37Å; K691-L695 PolarHBondContact O-N 2.82Å
692	M	88.4	Confident	83.7	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-59.1	-47.8	173.3	-174.2	-153.4	77.1	0	0	111	F302 W305 F333 L672 W687 P688 V689 N694 L695 W696 F727	F302-M692 HydrophobicContact CE2-SD 3.86Å; W305-M692 HydrophobicContact CH2-CE 4.24Å; W305-M692 HydrophobicContact CH2-SD 4.2Å; W305-M692 HydrophobicContact CZ3-SD 4.29Å; F333-M692 HydrophobicContact CE1-CG 4.27Å; L672-M692 HydrophobicContact CD1-CB 3.82Å; L672-M692 HydrophobicContact CD1-CG 4Å; L672-M692 HydrophobicContact CD1-SD 3.37Å; L672-M692 WeakPolarHBondContact CD1-SD 3.09Å; W687-M692 HydrophobicContact CE3-CB 3.86Å; W687-M692 HydrophobicContact CE3-CG 4.13Å; W687-M692 HydrophobicContact CZ3-CB 3.97Å; W687-M692 HydrophobicContact CZ3-CG 3.91Å; P688-M692 PolarHBondContact O-N 3.21Å; V689-M692 WeakPolarHBondContact O-CB 3.38Å; V689-M692 PolarHBondContact O-N 3.15Å; M692-N694 PolarHBondContact O-N 2.97Å; M692-L695 PolarHBondContact O-N 3.46Å; M692-W696 WeakPolarHBondContact O-CB 3.35Å; M692-W696 PolarHBondContact O-N 3.1Å; M692-F727 HydrophobicContact CE-CE2 4.3Å
693	W	91	Very high	84.8	Confident	25 Å²	25	61.7 Å²	61.7	10%	0.095	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-40.8	-179.7	-71.6	127.5	0	0	0	113.3	W305 V689 K690 L695 W696 D697 T720 V723 R724 F727	W305-W693 HydrophobicContact CZ2-CZ3 4.1Å; V689-W693 VanDerWaalsContact CG1-NE1 3.31Å; V689-W693 VanDerWaalsContact O-CD1 3.27Å; V689-W693 PolarHBondContact O-N 3.29Å; K690-W693 PolarHBondContact O-N 2.8Å; W693-L695 VanDerWaalsContact C-N 3.3Å; W693-L695 PolarHBondContact O-N 3.39Å; W693-W696 HydrophobicContact CE3-CB 4.06Å; W693-W696 AromaticContact CE3-CD1 3.64Å; W693-W696 AromaticContact CE3-CG 3.99Å; W693-W696 HydrophobicContact CE3-CG 3.99Å; W693-W696 HydrophobicContact CZ3-CB 4.47Å; W693-W696 AromaticContact CZ3-CD1 3.7Å; W693-W696 HydrophobicContact CZ3-CG 4.05Å; W693-W696 WeakPolarHBondContact O-CB 3.5Å; W693-W696 PolarHBondContact O-N 2.98Å; W693-D697 WeakPolarHBondContact O-CB 3.49Å; W693-D697 PolarHBondContact O-N 3.35Å; W693-T720 HydrophobicContact CH2-CG2 3.92Å; W693-T720 HydrophobicContact CZ3-CG2 3.58Å; W693-V723 HydrophobicContact CH2-CB 4.18Å; W693-V723 HydrophobicContact CH2-CG1 3.95Å; W693-V723 HydrophobicContact CZ2-CB 4.35Å; W693-V723 HydrophobicContact CZ2-CG1 3.87Å; W693-R724 HydrophobicContact CD2-CG 4.01Å; W693-R724 HydrophobicContact CE3-CG 4.33Å; W693-R724 HydrophobicContact CH2-CG 3.61Å; W693-R724 HydrophobicContact CZ2-CB 4.07Å; W693-R724 HydrophobicContact CZ2-CG 3.16Å; W693-R724 HydrophobicContact CZ3-CG 4.18Å; W693-F727 HydrophobicContact CZ2-CD2 4.05Å; W693-F727 HydrophobicContact CZ2-CE2 4.29Å
694	N	90.1	Very high	85.8	Confident	87 Å²	87	56.6 Å²	56.6	47%	0.465	28%	0.284	S	S	.	.	H	α-helix	trans	-58.5	-43.5	175.3	-71.5	-5.6	0	0	0	112	K690 K691 M692 I698	K690-N694 VanDerWaalsContact O-CG 3.26Å; K690-N694 PolarHBondContact O-N 2.91Å; K690-N694 VanDerWaalsContact O-N 3.09Å; K690-N694 PolarHBondContact O-OD1 3.32Å; K691-N694 PolarHBondContact O-N 2.95Å; M692-N694 PolarHBondContact O-N 2.97Å; N694-I698 WeakPolarHBondContact O-CD1 3.42Å; N694-I698 VanDerWaalsContact O-CG1 3.26Å; N694-I698 WeakPolarHBondContact O-CG1 3.21Å; N694-I698 PolarHBondContact O-N 3.26Å
695	L	88.7	Confident	86.4	Confident	37 Å²	37	52.4 Å²	52.4	19%	0.194	27%	0.272	C	S	.	.	H	α-helix	trans	-73.9	-33.6	179.2	-69.8	167.3	0	0	0	112.3	L329 F333 W687 K691 M692 W693 I698 Y699	L329-L695 HydrophobicContact CD2-CB 4.25Å; L329-L695 HydrophobicContact CD2-CD2 3.7Å; F333-L695 HydrophobicContact CZ-CB 4.32Å; W687-L695 HydrophobicContact CH2-CB 4.48Å; W687-L695 HydrophobicContact CH2-CD1 3.37Å; W687-L695 HydrophobicContact CZ2-CD1 3.11Å; K691-L695 HydrophobicContact CG-CD1 4.37Å; K691-L695 PolarHBondContact O-N 2.82Å; M692-L695 PolarHBondContact O-N 3.46Å; W693-L695 VanDerWaalsContact C-N 3.3Å; W693-L695 PolarHBondContact O-N 3.39Å; L695-I698 HydrophobicContact CD2-CD1 4.48Å; L695-I698 PolarHBondContact O-N 2.67Å; L695-Y699 WeakPolarHBondContact O-CB 3.39Å; L695-Y699 PolarHBondContact O-N 2.97Å
696	W	90.4	Very high	86.5	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-47.3	172.4	168.5	-106.7	0	0	0	111.1	W305 V309 F333 M692 W693 I698 Y699 Y700 L704 L716	W305-W696 HydrophobicContact CH2-CD2 4.47Å; W305-W696 HydrophobicContact CH2-CE3 4.28Å; W305-W696 AromaticContact CZ2-CD2 3.57Å; W305-W696 HydrophobicContact CZ2-CD2 3.57Å; W305-W696 AromaticContact CZ2-CE3 3.6Å; W305-W696 HydrophobicContact CZ2-CE3 3.6Å; W305-W696 HydrophobicContact CZ2-CG 4Å; W305-W696 HydrophobicContact CZ2-CH2 4.44Å; W305-W696 HydrophobicContact CZ2-CZ2 4.42Å; W305-W696 HydrophobicContact CZ2-CZ3 4.06Å; W305-W696 AromaticContact NE1-CZ2 3.97Å; V309-W696 HydrophobicContact CB-CZ3 4.28Å; V309-W696 HydrophobicContact CG1-CH2 4.5Å; V309-W696 HydrophobicContact CG1-CZ3 3.81Å; V309-W696 HydrophobicContact CG2-CE3 4.36Å; V309-W696 HydrophobicContact CG2-CH2 3.54Å; V309-W696 HydrophobicContact CG2-CZ3 3.42Å; V309-W696 VanDerWaalsContact CG2-CZ3 3.42Å; F333-W696 HydrophobicContact CE1-CB 4.33Å; F333-W696 HydrophobicContact CE1-CE3 4.35Å; F333-W696 HydrophobicContact CE2-CE3 4.38Å; F333-W696 HydrophobicContact CZ-CB 3.82Å; F333-W696 HydrophobicContact CZ-CE3 4.26Å; M692-W696 WeakPolarHBondContact O-CB 3.35Å; M692-W696 PolarHBondContact O-N 3.1Å; W693-W696 HydrophobicContact CE3-CB 4.06Å; W693-W696 AromaticContact CE3-CD1 3.64Å; W693-W696 AromaticContact CE3-CG 3.99Å; W693-W696 HydrophobicContact CE3-CG 3.99Å; W693-W696 HydrophobicContact CZ3-CB 4.47Å; W693-W696 AromaticContact CZ3-CD1 3.7Å; W693-W696 HydrophobicContact CZ3-CG 4.05Å; W693-W696 WeakPolarHBondContact O-CB 3.5Å; W693-W696 PolarHBondContact O-N 2.98Å; W696-I698 VanDerWaalsContact C-N 3.3Å; W696-I698 PolarHBondContact O-N 3.24Å; W696-Y699 HydrophobicContact CE3-CD1 4.15Å; W696-Y699 AromaticContact CZ3-CD1 3.84Å; W696-Y699 HydrophobicContact CZ3-CD1 3.84Å; W696-Y699 HydrophobicContact CZ3-CE1 4.45Å; W696-Y699 PolarHBondContact O-N 3.22Å; W696-Y699 VanDerWaalsContact O-N 3.15Å; W696-Y700 HydrophobicContact CH2-CD2 4.3Å; W696-Y700 AromaticContact CZ2-CD2 3.83Å; W696-Y700 HydrophobicContact CZ2-CD2 3.83Å; W696-Y700 HydrophobicContact CZ2-CG 4.24Å; W696-Y700 WeakPolarHBondContact O-CB 3.38Å; W696-Y700 PolarHBondContact O-N 3.43Å; W696-L704 HydrophobicContact CH2-CD1 3.84Å; W696-L704 HydrophobicContact CZ3-CD1 4.01Å; W696-L716 HydrophobicContact CH2-CD1 3.88Å; W696-L716 HydrophobicContact CH2-CD2 3.81Å; W696-L716 HydrophobicContact CH2-CG 4.08Å; W696-L716 HydrophobicContact CZ2-CD1 4.12Å; W696-L716 HydrophobicContact CZ2-CD2 4.03Å; W696-L716 HydrophobicContact CZ2-CG 4.03Å
697	D	91.4	Very high	86.4	Confident	66 Å²	66	57 Å²	57	35%	0.353	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-41.8	179.9	-67.3	-26.2	0	0	0	110.2	W693 T701 R724	W693-D697 WeakPolarHBondContact O-CB 3.49Å; W693-D697 PolarHBondContact O-N 3.35Å; D697-T701 WeakPolarHBondContact O-CB 3.42Å; D697-T701 PolarHBondContact O-N 3.45Å; D697-T701 PolarHBondContact O-OG1 3.15Å; D697-R724 IonicContact OD1-NH2 3.88Å; D697-R724 PolarHBondContact OD1-NH2 3.33Å; D697-R724 IonicContact OD2-NH2 2.64Å
698	I	88.8	Confident	86.6	Confident	63 Å²	63	57.3 Å²	57.3	32%	0.323	29%	0.288	S	S	.	.	H	α-helix	trans	-61.7	-47.1	173.6	-64.1	165.8	0	0	0	111.2	L329 N694 L695 W696 N702	L329-I698 HydrophobicContact CD1-CB 4.48Å; L329-I698 HydrophobicContact CD1-CG2 3.61Å; N694-I698 WeakPolarHBondContact O-CD1 3.42Å; N694-I698 VanDerWaalsContact O-CG1 3.26Å; N694-I698 WeakPolarHBondContact O-CG1 3.21Å; N694-I698 PolarHBondContact O-N 3.26Å; L695-I698 HydrophobicContact CD2-CD1 4.48Å; L695-I698 PolarHBondContact O-N 2.67Å; W696-I698 VanDerWaalsContact C-N 3.3Å; W696-I698 PolarHBondContact O-N 3.24Å; I698-N702 WeakPolarHBondContact CG2-ND2 3.25Å; I698-N702 VanDerWaalsContact O-CB 3.22Å; I698-N702 WeakPolarHBondContact O-CB 3.5Å; I698-N702 PolarHBondContact O-N 3.49Å
699	Y	87.4	Confident	86.6	Confident	1 Å²	1	57 Å²	57	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-45.1	-179.7	-174.4	-114.4	0	0	0	111.9	V309 S313 L329 R330 F333 L695 W696 I703 L704	V309-Y699 HydrophobicContact CG1-CE1 4Å; S313-Y699 PolarHBondContact OG-OH 3.15Å; S313-Y699 VanDerWaalsContact OG-OH 3.1Å; L329-Y699 HydrophobicContact CB-CD2 3.59Å; L329-Y699 HydrophobicContact CB-CE2 4.33Å; L329-Y699 HydrophobicContact CB-CG 4.37Å; R330-Y699 HydrophobicContact CB-CE2 3.98Å; F333-Y699 AromaticContact CD2-CD1 3.81Å; F333-Y699 HydrophobicContact CD2-CD1 3.81Å; F333-Y699 HydrophobicContact CD2-CE1 4.35Å; F333-Y699 AromaticContact CD2-CG 3.91Å; F333-Y699 HydrophobicContact CD2-CG 3.91Å; F333-Y699 HydrophobicContact CE2-CD1 4.28Å; F333-Y699 HydrophobicContact CE2-CG 4.13Å; L695-Y699 WeakPolarHBondContact O-CB 3.39Å; L695-Y699 PolarHBondContact O-N 2.97Å; W696-Y699 HydrophobicContact CE3-CD1 4.15Å; W696-Y699 AromaticContact CZ3-CD1 3.84Å; W696-Y699 HydrophobicContact CZ3-CD1 3.84Å; W696-Y699 HydrophobicContact CZ3-CE1 4.45Å; W696-Y699 PolarHBondContact O-N 3.22Å; W696-Y699 VanDerWaalsContact O-N 3.15Å; Y699-I703 HydrophobicContact CD2-CB 4.17Å; Y699-I703 HydrophobicContact CD2-CD1 3.45Å; Y699-I703 VanDerWaalsContact CD2-CD1 3.45Å; Y699-I703 HydrophobicContact CD2-CG1 4.39Å; Y699-I703 HydrophobicContact CD2-CG2 4.44Å; Y699-I703 HydrophobicContact CE2-CB 4.15Å; Y699-I703 HydrophobicContact CE2-CD1 3.74Å; Y699-I703 HydrophobicContact CE2-CG2 3.91Å; Y699-I703 WeakPolarHBondContact O-CB 3.37Å; Y699-I703 PolarHBondContact O-N 3.34Å; Y699-L704 HydrophobicContact CD1-CD1 3.74Å; Y699-L704 HydrophobicContact CD1-CG 4.16Å; Y699-L704 HydrophobicContact CE1-CD1 3.53Å; Y699-L704 HydrophobicContact CE1-CD2 4.29Å; Y699-L704 HydrophobicContact CE1-CG 3.82Å; Y699-L704 PolarHBondContact O-N 3.31Å
700	Y	89.3	Confident	86.6	Confident	40 Å²	40	62.4 Å²	62.4	16%	0.157	31%	0.313	C	S	.	.	I	π-helix	trans	-61.7	-52.3	178	177.2	-100.6	0	0	0	111.1	W696 L704 S705 I713 L716	W696-Y700 HydrophobicContact CH2-CD2 4.3Å; W696-Y700 AromaticContact CZ2-CD2 3.83Å; W696-Y700 HydrophobicContact CZ2-CD2 3.83Å; W696-Y700 HydrophobicContact CZ2-CG 4.24Å; W696-Y700 WeakPolarHBondContact O-CB 3.38Å; W696-Y700 PolarHBondContact O-N 3.43Å; Y700-L704 PolarHBondContact O-N 2.9Å; Y700-S705 WeakPolarHBondContact O-CB 3.41Å; Y700-S705 PolarHBondContact O-N 3.24Å; Y700-I713 WeakPolarHBondContact OH-CG2 3.22Å; Y700-L716 HydrophobicContact CD2-CD2 4.08Å; Y700-L716 HydrophobicContact CE2-CD2 4.07Å
701	T	86.8	Confident	86.6	Confident	80 Å²	80	60.2 Å²	60.2	49%	0.491	31%	0.306	S	S	.	.	I	π-helix	trans	-71.9	-40	-175.9	-54	0	0	0	0	113.4	D697 S705	D697-T701 WeakPolarHBondContact O-CB 3.42Å; D697-T701 PolarHBondContact O-N 3.45Å; D697-T701 PolarHBondContact O-OG1 3.15Å; T701-S705 PolarHBondContact O-OG 3.39Å
702	N	83	Confident	86.7	Confident	110 Å²	110	57.6 Å²	57.6	59%	0.588	30%	0.295	S	S	*	.	I	π-helix	trans	-88.3	-25.9	-172.5	-66.4	-16.8	0	0	0	113.3	I698	I698-N702 WeakPolarHBondContact CG2-ND2 3.25Å; I698-N702 VanDerWaalsContact O-CB 3.22Å; I698-N702 WeakPolarHBondContact O-CB 3.5Å; I698-N702 PolarHBondContact O-N 3.49Å
703	I	79.5	Confident	86.7	Confident	14 Å²	14	59.2 Å²	59.2	7%	0.072	30%	0.304	C	S	.	.	I	π-helix	trans	-120.1	-48.8	-168.4	-63.3	157.5	0	0	0	111.5	C326 L329 Y699 R707	C326-I703 HydrophobicContact CB-CD1 3.97Å; C326-I703 HydrophobicContact CB-CG1 4.46Å; L329-I703 HydrophobicContact CB-CD1 4.32Å; L329-I703 HydrophobicContact CD1-CD1 3.95Å; Y699-I703 HydrophobicContact CD2-CB 4.17Å; Y699-I703 HydrophobicContact CD2-CD1 3.45Å; Y699-I703 VanDerWaalsContact CD2-CD1 3.45Å; Y699-I703 HydrophobicContact CD2-CG1 4.39Å; Y699-I703 HydrophobicContact CD2-CG2 4.44Å; Y699-I703 HydrophobicContact CE2-CB 4.15Å; Y699-I703 HydrophobicContact CE2-CD1 3.74Å; Y699-I703 HydrophobicContact CE2-CG2 3.91Å; Y699-I703 WeakPolarHBondContact O-CB 3.37Å; Y699-I703 PolarHBondContact O-N 3.34Å; I703-R707 WeakPolarHBondContact O-CD 3.18Å; I703-R707 PolarHBondContact O-NE 3.04Å
704	L	84.4	Confident	86.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.322	C	S	.	.	I	π-helix	trans	-87	-45.1	-172.6	-69	176.6	0	0	0	114	E312 W696 Y699 Y700 N706 R707 L708 L716	E312-L704 WeakPolarHBondContact O-CD2 3.38Å; W696-L704 HydrophobicContact CH2-CD1 3.84Å; W696-L704 HydrophobicContact CZ3-CD1 4.01Å; Y699-L704 HydrophobicContact CD1-CD1 3.74Å; Y699-L704 HydrophobicContact CD1-CG 4.16Å; Y699-L704 HydrophobicContact CE1-CD1 3.53Å; Y699-L704 HydrophobicContact CE1-CD2 4.29Å; Y699-L704 HydrophobicContact CE1-CG 3.82Å; Y699-L704 PolarHBondContact O-N 3.31Å; Y700-L704 PolarHBondContact O-N 2.9Å; L704-N706 PolarHBondContact O-N 3.31Å; L704-R707 PolarHBondContact O-N 2.7Å; L704-L708 HydrophobicContact CB-CD1 3.98Å; L704-L708 HydrophobicContact CB-CG 4.44Å; L704-L708 WeakPolarHBondContact O-CG 3.48Å; L704-L708 PolarHBondContact O-N 3.26Å; L704-L716 HydrophobicContact CD1-CD2 4.29Å
705	S	82.7	Confident	86.8	Confident	29 Å²	29	65.3 Å²	65.3	20%	0.203	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.8	-164.5	65.5	0	0	0	0	114.2	Y700 T701 R707	Y700-S705 WeakPolarHBondContact O-CB 3.41Å; Y700-S705 PolarHBondContact O-N 3.24Å; T701-S705 PolarHBondContact O-OG 3.39Å; S705-R707 VanDerWaalsContact C-N 3.32Å
706	N	81.2	Confident	86.9	Confident	144 Å²	144	63.6 Å²	63.6	77%	0.77	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.2	-179.3	-61.3	-22.2	0	0	0	113.5	L704	L704-N706 PolarHBondContact O-N 3.31Å
707	R	80.5	Confident	87	Confident	124 Å²	124	66.5 Å²	66.5	47%	0.468	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-21.5	-174.4	-60.1	-175	-175.3	-155.1	1.1	113.2	I703 L704 S705	I703-R707 WeakPolarHBondContact O-CD 3.18Å; I703-R707 PolarHBondContact O-NE 3.04Å; L704-R707 PolarHBondContact O-N 2.7Å; S705-R707 VanDerWaalsContact C-N 3.32Å
708	L	84.8	Confident	87.1	Confident	20 Å²	20	67.1 Å²	67.1	11%	0.105	34%	0.34	C	S	.	.	S	Bend	trans	-90.6	143.7	-174.1	-61	179.9	0	0	0	111.5	E312 L704 Q712 I713 L716	E312-L708 HydrophobicContact CB-CD1 4.43Å; E312-L708 HydrophobicContact CB-CD2 3.7Å; E312-L708 HydrophobicContact CG-CD2 4.2Å; E312-L708 WeakPolarHBondContact OE2-CD2 3.39Å; L704-L708 HydrophobicContact CB-CD1 3.98Å; L704-L708 HydrophobicContact CB-CG 4.44Å; L704-L708 WeakPolarHBondContact O-CG 3.48Å; L704-L708 PolarHBondContact O-N 3.26Å; L708-Q712 HydrophobicContact CB-CB 4.12Å; L708-Q712 HydrophobicContact CD2-CB 4.43Å; L708-I713 HydrophobicContact CB-CD1 4.25Å; L708-I713 HydrophobicContact CB-CG1 3.66Å; L708-I713 HydrophobicContact CD1-CG1 4.46Å; L708-L716 HydrophobicContact CD1-CD2 3.81Å
709	S	87.7	Confident	87.4	Confident	56 Å²	56	64.8 Å²	64.8	39%	0.392	33%	0.33	S	S	.	.			trans	-67.5	158.4	167.6	66.2	0	0	0	0	110.8	E711 Q712 I713	S709-E711 PolarHBondContact O-N 3.2Å; S709-Q712 PolarHBondContact O-N 3.33Å; S709-Q712 VanDerWaalsContact OG-CD 3.28Å; S709-Q712 VanDerWaalsContact OG-CG 3.3Å; S709-Q712 WeakPolarHBondContact OG-CG 3.23Å; S709-Q712 PolarHBondContact OG-N 2.91Å; S709-Q712 PolarHBondContact OG-OE1 3.41Å; S709-I713 WeakPolarHBondContact O-CG1 3.45Å; S709-I713 PolarHBondContact O-N 3.47Å
710	I	87.4	Confident	87.7	Confident	135 Å²	135	65 Å²	65	69%	0.692	33%	0.331	S	S	*	.	H	α-helix	trans	-53.9	-42.2	178.7	-61.9	171.2	0	0	0	111	Q712 I713 D714	I710-Q712 PolarHBondContact O-N 3.34Å; I710-I713 WeakPolarHBondContact O-CB 3.48Å; I710-I713 PolarHBondContact O-N 2.74Å; I710-D714 PolarHBondContact O-N 2.91Å
711	E	87.8	Confident	87.9	Confident	118 Å²	118	67.1 Å²	67.1	55%	0.551	34%	0.342	S	S	*	.	H	α-helix	trans	-65.7	-38.5	179.5	-170.5	179.3	-177.6	0	0	112.7	S709 D714 R715	S709-E711 PolarHBondContact O-N 3.2Å; E711-D714 PolarHBondContact O-N 2.93Å; E711-R715 VanDerWaalsContact O-CG 3.31Å; E711-R715 WeakPolarHBondContact O-CG 3.26Å; E711-R715 PolarHBondContact O-N 3.5Å; E711-R715 VanDerWaalsContact O-N 3.08Å; E711-R715 IonicContact OE1-CZ 3.06Å; E711-R715 IonicContact OE1-NE 3.92Å; E711-R715 IonicContact OE1-NH2 3.86Å; E711-R715 PolarHBondContact OE1-NH2 2.85Å
712	Q	90.2	Very high	88.3	Confident	58 Å²	58	68 Å²	68	27%	0.271	34%	0.34	S	S	.	.	H	α-helix	trans	-67.3	-41.8	175.8	-72.6	165.4	-49.1	0	0	111.3	E312 L708 S709 I710 R715 L716	E312-Q712 VanDerWaalsContact CD-NE2 3.3Å; E312-Q712 WeakPolarHBondContact OE1-CG 3.27Å; E312-Q712 PolarHBondContact OE1-NE2 3.1Å; E312-Q712 VanDerWaalsContact OE2-CD 3.29Å; E312-Q712 PolarHBondContact OE2-NE2 3.43Å; L708-Q712 HydrophobicContact CB-CB 4.12Å; L708-Q712 HydrophobicContact CD2-CB 4.43Å; S709-Q712 PolarHBondContact O-N 3.33Å; S709-Q712 VanDerWaalsContact OG-CD 3.28Å; S709-Q712 VanDerWaalsContact OG-CG 3.3Å; S709-Q712 WeakPolarHBondContact OG-CG 3.23Å; S709-Q712 PolarHBondContact OG-N 2.91Å; S709-Q712 PolarHBondContact OG-OE1 3.41Å; I710-Q712 PolarHBondContact O-N 3.34Å; Q712-R715 PolarHBondContact O-N 3.28Å; Q712-L716 VanDerWaalsContact O-CB 3.24Å; Q712-L716 WeakPolarHBondContact O-CB 3.49Å; Q712-L716 PolarHBondContact O-N 3.43Å
713	I	87.8	Confident	88.8	Confident	33 Å²	33	62.8 Å²	62.8	17%	0.169	31%	0.312	C	S	.	.	H	α-helix	trans	-57.6	-49.5	174.8	-71.3	171.1	0	0	0	110.3	Y700 L708 S709 I710 R715 L716 N717	Y700-I713 WeakPolarHBondContact OH-CG2 3.22Å; L708-I713 HydrophobicContact CB-CD1 4.25Å; L708-I713 HydrophobicContact CB-CG1 3.66Å; L708-I713 HydrophobicContact CD1-CG1 4.46Å; S709-I713 WeakPolarHBondContact O-CG1 3.45Å; S709-I713 PolarHBondContact O-N 3.47Å; I710-I713 WeakPolarHBondContact O-CB 3.48Å; I710-I713 PolarHBondContact O-N 2.74Å; I713-R715 PolarHBondContact O-N 3.01Å; I713-L716 PolarHBondContact O-N 3.16Å; I713-N717 VanDerWaalsContact CG2-ND2 3.3Å; I713-N717 WeakPolarHBondContact CG2-ND2 3.4Å; I713-N717 WeakPolarHBondContact O-CB 3.19Å; I713-N717 VanDerWaalsContact O-CG 3.23Å; I713-N717 PolarHBondContact O-N 3.33Å; I713-N717 PolarHBondContact O-ND2 3.41Å
714	D	90.7	Very high	89.5	Confident	92 Å²	92	65.7 Å²	65.7	49%	0.492	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-46.2	-178.9	-75.4	-17.9	0	0	0	112	I710 E711 L716 N717 V718	I710-D714 PolarHBondContact O-N 2.91Å; E711-D714 PolarHBondContact O-N 2.93Å; D714-L716 VanDerWaalsContact C-N 3.33Å; D714-L716 PolarHBondContact O-N 3.17Å; D714-N717 PolarHBondContact O-N 3.26Å; D714-V718 VanDerWaalsContact O-CG2 3.29Å; D714-V718 WeakPolarHBondContact O-CG2 3.4Å; D714-V718 PolarHBondContact O-N 2.87Å
715	R	91.9	Very high	89.9	Confident	149 Å²	149	70 Å²	70	56%	0.562	34%	0.342	S	S	*	.	H	α-helix	trans	-60.1	-43.9	177.2	-71.9	175.4	-174.9	-168.5	2.9	111.8	E711 Q712 I713 A719	E711-R715 VanDerWaalsContact O-CG 3.31Å; E711-R715 WeakPolarHBondContact O-CG 3.26Å; E711-R715 PolarHBondContact O-N 3.5Å; E711-R715 VanDerWaalsContact O-N 3.08Å; E711-R715 IonicContact OE1-CZ 3.06Å; E711-R715 IonicContact OE1-NE 3.92Å; E711-R715 IonicContact OE1-NH2 3.86Å; E711-R715 PolarHBondContact OE1-NH2 2.85Å; Q712-R715 PolarHBondContact O-N 3.28Å; I713-R715 PolarHBondContact O-N 3.01Å; R715-A719 PolarHBondContact O-N 3.47Å; R715-A719 VanDerWaalsContact O-N 3.08Å
716	L	91.8	Very high	90.4	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-66.9	-42.3	179.1	-179.7	61.6	0	0	0	111.7	L308 V309 W696 Y700 L704 L708 Q712 I713 D714 A719 T720	L308-L716 HydrophobicContact CB-CD1 4.15Å; V309-L716 HydrophobicContact CG2-CD1 3.9Å; W696-L716 HydrophobicContact CH2-CD1 3.88Å; W696-L716 HydrophobicContact CH2-CD2 3.81Å; W696-L716 HydrophobicContact CH2-CG 4.08Å; W696-L716 HydrophobicContact CZ2-CD1 4.12Å; W696-L716 HydrophobicContact CZ2-CD2 4.03Å; W696-L716 HydrophobicContact CZ2-CG 4.03Å; Y700-L716 HydrophobicContact CD2-CD2 4.08Å; Y700-L716 HydrophobicContact CE2-CD2 4.07Å; L704-L716 HydrophobicContact CD1-CD2 4.29Å; L708-L716 HydrophobicContact CD1-CD2 3.81Å; Q712-L716 VanDerWaalsContact O-CB 3.24Å; Q712-L716 WeakPolarHBondContact O-CB 3.49Å; Q712-L716 PolarHBondContact O-N 3.43Å; I713-L716 PolarHBondContact O-N 3.16Å; D714-L716 VanDerWaalsContact C-N 3.33Å; D714-L716 PolarHBondContact O-N 3.17Å; L716-A719 PolarHBondContact O-N 3.49Å; L716-T720 VanDerWaalsContact O-CB 3.3Å; L716-T720 WeakPolarHBondContact O-CB 3.43Å; L716-T720 PolarHBondContact O-N 3.05Å; L716-T720 PolarHBondContact O-OG1 3.4Å
717	N	92.2	Very high	91	Very high	63 Å²	63	62 Å²	62	34%	0.337	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-43.9	176.3	-76.1	-24.5	0	0	0	111.7	I713 D714 A719 T720 E721	I713-N717 VanDerWaalsContact CG2-ND2 3.3Å; I713-N717 WeakPolarHBondContact CG2-ND2 3.4Å; I713-N717 WeakPolarHBondContact O-CB 3.19Å; I713-N717 VanDerWaalsContact O-CG 3.23Å; I713-N717 PolarHBondContact O-N 3.33Å; I713-N717 PolarHBondContact O-ND2 3.41Å; D714-N717 PolarHBondContact O-N 3.26Å; N717-A719 VanDerWaalsContact C-N 3.34Å; N717-A719 PolarHBondContact O-N 3.05Å; N717-T720 WeakPolarHBondContact O-CB 3.33Å; N717-T720 PolarHBondContact O-N 3.04Å; N717-E721 WeakPolarHBondContact O-CB 3.16Å; N717-E721 PolarHBondContact O-N 3.1Å
718	V	93.4	Very high	91.5	Very high	80 Å²	80	59.8 Å²	59.8	49%	0.485	30%	0.297	S	S	.	.	H	α-helix	trans	-60.7	-43.8	175.7	169.6	0	0	0	0	111.3	D714 K722	D714-V718 VanDerWaalsContact O-CG2 3.29Å; D714-V718 WeakPolarHBondContact O-CG2 3.4Å; D714-V718 PolarHBondContact O-N 2.87Å; V718-K722 HydrophobicContact CG1-CD 4.5Å; V718-K722 WeakPolarHBondContact O-CG 3.48Å; V718-K722 PolarHBondContact O-N 3.4Å; V718-K722 VanDerWaalsContact O-N 3.13Å
719	A	93.8	Very high	91.9	Very high	13 Å²	13	62.5 Å²	62.5	11%	0.107	31%	0.309	C	S	.	.	H	α-helix	trans	-65.2	-42.4	176.5	0	0	0	0	0	111.9	W305 L308 R715 L716 N717 E721 K722 V723	W305-A719 HydrophobicContact CB-CB 4.25Å; L308-A719 HydrophobicContact CD1-CB 3.67Å; R715-A719 PolarHBondContact O-N 3.47Å; R715-A719 VanDerWaalsContact O-N 3.08Å; L716-A719 PolarHBondContact O-N 3.49Å; N717-A719 VanDerWaalsContact C-N 3.34Å; N717-A719 PolarHBondContact O-N 3.05Å; A719-E721 PolarHBondContact O-N 3.19Å; A719-K722 PolarHBondContact O-N 2.98Å; A719-V723 WeakPolarHBondContact O-CG2 3.48Å; A719-V723 PolarHBondContact O-N 2.97Å; A719-V723 VanDerWaalsContact O-N 3.16Å
720	T	93.7	Very high	92.1	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-47.6	177	-61.4	0	0	0	0	111.2	W305 W693 L716 N717 V723 R724	W305-T720 PolarHBondContact NE1-OG1 3.24Å; W693-T720 HydrophobicContact CH2-CG2 3.92Å; W693-T720 HydrophobicContact CZ3-CG2 3.58Å; L716-T720 VanDerWaalsContact O-CB 3.3Å; L716-T720 WeakPolarHBondContact O-CB 3.43Å; L716-T720 PolarHBondContact O-N 3.05Å; L716-T720 PolarHBondContact O-OG1 3.4Å; N717-T720 WeakPolarHBondContact O-CB 3.33Å; N717-T720 PolarHBondContact O-N 3.04Å; T720-V723 PolarHBondContact O-N 3.49Å; T720-R724 PolarHBondContact O-N 3.42Å
721	E	94	Very high	92.3	Very high	85 Å²	85	56.9 Å²	56.9	40%	0.397	28%	0.276	S	S	.	.	H	α-helix	trans	-66.8	-39	-178.3	-175.3	54.7	-152.7	0	0	112	N717 A719 V723 R724 Q725	N717-E721 WeakPolarHBondContact O-CB 3.16Å; N717-E721 PolarHBondContact O-N 3.1Å; A719-E721 PolarHBondContact O-N 3.19Å; E721-V723 VanDerWaalsContact C-N 3.33Å; E721-V723 PolarHBondContact O-N 3.01Å; E721-R724 WeakPolarHBondContact O-CB 3.39Å; E721-R724 PolarHBondContact O-N 3.37Å; E721-Q725 WeakPolarHBondContact O-CB 3.33Å; E721-Q725 VanDerWaalsContact O-CG 3.31Å; E721-Q725 WeakPolarHBondContact O-CG 3.1Å; E721-Q725 PolarHBondContact O-N 3.29Å; E721-Q725 WeakPolarHBondContact OE1-CG 3.32Å; E721-Q725 PolarHBondContact OE1-NE2 3.28Å
722	K	95.3	Very high	92.6	Very high	100 Å²	100	56.2 Å²	56.2	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-57.6	-46.6	172.4	-74.7	176.2	-179.1	-178.7	0	111.7	V718 A719 R724 Q725 T726	V718-K722 HydrophobicContact CG1-CD 4.5Å; V718-K722 WeakPolarHBondContact O-CG 3.48Å; V718-K722 PolarHBondContact O-N 3.4Å; V718-K722 VanDerWaalsContact O-N 3.13Å; A719-K722 PolarHBondContact O-N 2.98Å; K722-R724 PolarHBondContact O-N 3.38Å; K722-Q725 PolarHBondContact O-N 3.4Å; K722-T726 WeakPolarHBondContact O-CB 3.49Å; K722-T726 PolarHBondContact O-N 2.92Å; K722-T726 PolarHBondContact O-OG1 2.81Å
723	V	93.9	Very high	92.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-42.3	177.5	175.8	0	0	0	0	111.3	L298 E301 F302 W305 W693 A719 T720 E721 T726 F727	L298-V723 HydrophobicContact CD1-CG1 4.32Å; E301-V723 HydrophobicContact CB-CG2 4.1Å; F302-V723 HydrophobicContact CD2-CG1 3.94Å; W305-V723 HydrophobicContact CB-CG2 3.77Å; W305-V723 HydrophobicContact CG-CG2 4.16Å; W693-V723 HydrophobicContact CH2-CB 4.18Å; W693-V723 HydrophobicContact CH2-CG1 3.95Å; W693-V723 HydrophobicContact CZ2-CB 4.35Å; W693-V723 HydrophobicContact CZ2-CG1 3.87Å; A719-V723 WeakPolarHBondContact O-CG2 3.48Å; A719-V723 PolarHBondContact O-N 2.97Å; A719-V723 VanDerWaalsContact O-N 3.16Å; T720-V723 PolarHBondContact O-N 3.49Å; E721-V723 VanDerWaalsContact C-N 3.33Å; E721-V723 PolarHBondContact O-N 3.01Å; V723-T726 PolarHBondContact O-N 3.36Å; V723-F727 HydrophobicContact CG1-CD2 3.74Å; V723-F727 HydrophobicContact CG1-CE2 3.38Å; V723-F727 HydrophobicContact CG1-CZ 4.33Å; V723-F727 WeakPolarHBondContact O-CD2 3.28Å; V723-F727 PolarHBondContact O-N 2.97Å
724	R	93.2	Very high	93	Very high	75 Å²	75	54 Å²	54	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-58.5	-48	174.6	-78.9	-176.8	177.9	174.6	-1.9	112.4	W693 D697 T720 E721 K722 T726 F727 T728	W693-R724 HydrophobicContact CD2-CG 4.01Å; W693-R724 HydrophobicContact CE3-CG 4.33Å; W693-R724 HydrophobicContact CH2-CG 3.61Å; W693-R724 HydrophobicContact CZ2-CB 4.07Å; W693-R724 HydrophobicContact CZ2-CG 3.16Å; W693-R724 HydrophobicContact CZ3-CG 4.18Å; D697-R724 IonicContact OD1-NH2 3.88Å; D697-R724 PolarHBondContact OD1-NH2 3.33Å; D697-R724 IonicContact OD2-NH2 2.64Å; T720-R724 PolarHBondContact O-N 3.42Å; E721-R724 WeakPolarHBondContact O-CB 3.39Å; E721-R724 PolarHBondContact O-N 3.37Å; K722-R724 PolarHBondContact O-N 3.38Å; R724-T726 VanDerWaalsContact C-N 3.34Å; R724-T726 PolarHBondContact O-N 3.4Å; R724-F727 PolarHBondContact O-N 2.87Å; R724-T728 PolarHBondContact O-N 2.85Å; R724-T728 PolarHBondContact O-OG1 3.01Å
725	Q	93.7	Very high	93	Very high	91 Å²	91	53.3 Å²	53.3	43%	0.425	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-43.6	179.9	-72.7	176.8	6.8	0	0	111.1	E721 K722 T728 Q729	E721-Q725 WeakPolarHBondContact O-CB 3.33Å; E721-Q725 VanDerWaalsContact O-CG 3.31Å; E721-Q725 WeakPolarHBondContact O-CG 3.1Å; E721-Q725 PolarHBondContact O-N 3.29Å; E721-Q725 WeakPolarHBondContact OE1-CG 3.32Å; E721-Q725 PolarHBondContact OE1-NE2 3.28Å; K722-Q725 PolarHBondContact O-N 3.4Å; Q725-T728 WeakPolarHBondContact O-CB 3.04Å; Q725-T728 PolarHBondContact O-N 3.34Å; Q725-Q729 WeakPolarHBondContact O-CG 3.42Å; Q725-Q729 PolarHBondContact O-N 3.24Å
726	T	93.4	Very high	93.1	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-67.5	-38	-179.8	-58.4	0	0	0	0	112.1	T294 L298 E301 K722 V723 R724 Q729 L730	T294-T726 HydrophobicContact CG2-CG2 3.74Å; T294-T726 WeakPolarHBondContact O-CG2 3.46Å; L298-T726 HydrophobicContact CB-CG2 3.64Å; L298-T726 HydrophobicContact CD1-CG2 3.87Å; L298-T726 HydrophobicContact CG-CG2 4.34Å; E301-T726 WeakPolarHBondContact OE2-CB 3.21Å; E301-T726 PolarHBondContact OE2-OG1 2.66Å; K722-T726 WeakPolarHBondContact O-CB 3.49Å; K722-T726 PolarHBondContact O-N 2.92Å; K722-T726 PolarHBondContact O-OG1 2.81Å; V723-T726 PolarHBondContact O-N 3.36Å; R724-T726 VanDerWaalsContact C-N 3.34Å; R724-T726 PolarHBondContact O-N 3.4Å; T726-Q729 PolarHBondContact O-N 3.15Å; T726-L730 WeakPolarHBondContact O-CG 3.44Å; T726-L730 PolarHBondContact O-N 3.24Å
727	F	93.2	Very high	93	Very high	3 Å²	3	49.5 Å²	49.5	1%	0.013	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-44.7	169.8	-79.7	-53.9	0	0	0	112.5	L298 F302 Y671 L672 V689 M692 W693 V723 R724 Q729 L730 D731	L298-F727 HydrophobicContact CD1-CD1 4.05Å; L298-F727 HydrophobicContact CD1-CD2 4.28Å; L298-F727 HydrophobicContact CD1-CE1 3.83Å; L298-F727 HydrophobicContact CD1-CE2 4.11Å; L298-F727 HydrophobicContact CD1-CG 4.24Å; L298-F727 HydrophobicContact CD1-CZ 3.85Å; L298-F727 HydrophobicContact CD2-CD1 3.91Å; L298-F727 HydrophobicContact CD2-CE1 3.39Å; L298-F727 HydrophobicContact CD2-CZ 4.01Å; L298-F727 HydrophobicContact CG-CE1 4.2Å; L298-F727 HydrophobicContact CG-CZ 4.43Å; F302-F727 HydrophobicContact CD2-CE2 4.44Å; F302-F727 HydrophobicContact CD2-CZ 4.31Å; Y671-F727 AromaticContact CD2-CD1 3.69Å; Y671-F727 HydrophobicContact CD2-CD1 3.69Å; Y671-F727 AromaticContact CD2-CE1 3.9Å; Y671-F727 HydrophobicContact CD2-CE1 3.9Å; Y671-F727 HydrophobicContact CE2-CD1 4.33Å; Y671-F727 HydrophobicContact CG-CD1 4.29Å; Y671-F727 HydrophobicContact CG-CE1 4.16Å; L672-F727 HydrophobicContact CD1-CZ 4.01Å; L672-F727 HydrophobicContact CD2-CZ 3.86Å; L672-F727 HydrophobicContact CG-CE1 4.39Å; L672-F727 HydrophobicContact CG-CZ 4Å; V689-F727 HydrophobicContact CG1-CB 4.09Å; V689-F727 HydrophobicContact CG1-CD1 4.39Å; V689-F727 HydrophobicContact CG1-CD2 3.87Å; V689-F727 HydrophobicContact CG1-CE2 4.4Å; V689-F727 HydrophobicContact CG1-CG 3.87Å; V689-F727 HydrophobicContact CG2-CD1 3.76Å; V689-F727 HydrophobicContact CG2-CE1 4Å; V689-F727 HydrophobicContact CG2-CG 4.1Å; V689-F727 HydrophobicContact CG2-CZ 4.5Å; M692-F727 HydrophobicContact CE-CE2 4.3Å; W693-F727 HydrophobicContact CZ2-CD2 4.05Å; W693-F727 HydrophobicContact CZ2-CE2 4.29Å; V723-F727 HydrophobicContact CG1-CD2 3.74Å; V723-F727 HydrophobicContact CG1-CE2 3.38Å; V723-F727 HydrophobicContact CG1-CZ 4.33Å; V723-F727 WeakPolarHBondContact O-CD2 3.28Å; V723-F727 PolarHBondContact O-N 2.97Å; R724-F727 PolarHBondContact O-N 2.87Å; F727-Q729 VanDerWaalsContact C-N 3.3Å; F727-Q729 PolarHBondContact O-N 3.18Å; F727-L730 WeakPolarHBondContact O-CB 3.49Å; F727-L730 PolarHBondContact O-N 2.97Å; F727-D731 PolarHBondContact O-N 3.18Å
728	T	91.8	Very high	93	Very high	78 Å²	78	48.5 Å²	48.5	48%	0.479	25%	0.254	S	S	.	.	H	α-helix	trans	-62.4	-39.5	178.4	-53.3	0	0	0	0	111.3	R724 Q725 D731 N732	R724-T728 PolarHBondContact O-N 2.85Å; R724-T728 PolarHBondContact O-OG1 3.01Å; Q725-T728 WeakPolarHBondContact O-CB 3.04Å; Q725-T728 PolarHBondContact O-N 3.34Å; T728-D731 PolarHBondContact O-N 2.9Å; T728-N732 WeakPolarHBondContact O-CB 3.48Å; T728-N732 VanDerWaalsContact O-CG 3.22Å; T728-N732 PolarHBondContact O-N 3.42Å; T728-N732 PolarHBondContact O-ND2 3.4Å
729	Q	93.5	Very high	93	Very high	77 Å²	77	46.2 Å²	46.2	36%	0.36	25%	0.246	S	C	.	.	H	α-helix	trans	-63	-42	174.8	-73.9	174.7	4.7	0	0	111.9	T294 Q725 T726 F727 N732 I733	T294-Q729 HydrophobicContact CG2-CB 3.9Å; Q725-Q729 WeakPolarHBondContact O-CG 3.42Å; Q725-Q729 PolarHBondContact O-N 3.24Å; T726-Q729 PolarHBondContact O-N 3.15Å; F727-Q729 VanDerWaalsContact C-N 3.3Å; F727-Q729 PolarHBondContact O-N 3.18Å; Q729-N732 PolarHBondContact O-N 3.29Å; Q729-I733 WeakPolarHBondContact O-CD1 3.43Å; Q729-I733 WeakPolarHBondContact O-CG1 3.24Å; Q729-I733 PolarHBondContact O-N 3.22Å
730	L	92	Very high	92.9	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-47.5	175.3	-70	168.1	0	0	0	111.5	F291 T294 F295 L298 Y671 T726 F727 N732 I733 I734	F291-L730 HydrophobicContact CD2-CD2 3.61Å; F291-L730 HydrophobicContact CE2-CB 4.39Å; F291-L730 HydrophobicContact CE2-CD2 3.61Å; F291-L730 HydrophobicContact CG-CD2 4.25Å; F291-L730 HydrophobicContact CZ-CD2 4.24Å; T294-L730 HydrophobicContact CG2-CD2 3.7Å; T294-L730 HydrophobicContact CG2-CG 3.75Å; F295-L730 HydrophobicContact CB-CD2 4.07Å; F295-L730 HydrophobicContact CD2-CD1 4.12Å; L298-L730 HydrophobicContact CB-CD1 4.3Å; L298-L730 HydrophobicContact CD2-CD1 3.55Å; L298-L730 HydrophobicContact CG-CD1 4.38Å; Y671-L730 HydrophobicContact CD1-CD1 4.33Å; Y671-L730 HydrophobicContact CE1-CB 4.15Å; Y671-L730 HydrophobicContact CE1-CD1 4.32Å; Y671-L730 HydrophobicContact CE2-CB 4.4Å; T726-L730 WeakPolarHBondContact O-CG 3.44Å; T726-L730 PolarHBondContact O-N 3.24Å; F727-L730 WeakPolarHBondContact O-CB 3.49Å; F727-L730 PolarHBondContact O-N 2.97Å; L730-N732 VanDerWaalsContact C-N 3.32Å; L730-N732 PolarHBondContact O-N 2.93Å; L730-I733 PolarHBondContact O-N 3.25Å; L730-I733 VanDerWaalsContact O-N 3.16Å; L730-I734 WeakPolarHBondContact O-CG1 3.24Å; L730-I734 PolarHBondContact O-N 3.28Å
731	D	91.7	Very high	92.7	Very high	73 Å²	73	45.8 Å²	45.8	39%	0.39	24%	0.242	S	C	.	.	H	α-helix	trans	-61.8	-39.4	178.8	-73.3	-20.5	0	0	0	112.1	Y671 F727 T728 I734 S735	Y671-D731 WeakPolarHBondContact CE2-OD1 3.39Å; Y671-D731 PolarHBondContact OH-OD1 3.41Å; F727-D731 PolarHBondContact O-N 3.18Å; T728-D731 PolarHBondContact O-N 2.9Å; D731-I734 PolarHBondContact O-N 3.49Å; D731-S735 WeakPolarHBondContact O-CB 3.38Å; D731-S735 PolarHBondContact O-N 3.31Å
732	N	93.2	Very high	92.6	Very high	103 Å²	103	44.6 Å²	44.6	55%	0.551	24%	0.238	S	C	*	.	H	α-helix	trans	-63.5	-41.1	174.7	-73	-18	0	0	0	112.2	T728 Q729 L730 S735 D736	T728-N732 WeakPolarHBondContact O-CB 3.48Å; T728-N732 VanDerWaalsContact O-CG 3.22Å; T728-N732 PolarHBondContact O-N 3.42Å; T728-N732 PolarHBondContact O-ND2 3.4Å; Q729-N732 PolarHBondContact O-N 3.29Å; L730-N732 VanDerWaalsContact C-N 3.32Å; L730-N732 PolarHBondContact O-N 2.93Å; N732-S735 PolarHBondContact O-N 2.83Å; N732-D736 PolarHBondContact O-N 2.97Å
733	I	93.5	Very high	92.3	Very high	24 Å²	24	42.3 Å²	42.3	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-42.7	176.6	-69.5	164	0	0	0	110.8	S287 A290 F291 Q729 L730 S735 D736 I737	S287-I733 WeakPolarHBondContact O-CG2 3.31Å; A290-I733 HydrophobicContact CB-CD1 4.03Å; F291-I733 HydrophobicContact CB-CG2 3.83Å; F291-I733 HydrophobicContact CD2-CG2 4.26Å; Q729-I733 WeakPolarHBondContact O-CD1 3.43Å; Q729-I733 WeakPolarHBondContact O-CG1 3.24Å; Q729-I733 PolarHBondContact O-N 3.22Å; L730-I733 PolarHBondContact O-N 3.25Å; L730-I733 VanDerWaalsContact O-N 3.16Å; I733-S735 VanDerWaalsContact C-N 3.35Å; I733-D736 PolarHBondContact O-N 2.91Å; I733-I737 HydrophobicContact CG2-CD1 4.08Å; I733-I737 WeakPolarHBondContact O-CG1 3.47Å; I733-I737 PolarHBondContact O-N 3.2Å
734	I	92.2	Very high	91.9	Very high	20 Å²	20	42.3 Å²	42.3	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-42.2	175.5	-66	-53.1	0	0	0	111.2	F291 M345 L667 P668 L730 D731 D736 I737 D738	F291-I734 HydrophobicContact CD2-CD1 3.73Å; F291-I734 HydrophobicContact CD2-CG1 4.2Å; F291-I734 HydrophobicContact CE2-CD1 3.6Å; F291-I734 HydrophobicContact CE2-CG1 3.9Å; F291-I734 HydrophobicContact CZ-CD1 4.44Å; M345-I734 HydrophobicContact CE-CD1 3.61Å; M345-I734 HydrophobicContact SD-CD1 4.04Å; L667-I734 HydrophobicContact CB-CG2 4.24Å; L667-I734 HydrophobicContact CD1-CG2 4.34Å; P668-I734 HydrophobicContact CG-CD1 3.62Å; P668-I734 HydrophobicContact CG-CG1 4.2Å; L730-I734 WeakPolarHBondContact O-CG1 3.24Å; L730-I734 PolarHBondContact O-N 3.28Å; D731-I734 PolarHBondContact O-N 3.49Å; I734-D736 PolarHBondContact O-N 3.44Å; I734-I737 PolarHBondContact O-N 3.04Å; I734-D738 WeakPolarHBondContact O-CB 3.38Å; I734-D738 PolarHBondContact O-N 3.49Å
735	S	92.4	Very high	91.6	Very high	78 Å²	78	41.4 Å²	41.4	55%	0.545	24%	0.238	S	C	.	.	H	α-helix	trans	-62	-41	176.2	-172.1	0	0	0	0	112.3	D731 N732 I733 D738 G739	D731-S735 WeakPolarHBondContact O-CB 3.38Å; D731-S735 PolarHBondContact O-N 3.31Å; N732-S735 PolarHBondContact O-N 2.83Å; I733-S735 VanDerWaalsContact C-N 3.35Å; S735-D738 PolarHBondContact O-N 3.36Å; S735-G739 PolarHBondContact O-N 2.97Å
736	D	92.9	Very high	91.2	Very high	70 Å²	70	44.7 Å²	44.7	37%	0.374	25%	0.25	S	S	.	.	H	α-helix	trans	-64.8	-43.4	175.3	178.4	56.1	0	0	0	111.9	S287 N732 I733 I734 G739 N740	S287-D736 PolarHBondContact OG-OD2 3.19Å; N732-D736 PolarHBondContact O-N 2.97Å; I733-D736 PolarHBondContact O-N 2.91Å; I734-D736 PolarHBondContact O-N 3.44Å; D736-G739 PolarHBondContact O-N 3.38Å; D736-N740 WeakPolarHBondContact O-CB 3.38Å; D736-N740 PolarHBondContact O-N 3.35Å; D736-N740 PolarHBondContact O-ND2 3.29Å; D736-N740 PolarHBondContact OD1-ND2 2.99Å; D736-N740 PolarHBondContact OD2-ND2 2.82Å
737	I	90.9	Very high	90.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-45.7	174.7	-68.8	167.8	0	0	0	110.6	I284 M345 L667 I733 I734 G739 N740 L741	I284-I737 HydrophobicContact CG2-CG2 4.47Å; M345-I737 HydrophobicContact CE-CD1 3.22Å; M345-I737 HydrophobicContact SD-CD1 4.05Å; L667-I737 HydrophobicContact CD1-CG2 4.42Å; L667-I737 HydrophobicContact CD2-CG2 3.94Å; I733-I737 HydrophobicContact CG2-CD1 4.08Å; I733-I737 WeakPolarHBondContact O-CG1 3.47Å; I733-I737 PolarHBondContact O-N 3.2Å; I734-I737 PolarHBondContact O-N 3.04Å; I737-G739 PolarHBondContact O-N 3.3Å; I737-N740 PolarHBondContact O-N 3.49Å; I737-L741 HydrophobicContact CG2-CD1 3.82Å; I737-L741 HydrophobicContact CG2-CG 4.34Å; I737-L741 WeakPolarHBondContact O-CB 3.07Å; I737-L741 VanDerWaalsContact O-CG 3.27Å; I737-L741 WeakPolarHBondContact O-CG 2.99Å; I737-L741 PolarHBondContact O-N 2.97Å
738	D	91.8	Very high	90.1	Very high	43 Å²	43	52.9 Å²	52.9	23%	0.23	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-45.8	177.3	-166.4	55.3	0	0	0	111.5	R664 L667 I734 S735 N740 L741 I742	R664-D738 WeakPolarHBondContact CG-OD1 3.21Å; R664-D738 IonicContact CZ-OD1 3.72Å; R664-D738 IonicContact CZ-OD2 2.76Å; R664-D738 IonicContact NE-OD1 2.84Å; R664-D738 PolarHBondContact NE-OD1 3.15Å; R664-D738 IonicContact NE-OD2 2.88Å; R664-D738 IonicContact NH2-OD1 3.86Å; R664-D738 PolarHBondContact NH2-OD1 3.36Å; R664-D738 IonicContact NH2-OD2 3.68Å; R664-D738 PolarHBondContact NH2-OD2 2.97Å; L667-D738 HydrophobicContact CD1-CB 3.98Å; I734-D738 WeakPolarHBondContact O-CB 3.38Å; I734-D738 PolarHBondContact O-N 3.49Å; S735-D738 PolarHBondContact O-N 3.36Å; D738-N740 VanDerWaalsContact C-N 3.35Å; D738-N740 PolarHBondContact O-N 3.16Å; D738-L741 PolarHBondContact O-N 3.26Å; D738-I742 VanDerWaalsContact O-CG1 3.31Å; D738-I742 WeakPolarHBondContact O-CG1 3.22Å; D738-I742 PolarHBondContact O-N 3Å
739	G	92.9	Very high	89.5	Confident	31 Å²	31	55.6 Å²	55.6	32%	0.32	29%	0.292	S	S	.	.	H	α-helix	trans	-58.2	-43.9	175.9	0	0	0	0	0	112.8	S735 D736 I737 I742 V743	S735-G739 PolarHBondContact O-N 2.97Å; D736-G739 PolarHBondContact O-N 3.38Å; I737-G739 PolarHBondContact O-N 3.3Å; G739-I742 PolarHBondContact O-N 3.11Å; G739-V743 PolarHBondContact O-N 3.12Å
740	N	91.3	Very high	88.8	Confident	10 Å²	10	52 Å²	52	5%	0.053	28%	0.275	C	S	.	.	H	α-helix	trans	-67.5	-38.4	176.1	-70.7	-49.5	0	0	0	112	K280 I284 D736 I737 D738 I742 V743 L744	K280-N740 HydrophobicContact CD-CB 4.35Å; K280-N740 WeakPolarHBondContact CD-OD1 3.24Å; K280-N740 PolarHBondContact NZ-OD1 2.81Å; I284-N740 HydrophobicContact CD1-CB 3.92Å; I284-N740 HydrophobicContact CG1-CB 3.68Å; D736-N740 WeakPolarHBondContact O-CB 3.38Å; D736-N740 PolarHBondContact O-N 3.35Å; D736-N740 PolarHBondContact O-ND2 3.29Å; D736-N740 PolarHBondContact OD1-ND2 2.99Å; D736-N740 PolarHBondContact OD2-ND2 2.82Å; I737-N740 PolarHBondContact O-N 3.49Å; D738-N740 VanDerWaalsContact C-N 3.35Å; D738-N740 PolarHBondContact O-N 3.16Å; N740-I742 PolarHBondContact O-N 2.86Å; N740-V743 PolarHBondContact O-N 2.72Å; N740-L744 WeakPolarHBondContact O-CG 3.45Å; N740-L744 PolarHBondContact O-N 2.91Å
741	L	90.2	Very high	88.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.3	-35	174.8	-71.2	169.6	0	0	0	112.7	I284 F350 Y660 V663 R664 L667 I737 D738 V743 L744 S745	I284-L741 HydrophobicContact CD1-CD2 3.92Å; I284-L741 HydrophobicContact CD1-CG 4.12Å; F350-L741 HydrophobicContact CE1-CD2 4.45Å; F350-L741 HydrophobicContact CZ-CD2 3.94Å; Y660-L741 HydrophobicContact CD1-CD2 3.81Å; Y660-L741 HydrophobicContact CG-CD2 4.45Å; V663-L741 HydrophobicContact CG1-CD1 4.17Å; R664-L741 HydrophobicContact CG-CB 3.66Å; R664-L741 HydrophobicContact CG-CD1 3.66Å; R664-L741 HydrophobicContact CG-CG 4.28Å; L667-L741 HydrophobicContact CD1-CD1 4.25Å; I737-L741 HydrophobicContact CG2-CD1 3.82Å; I737-L741 HydrophobicContact CG2-CG 4.34Å; I737-L741 WeakPolarHBondContact O-CB 3.07Å; I737-L741 VanDerWaalsContact O-CG 3.27Å; I737-L741 WeakPolarHBondContact O-CG 2.99Å; I737-L741 PolarHBondContact O-N 2.97Å; D738-L741 PolarHBondContact O-N 3.26Å; L741-V743 VanDerWaalsContact C-N 3.33Å; L741-L744 PolarHBondContact O-N 3.17Å; L741-S745 WeakPolarHBondContact O-CB 3.35Å; L741-S745 PolarHBondContact O-N 2.84Å
742	I	90.6	Very high	87.9	Confident	59 Å²	59	54.2 Å²	54.2	30%	0.303	30%	0.297	S	S	.	.	H	α-helix	trans	-64.4	-37.8	173.5	-69.3	165.1	0	0	0	111.5	R664 D738 G739 N740 S745	R664-I742 VanDerWaalsContact CZ-CG1 3.45Å; D738-I742 VanDerWaalsContact O-CG1 3.31Å; D738-I742 WeakPolarHBondContact O-CG1 3.22Å; D738-I742 PolarHBondContact O-N 3Å; G739-I742 PolarHBondContact O-N 3.11Å; N740-I742 PolarHBondContact O-N 2.86Å; I742-S745 PolarHBondContact O-OG 3.48Å
743	V	89.2	Confident	87.4	Confident	52 Å²	52	52.4 Å²	52.4	32%	0.315	29%	0.285	S	S	.	.	H	α-helix	trans	-67.9	-44.8	175.5	176.5	0	0	0	0	109.9	T276 K280 G739 N740 L741 S745 K746	T276-V743 HydrophobicContact CG2-CG1 3.84Å; K280-V743 HydrophobicContact CD-CB 4.4Å; K280-V743 HydrophobicContact CD-CG1 4.31Å; K280-V743 HydrophobicContact CG-CB 4.48Å; K280-V743 HydrophobicContact CG-CG1 4.12Å; G739-V743 PolarHBondContact O-N 3.12Å; N740-V743 PolarHBondContact O-N 2.72Å; L741-V743 VanDerWaalsContact C-N 3.33Å; V743-S745 VanDerWaalsContact C-N 3.32Å; V743-S745 PolarHBondContact O-N 3.05Å; V743-K746 PolarHBondContact O-N 2.69Å
744	L	87.3	Confident	86.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-35.6	177.7	-70.7	177.5	0	0	0	112.8	L277 K280 I284 F350 Y660 N740 L741 K746 L747	L277-L744 HydrophobicContact CD1-CD2 3.76Å; K280-L744 HydrophobicContact CB-CD1 4.28Å; K280-L744 HydrophobicContact CB-CD2 3.77Å; K280-L744 HydrophobicContact CB-CG 3.9Å; K280-L744 HydrophobicContact CG-CD2 4.48Å; I284-L744 HydrophobicContact CD1-CD1 3.54Å; F350-L744 HydrophobicContact CE2-CD1 4.44Å; Y660-L744 HydrophobicContact CD1-CB 4.22Å; Y660-L744 HydrophobicContact CD1-CD1 4.49Å; Y660-L744 HydrophobicContact CD2-CB 4.04Å; Y660-L744 HydrophobicContact CE1-CB 4.04Å; Y660-L744 HydrophobicContact CE1-CD1 4.05Å; Y660-L744 HydrophobicContact CE2-CB 3.79Å; Y660-L744 WeakPolarHBondContact CE2-O 3.48Å; Y660-L744 HydrophobicContact CG-CB 4.21Å; N740-L744 WeakPolarHBondContact O-CG 3.45Å; N740-L744 PolarHBondContact O-N 2.91Å; L741-L744 PolarHBondContact O-N 3.17Å; L744-K746 PolarHBondContact O-N 2.9Å; L744-L747 HydrophobicContact CD2-CD1 3.63Å; L744-L747 WeakPolarHBondContact O-CB 3.48Å; L744-L747 PolarHBondContact O-N 3.22Å
745	S	85.6	Confident	86.6	Confident	57 Å²	57	52.9 Å²	52.9	40%	0.399	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-15.4	179	73.4	0	0	0	0	114.8	L741 I742 V743	L741-S745 WeakPolarHBondContact O-CB 3.35Å; L741-S745 PolarHBondContact O-N 2.84Å; I742-S745 PolarHBondContact O-OG 3.48Å; V743-S745 VanDerWaalsContact C-N 3.32Å; V743-S745 PolarHBondContact O-N 3.05Å
746	K	85.7	Confident	86.3	Confident	160 Å²	160	54.2 Å²	54.2	70%	0.696	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-13.1	174.3	-64.1	173.9	-176	177.7	0	113	V743 L744 K748	V743-K746 PolarHBondContact O-N 2.69Å; L744-K746 PolarHBondContact O-N 2.9Å; K746-K748 PolarHBondContact O-N 3.37Å
747	L	83.1	Confident	85.9	Confident	23 Å²	23	51.2 Å²	51.2	12%	0.12	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-68.6	131.2	179.5	-64.4	178.3	0	0	0	110	T276 L277 L744	T276-L747 HydrophobicContact CG2-CD1 4.35Å; T276-L747 HydrophobicContact CG2-CD2 4Å; L277-L747 HydrophobicContact CB-CD1 4.06Å; L277-L747 HydrophobicContact CD1-CD1 4.18Å; L744-L747 HydrophobicContact CD2-CD1 3.63Å; L744-L747 WeakPolarHBondContact O-CB 3.48Å; L744-L747 PolarHBondContact O-N 3.22Å
748	K	79.6	Confident	85.6	Confident	152 Å²	152	54 Å²	54	66%	0.661	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-88.3	157.8	174.4	-66.7	-179.8	-177.7	175.5	0	109.9	I657 K746 I750	I657-K748 WeakPolarHBondContact CD1-O 3.43Å; K746-K748 PolarHBondContact O-N 3.37Å; K748-I750 WeakPolarHBondContact O-CG1 3.1Å; K748-I750 PolarHBondContact O-N 3.28Å
749	K	80.5	Confident	85.4	Confident	135 Å²	135	58.3 Å²	58.3	59%	0.587	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-56.7	126.4	168.6	-74.7	-166	177.2	-167.3	0	110.4	D654	D654-K749 VanDerWaalsContact OD2-CB 3.28Å; D654-K749 WeakPolarHBondContact OD2-CB 3.47Å
750	I	79.1	Confident	85.1	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.01	30%	0.298	C	S	.	.			trans	-92.2	-24.6	-171.4	-48	178.2	0	0	0	110.4	L270 H273 V274 D654 I657 K748 P752 H753 V754	L270-I750 HydrophobicContact CD1-CB 4.48Å; L270-I750 HydrophobicContact CD1-CG2 3.03Å; L270-I750 HydrophobicContact CG-CG2 4.45Å; H273-I750 HydrophobicContact CB-CD1 3.6Å; H273-I750 HydrophobicContact CB-CG1 3.98Å; V274-I750 HydrophobicContact CG2-CD1 4.24Å; D654-I750 WeakPolarHBondContact OD1-CA 3.12Å; D654-I750 WeakPolarHBondContact OD1-CB 3.32Å; D654-I750 PolarHBondContact OD1-N 2.86Å; D654-I750 PolarHBondContact OD2-N 2.8Å; I657-I750 HydrophobicContact CD1-CG1 4.34Å; K748-I750 WeakPolarHBondContact O-CG1 3.1Å; K748-I750 PolarHBondContact O-N 3.28Å; I750-P752 VanDerWaalsContact C-CD 3.41Å; I750-P752 VanDerWaalsContact C-N 3.34Å; I750-P752 VanDerWaalsContact O-N 3.16Å; I750-H753 WeakPolarHBondContact O-CA 3.27Å; I750-H753 WeakPolarHBondContact O-CB 3.42Å; I750-H753 PolarHBondContact O-N 3.01Å; I750-V754 HydrophobicContact CG2-CG2 3.98Å; I750-V754 PolarHBondContact O-N 2.94Å
751	A	80.8	Confident	84.8	Confident	34 Å²	34	58.8 Å²	58.8	28%	0.281	30%	0.297	S	S	.	.	H	α-helix	trans	-51.8	-39.7	-177.9	0	0	0	0	0	114.7	D654 H753 V754 A755	D654-A751 PolarHBondContact OD1-N 2.87Å; D654-A751 WeakPolarHBondContact OD2-CB 3.16Å; D654-A751 PolarHBondContact OD2-N 3.35Å; A751-H753 VanDerWaalsContact C-N 3.32Å; A751-H753 PolarHBondContact O-N 2.85Å; A751-V754 PolarHBondContact O-N 3.39Å; A751-A755 WeakPolarHBondContact O-CB 3.1Å; A751-A755 PolarHBondContact O-N 3.32Å
752	P	84.3	Confident	84.7	Confident	86 Å²	86	63.9 Å²	63.9	56%	0.558	32%	0.323	S	S	*	.	H	α-helix	trans	-62.4	-37.9	174.5	-22.2	34.2	0	0	0	113.2	I750 K756	I750-P752 VanDerWaalsContact C-CD 3.41Å; I750-P752 VanDerWaalsContact C-N 3.34Å; I750-P752 VanDerWaalsContact O-N 3.16Å; P752-K756 WeakPolarHBondContact O-CB 3.2Å; P752-K756 PolarHBondContact O-N 3.5Å; P752-K756 VanDerWaalsContact O-N 3.08Å
753	H	82.2	Confident	84.5	Confident	64 Å²	64	64.4 Å²	64.4	30%	0.296	32%	0.324	S	S	.	.	H	α-helix	trans	-71.2	-40.6	177	-66.5	-71.9	0	0	0	111.4	I750 A751 K756 L757	I750-H753 WeakPolarHBondContact O-CA 3.27Å; I750-H753 WeakPolarHBondContact O-CB 3.42Å; I750-H753 PolarHBondContact O-N 3.01Å; A751-H753 VanDerWaalsContact C-N 3.32Å; A751-H753 PolarHBondContact O-N 2.85Å; H753-K756 PolarHBondContact O-N 3.35Å; H753-L757 WeakPolarHBondContact O-CB 2.93Å; H753-L757 PolarHBondContact O-N 2.81Å
754	V	83	Confident	84.4	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-48.7	173.7	174.5	0	0	0	0	110.8	L270 L647 A650 I750 A751 K756 L757 Q758	L270-V754 HydrophobicContact CD1-CG2 3.66Å; L270-V754 HydrophobicContact CD2-CG2 4.13Å; L647-V754 HydrophobicContact CB-CG1 4.34Å; L647-V754 WeakPolarHBondContact O-CG1 3.26Å; A650-V754 HydrophobicContact CB-CG2 4.28Å; I750-V754 HydrophobicContact CG2-CG2 3.98Å; I750-V754 PolarHBondContact O-N 2.94Å; A751-V754 PolarHBondContact O-N 3.39Å; V754-K756 VanDerWaalsContact C-N 3.29Å; V754-K756 PolarHBondContact O-N 3.44Å; V754-L757 PolarHBondContact O-N 3.44Å; V754-L757 VanDerWaalsContact O-N 3.16Å; V754-Q758 HydrophobicContact CG1-CG 4.11Å; V754-Q758 WeakPolarHBondContact O-CB 3.25Å; V754-Q758 WeakPolarHBondContact O-CG 3.46Å; V754-Q758 PolarHBondContact O-N 3.47Å
755	A	84.6	Confident	84.3	Confident	54 Å²	54	63 Å²	63	45%	0.446	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-40.7	179.5	0	0	0	0	0	111.5	A751 K759	A751-A755 WeakPolarHBondContact O-CB 3.1Å; A751-A755 PolarHBondContact O-N 3.32Å; A755-K759 WeakPolarHBondContact O-CB 3.33Å; A755-K759 PolarHBondContact O-N 3.46Å
756	K	86.1	Confident	84.5	Confident	106 Å²	106	64.8 Å²	64.8	46%	0.461	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-44	174.9	-166	-178.5	176.8	-160.6	0	111.6	E262 L266 P752 H753 V754 R760	E262-K756 WeakPolarHBondContact OE1-CE 3.32Å; E262-K756 IonicContact OE1-NZ 2.87Å; E262-K756 PolarHBondContact OE1-NZ 3.08Å; L266-K756 HydrophobicContact CD1-CB 4.31Å; L266-K756 HydrophobicContact CD1-CD 4.01Å; L266-K756 HydrophobicContact CD1-CG 3.91Å; L266-K756 HydrophobicContact CD2-CD 4.14Å; P752-K756 WeakPolarHBondContact O-CB 3.2Å; P752-K756 PolarHBondContact O-N 3.5Å; P752-K756 VanDerWaalsContact O-N 3.08Å; H753-K756 PolarHBondContact O-N 3.35Å; V754-K756 VanDerWaalsContact C-N 3.29Å; V754-K756 PolarHBondContact O-N 3.44Å; K756-R760 WeakPolarHBondContact O-CB 3.37Å; K756-R760 PolarHBondContact O-N 3.19Å
757	L	85	Confident	84.5	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-65.4	-47.1	177.8	178.3	56.4	0	0	0	111.8	A263 L266 L270 L647 H753 V754 K759 R760 L761	A263-L757 HydrophobicContact CB-CD1 4.15Å; A263-L757 WeakPolarHBondContact O-CD1 3.5Å; L266-L757 HydrophobicContact CB-CB 4.13Å; L266-L757 HydrophobicContact CB-CD1 4.02Å; L266-L757 HydrophobicContact CB-CG 4.47Å; L266-L757 HydrophobicContact CD1-CB 4.41Å; L270-L757 HydrophobicContact CD2-CD2 3.81Å; L647-L757 HydrophobicContact CD1-CD2 4.11Å; L647-L757 HydrophobicContact CD1-CG 4.16Å; L647-L757 HydrophobicContact CD2-CD2 3.6Å; L647-L757 HydrophobicContact CD2-CG 4.43Å; H753-L757 WeakPolarHBondContact O-CB 2.93Å; H753-L757 PolarHBondContact O-N 2.81Å; V754-L757 PolarHBondContact O-N 3.44Å; V754-L757 VanDerWaalsContact O-N 3.16Å; L757-K759 VanDerWaalsContact C-N 3.34Å; L757-K759 PolarHBondContact O-N 2.65Å; L757-R760 CarbonylContact O-C 3.54Å; L757-R760 PolarHBondContact O-N 3.19Å; L757-R760 VanDerWaalsContact O-N 3.09Å; L757-L761 HydrophobicContact CD1-CD1 4.14Å; L757-L761 HydrophobicContact CD1-CD2 4.48Å; L757-L761 HydrophobicContact CD1-CG 3.97Å; L757-L761 HydrophobicContact CG-CD1 4.09Å; L757-L761 HydrophobicContact CG-CG 4.35Å; L757-L761 WeakPolarHBondContact O-CB 3.49Å; L757-L761 WeakPolarHBondContact O-CG 2.92Å; L757-L761 PolarHBondContact O-N 3.22Å
758	Q	85.2	Confident	84.6	Confident	58 Å²	58	57.9 Å²	57.9	27%	0.271	29%	0.292	S	S	.	.	H	α-helix	trans	-58	-47.2	176.2	-76.5	-179.7	-32.7	0	0	111.2	L647 V754 R760 L761 I762	L647-Q758 HydrophobicContact CB-CG 4.12Å; L647-Q758 HydrophobicContact CD1-CG 4.32Å; V754-Q758 HydrophobicContact CG1-CG 4.11Å; V754-Q758 WeakPolarHBondContact O-CB 3.25Å; V754-Q758 WeakPolarHBondContact O-CG 3.46Å; V754-Q758 PolarHBondContact O-N 3.47Å; Q758-R760 VanDerWaalsContact C-N 3.29Å; Q758-R760 PolarHBondContact O-N 3.47Å; Q758-L761 PolarHBondContact O-N 3.12Å; Q758-I762 VanDerWaalsContact O-CG1 3.26Å; Q758-I762 WeakPolarHBondContact O-CG1 3.34Å; Q758-I762 PolarHBondContact O-N 3.29Å
759	K	87.6	Confident	84.9	Confident	134 Å²	134	55.1 Å²	55.1	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-57.1	-45.8	174.5	-178.4	178.3	173.9	-177	0	111	A755 L757 I762 E763	A755-K759 WeakPolarHBondContact O-CB 3.33Å; A755-K759 PolarHBondContact O-N 3.46Å; L757-K759 VanDerWaalsContact C-N 3.34Å; L757-K759 PolarHBondContact O-N 2.65Å; K759-I762 PolarHBondContact O-N 3.31Å; K759-E763 WeakPolarHBondContact CE-OE1 3.31Å; K759-E763 WeakPolarHBondContact O-CG 3.36Å; K759-E763 PolarHBondContact O-N 3.4Å
760	R	86.5	Confident	85.4	Confident	48 Å²	48	52.7 Å²	52.7	18%	0.181	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-38.5	-179.7	-163.3	56.1	165.8	157	2.3	112.7	E262 A263 K756 L757 Q758 E763 L764	E262-R760 IonicContact OE2-CZ 3.54Å; E262-R760 IonicContact OE2-NE 3.26Å; E262-R760 PolarHBondContact OE2-NE 2.91Å; E262-R760 IonicContact OE2-NH2 3.72Å; A263-R760 HydrophobicContact CB-CG 4.25Å; K756-R760 WeakPolarHBondContact O-CB 3.37Å; K756-R760 PolarHBondContact O-N 3.19Å; L757-R760 CarbonylContact O-C 3.54Å; L757-R760 PolarHBondContact O-N 3.19Å; L757-R760 VanDerWaalsContact O-N 3.09Å; Q758-R760 VanDerWaalsContact C-N 3.29Å; Q758-R760 PolarHBondContact O-N 3.47Å; R760-E763 IonicContact CZ-OE2 3.79Å; R760-E763 IonicContact NH1-OE2 2.75Å; R760-E763 PolarHBondContact NH1-OE2 3.38Å; R760-E763 PolarHBondContact O-N 2.87Å; R760-L764 WeakPolarHBondContact O-CB 3.3Å; R760-L764 PolarHBondContact O-N 2.95Å
761	L	85.8	Confident	85.8	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-66.3	-40	174.5	-72.4	177	0	0	0	111.5	A263 F639 L647 L757 Q758 L764 K765	A263-L761 HydrophobicContact CB-CD2 4.37Å; F639-L761 HydrophobicContact CD1-CD2 3.52Å; F639-L761 HydrophobicContact CD2-CD2 4.38Å; F639-L761 HydrophobicContact CE1-CD2 3.55Å; F639-L761 HydrophobicContact CE2-CD2 4.41Å; F639-L761 HydrophobicContact CG-CD2 3.95Å; F639-L761 HydrophobicContact CZ-CD2 4.01Å; L647-L761 HydrophobicContact CD1-CD1 3.31Å; L757-L761 HydrophobicContact CD1-CD1 4.14Å; L757-L761 HydrophobicContact CD1-CD2 4.48Å; L757-L761 HydrophobicContact CD1-CG 3.97Å; L757-L761 HydrophobicContact CG-CD1 4.09Å; L757-L761 HydrophobicContact CG-CG 4.35Å; L757-L761 WeakPolarHBondContact O-CB 3.49Å; L757-L761 WeakPolarHBondContact O-CG 2.92Å; L757-L761 PolarHBondContact O-N 3.22Å; Q758-L761 PolarHBondContact O-N 3.12Å; L761-L764 HydrophobicContact CD2-CD2 4.5Å; L761-L764 PolarHBondContact O-N 3.42Å; L761-K765 VanDerWaalsContact O-CB 3.26Å; L761-K765 WeakPolarHBondContact O-CB 3.31Å; L761-K765 WeakPolarHBondContact O-CG 3.27Å; L761-K765 PolarHBondContact O-N 2.95Å
762	I	86.4	Confident	86.2	Confident	107 Å²	107	58.1 Å²	58.1	55%	0.549	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-46.5	175	-68.7	163.4	0	0	0	110.8	Q758 K759 K765 T766	Q758-I762 VanDerWaalsContact O-CG1 3.26Å; Q758-I762 WeakPolarHBondContact O-CG1 3.34Å; Q758-I762 PolarHBondContact O-N 3.29Å; K759-I762 PolarHBondContact O-N 3.31Å; I762-K765 PolarHBondContact O-N 3.17Å; I762-T766 WeakPolarHBondContact O-CB 3.42Å; I762-T766 PolarHBondContact O-N 3.17Å; I762-T766 PolarHBondContact O-OG1 3.37Å
763	E	87.9	Confident	86.4	Confident	69 Å²	69	56.7 Å²	56.7	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-58.7	-48.2	175	-72.6	171.8	-174.2	0	0	111	K759 R760 T766 I767	K759-E763 WeakPolarHBondContact CE-OE1 3.31Å; K759-E763 WeakPolarHBondContact O-CG 3.36Å; K759-E763 PolarHBondContact O-N 3.4Å; R760-E763 IonicContact CZ-OE2 3.79Å; R760-E763 IonicContact NH1-OE2 2.75Å; R760-E763 PolarHBondContact NH1-OE2 3.38Å; R760-E763 PolarHBondContact O-N 2.87Å; E763-T766 WeakPolarHBondContact O-CB 3.48Å; E763-T766 PolarHBondContact O-N 2.81Å; E763-I767 WeakPolarHBondContact O-CG1 3.26Å; E763-I767 PolarHBondContact O-N 3.09Å
764	L	85.9	Confident	86.8	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-46.5	179.3	-178.5	63.8	0	0	0	111.8	I258 V260 F639 R760 L761 T766 I767 M768	I258-L764 HydrophobicContact CB-CD1 4.28Å; I258-L764 HydrophobicContact CD1-CD1 4.16Å; I258-L764 HydrophobicContact CG1-CD1 3.98Å; V260-L764 HydrophobicContact CG2-CD1 3.67Å; V260-L764 HydrophobicContact CG2-CD2 3.83Å; V260-L764 HydrophobicContact CG2-CG 4.4Å; F639-L764 HydrophobicContact CD2-CD2 4.38Å; F639-L764 HydrophobicContact CE2-CD2 3.47Å; F639-L764 VanDerWaalsContact CE2-CD2 3.47Å; F639-L764 HydrophobicContact CE2-CG 4.42Å; F639-L764 HydrophobicContact CZ-CD2 3.7Å; R760-L764 WeakPolarHBondContact O-CB 3.3Å; R760-L764 PolarHBondContact O-N 2.95Å; L761-L764 HydrophobicContact CD2-CD2 4.5Å; L761-L764 PolarHBondContact O-N 3.42Å; L764-T766 VanDerWaalsContact C-N 3.27Å; L764-T766 PolarHBondContact O-N 3.2Å; L764-I767 PolarHBondContact O-N 3.46Å; L764-M768 HydrophobicContact CD1-CG 3.89Å; L764-M768 HydrophobicContact CD1-SD 3.63Å; L764-M768 HydrophobicContact CD2-SD 4.22Å; L764-M768 HydrophobicContact CG-CG 4.25Å; L764-M768 HydrophobicContact CG-SD 3.65Å; L764-M768 WeakPolarHBondContact O-CB 3.33Å; L764-M768 VanDerWaalsContact O-CG 3.28Å; L764-M768 WeakPolarHBondContact O-CG 3.49Å; L764-M768 PolarHBondContact O-N 2.88Å
765	K	86.4	Confident	87.2	Confident	24 Å²	24	54.8 Å²	54.8	10%	0.104	28%	0.283	C	S	.	.	H	α-helix	trans	-58.4	-42	175.4	-74.1	-177.2	176	-170.3	0	110.8	V635 F639 D644 L761 I762 M768 N769	V635-K765 HydrophobicContact CG1-CB 4.03Å; V635-K765 HydrophobicContact CG1-CG 3.6Å; F639-K765 WeakPolarHBondContact O-CE 3.26Å; F639-K765 PolarHBondContact O-NZ 3.42Å; D644-K765 VanDerWaalsContact CG-NZ 3.27Å; D644-K765 IonicContact OD1-NZ 3.73Å; D644-K765 PolarHBondContact OD1-NZ 3.34Å; D644-K765 IonicContact OD2-NZ 2.75Å; D644-K765 PolarHBondContact OD2-NZ 3.38Å; L761-K765 VanDerWaalsContact O-CB 3.26Å; L761-K765 WeakPolarHBondContact O-CB 3.31Å; L761-K765 WeakPolarHBondContact O-CG 3.27Å; L761-K765 PolarHBondContact O-N 2.95Å; I762-K765 PolarHBondContact O-N 3.17Å; K765-M768 PolarHBondContact O-N 3.36Å; K765-N769 WeakPolarHBondContact O-CB 3.38Å; K765-N769 PolarHBondContact O-N 2.93Å; K765-N769 PolarHBondContact O-ND2 2.67Å
766	T	88.5	Confident	87.6	Confident	94 Å²	94	56.9 Å²	56.9	58%	0.577	29%	0.287	S	S	*	.	H	α-helix	trans	-62.8	-46.8	177.5	-55.8	0	0	0	0	111.5	I762 E763 L764 N770	I762-T766 WeakPolarHBondContact O-CB 3.42Å; I762-T766 PolarHBondContact O-N 3.17Å; I762-T766 PolarHBondContact O-OG1 3.37Å; E763-T766 WeakPolarHBondContact O-CB 3.48Å; E763-T766 PolarHBondContact O-N 2.81Å; L764-T766 VanDerWaalsContact C-N 3.27Å; L764-T766 PolarHBondContact O-N 3.2Å; T766-N770 PolarHBondContact O-N 3.02Å
767	I	86.8	Confident	87.8	Confident	32 Å²	32	56.7 Å²	56.7	16%	0.164	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-48.6	177.5	-66.7	166.2	0	0	0	110.5	I258 E763 L764 N769 N770 L774	I258-I767 HydrophobicContact CG2-CG2 4.38Å; E763-I767 WeakPolarHBondContact O-CG1 3.26Å; E763-I767 PolarHBondContact O-N 3.09Å; L764-I767 PolarHBondContact O-N 3.46Å; I767-N769 PolarHBondContact O-N 3.16Å; I767-N770 CarbonylContact O-C 3.56Å; I767-N770 PolarHBondContact O-N 3.39Å; I767-L774 HydrophobicContact CG2-CD1 4.27Å
768	M	85	Confident	88.2	Confident	5 Å²	5	56.4 Å²	56.4	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-75	-24.4	-174.2	-64.2	178.2	72.6	0	0	114	I633 V635 M638 L764 K765 K771	I633-M768 HydrophobicContact CG2-CE 3.38Å; V635-M768 HydrophobicContact CB-CB 4.46Å; V635-M768 HydrophobicContact CG1-CB 4.41Å; V635-M768 HydrophobicContact CG2-CB 3.24Å; V635-M768 HydrophobicContact CG2-CE 4.21Å; V635-M768 HydrophobicContact CG2-CG 4.39Å; V635-M768 HydrophobicContact CG2-SD 4.4Å; M638-M768 HydrophobicContact SD-CE 3.75Å; L764-M768 HydrophobicContact CD1-CG 3.89Å; L764-M768 HydrophobicContact CD1-SD 3.63Å; L764-M768 HydrophobicContact CD2-SD 4.22Å; L764-M768 HydrophobicContact CG-CG 4.25Å; L764-M768 HydrophobicContact CG-SD 3.65Å; L764-M768 WeakPolarHBondContact O-CB 3.33Å; L764-M768 VanDerWaalsContact O-CG 3.28Å; L764-M768 WeakPolarHBondContact O-CG 3.49Å; L764-M768 PolarHBondContact O-N 2.88Å; K765-M768 PolarHBondContact O-N 3.36Å; M768-K771 WeakPolarHBondContact O-CD 3.39Å; M768-K771 VanDerWaalsContact O-CE 3.3Å; M768-K771 WeakPolarHBondContact O-CE 3.18Å; M768-K771 PolarHBondContact O-NZ 3.37Å
769	N	86.3	Confident	88.6	Confident	94 Å²	94	55 Å²	55	50%	0.503	28%	0.276	S	S	.	.	H	α-helix	trans	-75.2	-32.4	171.1	-76.8	-19.5	0	0	0	111.7	V635 K765 I767 K771	V635-N769 WeakPolarHBondContact CG2-OD1 3.26Å; K765-N769 WeakPolarHBondContact O-CB 3.38Å; K765-N769 PolarHBondContact O-N 2.93Å; K765-N769 PolarHBondContact O-ND2 2.67Å; I767-N769 PolarHBondContact O-N 3.16Å; N769-K771 VanDerWaalsContact C-N 3.25Å; N769-K771 PolarHBondContact O-N 3.4Å
770	N	89.9	Confident	88.9	Confident	84 Å²	84	52 Å²	52	45%	0.449	27%	0.272	S	S	.	.			trans	-79.5	76.2	169.3	-169.7	-9.2	0	0	0	110.7	T766 I767 T772 D773 L774	T766-N770 PolarHBondContact O-N 3.02Å; I767-N770 CarbonylContact O-C 3.56Å; I767-N770 PolarHBondContact O-N 3.39Å; N770-T772 PolarHBondContact O-N 3.42Å; N770-D773 HydrophobicContact CB-CB 4.24Å; N770-D773 PolarHBondContact O-N 3.33Å; N770-D773 PolarHBondContact OD1-N 3.46Å; N770-L774 PolarHBondContact O-N 2.97Å
771	K	87.3	Confident	89.2	Confident	56 Å²	56	50.6 Å²	50.6	24%	0.243	27%	0.268	C	S	.	.	H	α-helix	trans	-50.9	-36.2	-177.9	-63.8	-58.6	-178.6	-164.9	0	113.6	I633 M768 N769 I775	I633-K771 WeakPolarHBondContact O-CE 3.41Å; I633-K771 PolarHBondContact O-NZ 3.41Å; M768-K771 WeakPolarHBondContact O-CD 3.39Å; M768-K771 VanDerWaalsContact O-CE 3.3Å; M768-K771 WeakPolarHBondContact O-CE 3.18Å; M768-K771 PolarHBondContact O-NZ 3.37Å; N769-K771 VanDerWaalsContact C-N 3.25Å; N769-K771 PolarHBondContact O-N 3.4Å; K771-I775 WeakPolarHBondContact O-CB 3.44Å; K771-I775 WeakPolarHBondContact O-CD1 3.5Å; K771-I775 WeakPolarHBondContact O-CG1 3.44Å; K771-I775 PolarHBondContact O-N 3.31Å
772	T	89.7	Confident	89.5	Confident	94 Å²	94	50.9 Å²	50.9	58%	0.577	27%	0.269	S	S	*	.	H	α-helix	trans	-66.8	-46.1	-179.9	-51.6	0	0	0	0	111.5	N770 I775 N776	N770-T772 PolarHBondContact O-N 3.42Å; T772-I775 PolarHBondContact O-N 2.93Å; T772-N776 WeakPolarHBondContact O-CB 3.47Å; T772-N776 PolarHBondContact O-N 2.79Å; T772-N776 PolarHBondContact O-ND2 2.67Å
773	D	89	Confident	89.9	Confident	56 Å²	56	48.3 Å²	48.3	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-66.7	-42.9	177.9	-169.2	50.4	0	0	0	111.7	N770 I775 N776 R777	N770-D773 HydrophobicContact CB-CB 4.24Å; N770-D773 PolarHBondContact O-N 3.33Å; N770-D773 PolarHBondContact OD1-N 3.46Å; D773-I775 PolarHBondContact O-N 2.96Å; D773-N776 PolarHBondContact O-N 3.29Å; D773-R777 WeakPolarHBondContact O-CG 3.35Å; D773-R777 PolarHBondContact O-N 2.99Å; D773-R777 IonicContact OD1-NE 2.87Å; D773-R777 IonicContact OD2-CZ 3.17Å; D773-R777 IonicContact OD2-NE 2.67Å; D773-R777 PolarHBondContact OD2-NE 2.88Å; D773-R777 IonicContact OD2-NH2 3.57Å
774	L	89.8	Confident	90	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-47.8	176.1	177.9	65.2	0	0	0	111.7	I258 L630 I767 N770 R777 A778	I258-L774 HydrophobicContact CD1-CD1 4.48Å; I258-L774 HydrophobicContact CG2-CD1 4.1Å; L630-L774 HydrophobicContact CB-CD2 4.45Å; L630-L774 HydrophobicContact CD2-CD2 4.2Å; L630-L774 HydrophobicContact CD2-CG 4.49Å; I767-L774 HydrophobicContact CG2-CD1 4.27Å; N770-L774 PolarHBondContact O-N 2.97Å; L774-R777 PolarHBondContact O-N 3.41Å; L774-A778 VanDerWaalsContact O-CB 3.31Å; L774-A778 WeakPolarHBondContact O-CB 3.25Å; L774-A778 PolarHBondContact O-N 2.87Å
775	I	91.9	Very high	90.2	Very high	23 Å²	23	53.3 Å²	53.3	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-64	-44.6	179	-71.1	165.4	0	0	0	110.4	I627 L630 R631 K771 T772 D773 R777 A778 V779	I627-I775 HydrophobicContact CG1-CG2 4.14Å; I627-I775 HydrophobicContact CG2-CD1 4.38Å; I627-I775 HydrophobicContact CG2-CG2 4.39Å; L630-I775 HydrophobicContact CB-CG1 4.35Å; R631-I775 HydrophobicContact CG-CD1 3.74Å; K771-I775 WeakPolarHBondContact O-CB 3.44Å; K771-I775 WeakPolarHBondContact O-CD1 3.5Å; K771-I775 WeakPolarHBondContact O-CG1 3.44Å; K771-I775 PolarHBondContact O-N 3.31Å; T772-I775 PolarHBondContact O-N 2.93Å; D773-I775 PolarHBondContact O-N 2.96Å; I775-R777 VanDerWaalsContact C-N 3.35Å; I775-R777 PolarHBondContact O-N 3.18Å; I775-A778 PolarHBondContact O-N 3.03Å; I775-V779 HydrophobicContact CG2-CG2 4.15Å; I775-V779 VanDerWaalsContact O-CB 3.32Å; I775-V779 WeakPolarHBondContact O-CB 3.41Å; I775-V779 VanDerWaalsContact O-CG2 3.26Å; I775-V779 WeakPolarHBondContact O-CG2 3.12Å; I775-V779 PolarHBondContact O-N 2.69Å
776	N	92.4	Very high	90.4	Very high	99 Å²	99	52.8 Å²	52.8	53%	0.529	28%	0.278	S	S	.	.	H	α-helix	trans	-61.4	-42.7	179.4	-72.6	-18.8	0	0	0	112	T772 D773 S780	T772-N776 WeakPolarHBondContact O-CB 3.47Å; T772-N776 PolarHBondContact O-N 2.79Å; T772-N776 PolarHBondContact O-ND2 2.67Å; D773-N776 PolarHBondContact O-N 3.29Å; N776-S780 WeakPolarHBondContact O-CB 3.46Å; N776-S780 PolarHBondContact O-N 2.94Å
777	R	91.6	Very high	90.5	Very high	102 Å²	102	52.4 Å²	52.4	39%	0.385	27%	0.269	S	S	.	.	H	α-helix	trans	-62.3	-49.6	173.7	-74.9	172.9	179.9	-100	-2.5	111.9	D257 D773 L774 I775 V779 S780 L781	D257-R777 IonicContact OD2-NH1 2.98Å; D773-R777 WeakPolarHBondContact O-CG 3.35Å; D773-R777 PolarHBondContact O-N 2.99Å; D773-R777 IonicContact OD1-NE 2.87Å; D773-R777 IonicContact OD2-CZ 3.17Å; D773-R777 IonicContact OD2-NE 2.67Å; D773-R777 PolarHBondContact OD2-NE 2.88Å; D773-R777 IonicContact OD2-NH2 3.57Å; L774-R777 PolarHBondContact O-N 3.41Å; I775-R777 VanDerWaalsContact C-N 3.35Å; I775-R777 PolarHBondContact O-N 3.18Å; R777-V779 VanDerWaalsContact C-N 3.32Å; R777-V779 PolarHBondContact O-N 3.41Å; R777-S780 WeakPolarHBondContact O-CB 3.22Å; R777-S780 PolarHBondContact O-N 3.36Å; R777-L781 WeakPolarHBondContact O-CG 3.43Å; R777-L781 PolarHBondContact O-N 3.4Å
778	A	92.6	Very high	90.5	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-42	179.5	0	0	0	0	0	112	F250 L254 M626 L630 L774 I775 L781 F782	F250-A778 HydrophobicContact CZ-CB 4.23Å; L254-A778 HydrophobicContact CD1-CB 3.98Å; L254-A778 HydrophobicContact CD2-CB 4.37Å; M626-A778 HydrophobicContact CE-CB 4.22Å; M626-A778 HydrophobicContact SD-CB 4.11Å; L630-A778 HydrophobicContact CD1-CB 3.28Å; L774-A778 VanDerWaalsContact O-CB 3.31Å; L774-A778 WeakPolarHBondContact O-CB 3.25Å; L774-A778 PolarHBondContact O-N 2.87Å; I775-A778 PolarHBondContact O-N 3.03Å; A778-L781 PolarHBondContact O-N 3Å; A778-F782 VanDerWaalsContact O-CB 3.24Å; A778-F782 WeakPolarHBondContact O-CB 3.23Å; A778-F782 PolarHBondContact O-N 2.87Å
779	V	93.5	Very high	90.7	Very high	27 Å²	27	57.4 Å²	57.4	16%	0.164	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-45.4	174.5	163.1	0	0	0	0	111.3	M626 I627 I775 R777 L781 F782 D783	M626-V779 HydrophobicContact CE-CG2 3.88Å; I627-V779 HydrophobicContact CD1-CG2 4.07Å; I627-V779 HydrophobicContact CG1-CG2 4.18Å; I775-V779 HydrophobicContact CG2-CG2 4.15Å; I775-V779 VanDerWaalsContact O-CB 3.32Å; I775-V779 WeakPolarHBondContact O-CB 3.41Å; I775-V779 VanDerWaalsContact O-CG2 3.26Å; I775-V779 WeakPolarHBondContact O-CG2 3.12Å; I775-V779 PolarHBondContact O-N 2.69Å; R777-V779 VanDerWaalsContact C-N 3.32Å; R777-V779 PolarHBondContact O-N 3.41Å; V779-L781 PolarHBondContact O-N 3.35Å; V779-F782 PolarHBondContact O-N 3.01Å; V779-D783 WeakPolarHBondContact O-CB 3.2Å; V779-D783 VanDerWaalsContact O-CG 3.31Å; V779-D783 PolarHBondContact O-N 3.2Å
780	S	94.5	Very high	90.7	Very high	71 Å²	71	53.8 Å²	53.8	50%	0.497	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-45.7	176.6	-174	0	0	0	0	111.7	N776 R777 D783 Q784	N776-S780 WeakPolarHBondContact O-CB 3.46Å; N776-S780 PolarHBondContact O-N 2.94Å; R777-S780 WeakPolarHBondContact O-CB 3.22Å; R777-S780 PolarHBondContact O-N 3.36Å; S780-D783 PolarHBondContact O-N 3.02Å; S780-Q784 WeakPolarHBondContact O-CB 3.34Å; S780-Q784 PolarHBondContact O-N 3.34Å
781	L	92.6	Very high	90.6	Very high	19 Å²	19	51.9 Å²	51.9	10%	0.099	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-38.6	177.5	-69.3	170.8	0	0	0	111.8	F250 I253 L254 D257 R777 A778 V779 Q784 H785	F250-L781 HydrophobicContact CE2-CB 3.97Å; I253-L781 HydrophobicContact CG2-CB 4.49Å; I253-L781 HydrophobicContact CG2-CD1 4.3Å; I253-L781 HydrophobicContact CG2-CD2 4Å; I253-L781 HydrophobicContact CG2-CG 4.5Å; L254-L781 HydrophobicContact CD1-CD1 4.06Å; D257-L781 HydrophobicContact CB-CD1 3.84Å; R777-L781 WeakPolarHBondContact O-CG 3.43Å; R777-L781 PolarHBondContact O-N 3.4Å; A778-L781 PolarHBondContact O-N 3Å; V779-L781 PolarHBondContact O-N 3.35Å; L781-Q784 PolarHBondContact O-N 2.9Å; L781-H785 WeakPolarHBondContact O-CB 3.43Å; L781-H785 PolarHBondContact O-CD2 2.85Å; L781-H785 PolarHBondContact O-N 3.2Å
782	F	92.5	Very high	90.6	Very high	10 Å²	10	52.6 Å²	52.6	4%	0.044	28%	0.284	C	S	.	.	H	α-helix	trans	-65.4	-45	178.2	-175.3	-85.6	0	0	0	110.6	F250 I619 K623 M626 A778 V779 Q784 I786 K787	F250-F782 HydrophobicContact CD2-CB 4.38Å; F250-F782 HydrophobicContact CD2-CD2 4.27Å; F250-F782 HydrophobicContact CE2-CB 3.73Å; F250-F782 HydrophobicContact CE2-CD2 4.24Å; F250-F782 HydrophobicContact CZ-CB 4.14Å; F250-F782 HydrophobicContact CZ-CD2 4.47Å; I619-F782 HydrophobicContact CG2-CE1 3.89Å; K623-F782 HydrophobicContact CB-CD1 4.19Å; K623-F782 HydrophobicContact CB-CE1 3.79Å; K623-F782 HydrophobicContact CB-CZ 4.14Å; K623-F782 HydrophobicContact CD-CD1 4.37Å; K623-F782 HydrophobicContact CG-CD1 4.25Å; K623-F782 HydrophobicContact CG-CE1 4.34Å; M626-F782 HydrophobicContact CE-CB 4.31Å; M626-F782 HydrophobicContact SD-CB 3.94Å; M626-F782 HydrophobicContact SD-CD2 3.81Å; M626-F782 HydrophobicContact SD-CG 4.14Å; A778-F782 VanDerWaalsContact O-CB 3.24Å; A778-F782 WeakPolarHBondContact O-CB 3.23Å; A778-F782 PolarHBondContact O-N 2.87Å; V779-F782 PolarHBondContact O-N 3.01Å; F782-Q784 VanDerWaalsContact C-N 3.32Å; F782-Q784 PolarHBondContact O-N 2.87Å; F782-I786 HydrophobicContact CD1-CB 4.36Å; F782-I786 HydrophobicContact CD2-CB 3.89Å; F782-I786 HydrophobicContact CD2-CG1 3.89Å; F782-I786 HydrophobicContact CD2-CG2 4.19Å; F782-I786 HydrophobicContact CE1-CB 4.33Å; F782-I786 HydrophobicContact CE1-CG2 4.24Å; F782-I786 HydrophobicContact CE2-CB 3.87Å; F782-I786 HydrophobicContact CE2-CG1 4.13Å; F782-I786 HydrophobicContact CE2-CG2 3.63Å; F782-I786 HydrophobicContact CG-CB 4.14Å; F782-I786 HydrophobicContact CG-CG1 4.4Å; F782-I786 HydrophobicContact CZ-CB 4.09Å; F782-I786 HydrophobicContact CZ-CG2 3.65Å; F782-I786 WeakPolarHBondContact O-CA 3.46Å; F782-I786 WeakPolarHBondContact O-CB 3.36Å; F782-I786 PolarHBondContact O-N 3.49Å; F782-K787 PolarHBondContact O-N 3.49Å
783	D	92.9	Very high	90.5	Very high	54 Å²	54	49.6 Å²	49.6	29%	0.289	26%	0.263	S	S	.	.	I	π-helix	trans	-64.2	-39.3	177.8	-71.3	-22.9	0	0	0	110.8	K623 V779 S780 A788	K623-D783 VanDerWaalsContact NZ-CG 3.26Å; K623-D783 IonicContact NZ-OD1 2.94Å; K623-D783 PolarHBondContact NZ-OD1 3.28Å; K623-D783 IonicContact NZ-OD2 3.05Å; K623-D783 PolarHBondContact NZ-OD2 2.98Å; V779-D783 WeakPolarHBondContact O-CB 3.2Å; V779-D783 VanDerWaalsContact O-CG 3.31Å; V779-D783 PolarHBondContact O-N 3.2Å; S780-D783 PolarHBondContact O-N 3.02Å; D783-A788 PolarHBondContact O-N 3.39Å
784	Q	91.2	Very high	90.4	Very high	122 Å²	122	47.8 Å²	47.8	57%	0.57	26%	0.256	S	S	*	.	I	π-helix	trans	-71.7	-40.6	179.3	-175.1	176.3	1.3	0	0	113.8	S780 L781 F782	S780-Q784 WeakPolarHBondContact O-CB 3.34Å; S780-Q784 PolarHBondContact O-N 3.34Å; L781-Q784 PolarHBondContact O-N 2.9Å; F782-Q784 VanDerWaalsContact C-N 3.32Å; F782-Q784 PolarHBondContact O-N 2.87Å
785	H	90.6	Very high	90.3	Very high	51 Å²	51	50.8 Å²	50.8	24%	0.236	27%	0.27	C	S	.	.	I	π-helix	trans	-108.1	-31	-169.2	-68.1	-74.3	0	0	0	114.6	I253 L781 K789	I253-H785 HydrophobicContact CD1-CB 3.9Å; L781-H785 WeakPolarHBondContact O-CB 3.43Å; L781-H785 PolarHBondContact O-CD2 2.85Å; L781-H785 PolarHBondContact O-N 3.2Å; H785-K789 WeakPolarHBondContact O-CB 3.41Å; H785-K789 VanDerWaalsContact O-CD 3.24Å; H785-K789 WeakPolarHBondContact O-CD 3.49Å; H785-K789 WeakPolarHBondContact O-CG 3.19Å
786	I	90.2	Very high	90.2	Very high	13 Å²	13	55 Å²	55	7%	0.067	29%	0.288	C	S	.	.	I	π-helix	trans	-100.7	-58.6	-176.3	-53.8	-56.6	0	0	0	110.1	M246 F250 F782 A788 K789 T790	M246-I786 HydrophobicContact CB-CD1 4.3Å; M246-I786 HydrophobicContact CE-CB 4.31Å; M246-I786 HydrophobicContact CE-CD1 3.5Å; M246-I786 VanDerWaalsContact CE-CD1 3.5Å; M246-I786 HydrophobicContact CE-CG1 4.48Å; M246-I786 HydrophobicContact CE-CG2 4.08Å; M246-I786 HydrophobicContact SD-CD1 4.45Å; F250-I786 HydrophobicContact CB-CD1 3.84Å; F250-I786 HydrophobicContact CB-CG1 3.97Å; F250-I786 HydrophobicContact CD2-CD1 4.45Å; F250-I786 HydrophobicContact CD2-CG1 3.81Å; F250-I786 HydrophobicContact CG-CG1 4.15Å; F782-I786 HydrophobicContact CD1-CB 4.36Å; F782-I786 HydrophobicContact CD2-CB 3.89Å; F782-I786 HydrophobicContact CD2-CG1 3.89Å; F782-I786 HydrophobicContact CD2-CG2 4.19Å; F782-I786 HydrophobicContact CE1-CB 4.33Å; F782-I786 HydrophobicContact CE1-CG2 4.24Å; F782-I786 HydrophobicContact CE2-CB 3.87Å; F782-I786 HydrophobicContact CE2-CG1 4.13Å; F782-I786 HydrophobicContact CE2-CG2 3.63Å; F782-I786 HydrophobicContact CG-CB 4.14Å; F782-I786 HydrophobicContact CG-CG1 4.4Å; F782-I786 HydrophobicContact CZ-CB 4.09Å; F782-I786 HydrophobicContact CZ-CG2 3.65Å; F782-I786 WeakPolarHBondContact O-CA 3.46Å; F782-I786 WeakPolarHBondContact O-CB 3.36Å; F782-I786 PolarHBondContact O-N 3.49Å; I786-A788 VanDerWaalsContact C-N 3.29Å; I786-A788 PolarHBondContact O-N 3.34Å; I786-K789 PolarHBondContact O-N 3.07Å; I786-T790 PolarHBondContact O-N 3.49Å; I786-T790 PolarHBondContact O-OG1 3.44Å
787	K	89.7	Confident	90.1	Very high	87 Å²	87	51.3 Å²	51.3	38%	0.378	27%	0.268	S	S	.	.	I	π-helix	trans	-55	-43.2	-179.6	177.3	170	-176.2	176.1	0	112.6	I619 F782 P791	I619-K787 HydrophobicContact CD1-CG 4.26Å; I619-K787 HydrophobicContact CG2-CB 3.86Å; I619-K787 HydrophobicContact CG2-CD 4.12Å; I619-K787 HydrophobicContact CG2-CG 3.81Å; F782-K787 PolarHBondContact O-N 3.49Å; K787-P791 WeakPolarHBondContact O-CD 3.47Å
788	A	87.5	Confident	89.9	Confident	65 Å²	65	48 Å²	48	54%	0.537	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-30.8	179	0	0	0	0	0	113.9	D783 I786	D783-A788 PolarHBondContact O-N 3.39Å; I786-A788 VanDerWaalsContact C-N 3.29Å; I786-A788 PolarHBondContact O-N 3.34Å
789	K	89	Confident	89.7	Confident	76 Å²	76	52.1 Å²	52.1	33%	0.33	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-31.4	-176.7	-71.2	-172	-172.5	-179.6	0	113.4	M246 E249 H785 I786 V792 E793	M246-K789 HydrophobicContact CE-CB 3.8Å; M246-K789 HydrophobicContact CE-CD 4.38Å; E249-K789 IonicContact OE1-NZ 2.65Å; E249-K789 PolarHBondContact OE1-NZ 3.03Å; E249-K789 IonicContact OE2-NZ 3.21Å; H785-K789 WeakPolarHBondContact O-CB 3.41Å; H785-K789 VanDerWaalsContact O-CD 3.24Å; H785-K789 WeakPolarHBondContact O-CD 3.49Å; H785-K789 WeakPolarHBondContact O-CG 3.19Å; I786-K789 PolarHBondContact O-N 3.07Å; K789-V792 WeakPolarHBondContact O-CB 3.14Å; K789-V792 PolarHBondContact O-N 2.89Å; K789-V792 VanDerWaalsContact O-N 3.09Å; K789-E793 PolarHBondContact O-N 2.56Å
790	T	86.9	Confident	89.5	Confident	18 Å²	18	55.9 Å²	55.9	11%	0.11	30%	0.295	C	S	.	.	H	α-helix	trans	-54.3	-46.8	-173.7	-64.4	0	0	0	0	113.5	M242 I619 I786 V792 E793 A794	M242-T790 HydrophobicContact CE-CG2 3.96Å; I619-T790 HydrophobicContact CD1-CG2 4.13Å; I619-T790 HydrophobicContact CG1-CG2 3.9Å; I786-T790 PolarHBondContact O-N 3.49Å; I786-T790 PolarHBondContact O-OG1 3.44Å; T790-V792 VanDerWaalsContact C-N 3.3Å; T790-V792 PolarHBondContact O-N 3.26Å; T790-E793 PolarHBondContact O-N 2.75Å; T790-A794 WeakPolarHBondContact O-CB 3.48Å; T790-A794 PolarHBondContact O-N 2.87Å
791	P	86.7	Confident	89.3	Confident	44 Å²	44	53.2 Å²	53.2	29%	0.286	27%	0.274	S	S	.	.	H	α-helix	trans	-61.9	-36.4	178.3	-24.1	35.2	0	0	0	113.3	N610 I619 K787 E795	N610-P791 PolarHBondContact ND2-O 2.87Å; I619-P791 HydrophobicContact CD1-CG 4.46Å; K787-P791 WeakPolarHBondContact O-CD 3.47Å; P791-E795 WeakPolarHBondContact O-CB 3.43Å; P791-E795 PolarHBondContact O-N 2.64Å
792	V	87.9	Confident	89	Confident	72 Å²	72	52.8 Å²	52.8	44%	0.436	27%	0.274	S	S	.	.	H	α-helix	trans	-70.1	-39.1	179.4	-178.7	0	0	0	0	111.1	K789 T790 K796	K789-V792 WeakPolarHBondContact O-CB 3.14Å; K789-V792 PolarHBondContact O-N 2.89Å; K789-V792 VanDerWaalsContact O-N 3.09Å; T790-V792 VanDerWaalsContact C-N 3.3Å; T790-V792 PolarHBondContact O-N 3.26Å; V792-K796 WeakPolarHBondContact O-CG 3.39Å; V792-K796 PolarHBondContact O-N 3Å; V792-K796 VanDerWaalsContact O-N 3.13Å
793	E	88.3	Confident	88.8	Confident	30 Å²	30	54.4 Å²	54.4	14%	0.14	29%	0.286	C	S	.	.	H	α-helix	trans	-73.1	-36.6	176.4	-66.5	-65.5	141.9	0	0	111.9	M242 R245 K789 T790 E795 K796 L797	M242-E793 HydrophobicContact CE-CB 3.4Å; M242-E793 HydrophobicContact CE-CG 4.39Å; M242-E793 HydrophobicContact CG-CB 4.37Å; M242-E793 HydrophobicContact SD-CB 3.61Å; R245-E793 IonicContact CZ-OE2 2.69Å; R245-E793 IonicContact NH1-OE2 2.95Å; R245-E793 IonicContact NH2-OE2 3.82Å; R245-E793 PolarHBondContact NH2-OE2 2.9Å; K789-E793 PolarHBondContact O-N 2.56Å; T790-E793 PolarHBondContact O-N 2.75Å; E793-E795 VanDerWaalsContact C-N 3.34Å; E793-K796 WeakPolarHBondContact O-CB 3.48Å; E793-K796 PolarHBondContact O-N 3.15Å; E793-K796 IonicContact OE1-NZ 3.66Å; E793-K796 PolarHBondContact OE1-NZ 3.34Å; E793-K796 IonicContact OE2-NZ 3.87Å; E793-L797 PolarHBondContact O-N 2.89Å; E793-L797 VanDerWaalsContact O-N 3.14Å
794	A	86.5	Confident	88.7	Confident	18 Å²	18	56.6 Å²	56.6	15%	0.149	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-43.3	171.2	0	0	0	0	0	111.3	T790 K796 L797 I798	T790-A794 WeakPolarHBondContact O-CB 3.48Å; T790-A794 PolarHBondContact O-N 2.87Å; A794-K796 VanDerWaalsContact C-N 3.32Å; A794-K796 PolarHBondContact O-N 3.49Å; A794-L797 WeakPolarHBondContact O-CB 3.49Å; A794-L797 PolarHBondContact O-N 3.24Å; A794-L797 VanDerWaalsContact O-N 3.14Å; A794-I798 WeakPolarHBondContact O-CG1 3.47Å; A794-I798 PolarHBondContact O-N 2.96Å
795	E	87.9	Confident	88.5	Confident	66 Å²	66	52.7 Å²	52.7	31%	0.308	28%	0.275	S	S	.	.	H	α-helix	trans	-57.9	-43	174	-173.4	-174.7	169.2	0	0	111.7	T607 P791 E793 L797 I798 L799	T607-E795 HydrophobicContact CG2-CG 4.22Å; T607-E795 VanDerWaalsContact CG2-OE1 3.28Å; T607-E795 WeakPolarHBondContact CG2-OE1 3.38Å; P791-E795 WeakPolarHBondContact O-CB 3.43Å; P791-E795 PolarHBondContact O-N 2.64Å; E793-E795 VanDerWaalsContact C-N 3.34Å; E795-L797 VanDerWaalsContact C-N 3.32Å; E795-L797 PolarHBondContact O-N 2.99Å; E795-I798 PolarHBondContact O-N 3.36Å; E795-I798 VanDerWaalsContact O-N 3.17Å; E795-L799 HydrophobicContact CG-CD1 4.27Å; E795-L799 HydrophobicContact CG-CG 4.42Å; E795-L799 WeakPolarHBondContact O-CG 3.29Å; E795-L799 PolarHBondContact O-N 3.21Å
796	K	90.3	Very high	88.4	Confident	111 Å²	111	51.5 Å²	51.5	48%	0.483	27%	0.27	S	S	.	.	H	α-helix	trans	-58.9	-42.4	175	-70.6	172.7	-172.7	172.7	0	112.4	V792 E793 A794 L799 Q800	V792-K796 WeakPolarHBondContact O-CG 3.39Å; V792-K796 PolarHBondContact O-N 3Å; V792-K796 VanDerWaalsContact O-N 3.13Å; E793-K796 WeakPolarHBondContact O-CB 3.48Å; E793-K796 PolarHBondContact O-N 3.15Å; E793-K796 IonicContact OE1-NZ 3.66Å; E793-K796 PolarHBondContact OE1-NZ 3.34Å; E793-K796 IonicContact OE2-NZ 3.87Å; A794-K796 VanDerWaalsContact C-N 3.32Å; A794-K796 PolarHBondContact O-N 3.49Å; K796-L799 PolarHBondContact O-N 3.43Å; K796-Q800 WeakPolarHBondContact O-CB 3.5Å; K796-Q800 PolarHBondContact O-N 3.02Å
797	L	89.3	Confident	88.4	Confident	22 Å²	22	51.9 Å²	51.9	12%	0.115	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-42.6	176.1	-67.4	176.3	0	0	0	111.1	L235 A238 M242 E793 A794 E795 Q800 F801	L235-L797 HydrophobicContact CD1-CB 4.13Å; A238-L797 HydrophobicContact CB-CD2 3.71Å; M242-L797 HydrophobicContact SD-CD1 3.85Å; E793-L797 PolarHBondContact O-N 2.89Å; E793-L797 VanDerWaalsContact O-N 3.14Å; A794-L797 WeakPolarHBondContact O-CB 3.49Å; A794-L797 PolarHBondContact O-N 3.24Å; A794-L797 VanDerWaalsContact O-N 3.14Å; E795-L797 VanDerWaalsContact C-N 3.32Å; E795-L797 PolarHBondContact O-N 2.99Å; L797-Q800 PolarHBondContact O-N 3.34Å; L797-F801 HydrophobicContact CD2-CD2 4.31Å; L797-F801 HydrophobicContact CD2-CE2 3.97Å; L797-F801 WeakPolarHBondContact O-CB 3.49Å; L797-F801 WeakPolarHBondContact O-CD2 3.31Å; L797-F801 PolarHBondContact O-N 2.79Å
798	I	87.3	Confident	88.4	Confident	33 Å²	33	52 Å²	52	17%	0.169	28%	0.275	C	S	.	.	H	α-helix	trans	-62	-45.4	176.7	-67.6	165.6	0	0	0	111	M606 L609 N610 A794 E795 Q800 G802	M606-I798 HydrophobicContact CB-CG2 4.25Å; M606-I798 WeakPolarHBondContact O-CG2 3.33Å; L609-I798 HydrophobicContact CB-CG2 4.13Å; N610-I798 HydrophobicContact CB-CD1 3.73Å; A794-I798 WeakPolarHBondContact O-CG1 3.47Å; A794-I798 PolarHBondContact O-N 2.96Å; E795-I798 PolarHBondContact O-N 3.36Å; E795-I798 VanDerWaalsContact O-N 3.17Å; I798-Q800 VanDerWaalsContact C-N 3.28Å; I798-Q800 PolarHBondContact O-N 2.99Å; I798-G802 WeakPolarHBondContact O-CA 3.48Å; I798-G802 PolarHBondContact O-N 3.16Å
799	L	87.6	Confident	88.5	Confident	85 Å²	85	50 Å²	50	45%	0.445	26%	0.256	S	S	.	.	H	α-helix	trans	-63.4	-33.9	176.9	-69.6	177.1	0	0	0	112.5	M606 T607 E795 K796 P803	M606-L799 HydrophobicContact CB-CD2 3.9Å; T607-L799 HydrophobicContact CG2-CD2 4.02Å; E795-L799 HydrophobicContact CG-CD1 4.27Å; E795-L799 HydrophobicContact CG-CG 4.42Å; E795-L799 WeakPolarHBondContact O-CG 3.29Å; E795-L799 PolarHBondContact O-N 3.21Å; K796-L799 PolarHBondContact O-N 3.43Å; L799-P803 VanDerWaalsContact O-CD 3.28Å; L799-P803 WeakPolarHBondContact O-CD 3.33Å
800	Q	89.7	Confident	88.5	Confident	106 Å²	106	46.5 Å²	46.5	50%	0.495	24%	0.241	S	C	.	.	H	α-helix	trans	-79.6	-41.3	-178.9	-173.5	-179.4	14.8	0	0	113.4	K796 L797 I798	K796-Q800 WeakPolarHBondContact O-CB 3.5Å; K796-Q800 PolarHBondContact O-N 3.02Å; L797-Q800 PolarHBondContact O-N 3.34Å; I798-Q800 VanDerWaalsContact C-N 3.28Å; I798-Q800 PolarHBondContact O-N 2.99Å
801	F	90.4	Very high	88.8	Confident	15 Å²	15	48 Å²	48	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-103	-26.8	-172.3	-68.7	-80.4	0	0	0	113.4	V231 L235 A238 L797 K804 I805	V231-F801 HydrophobicContact CG1-CD1 4.14Å; L235-F801 HydrophobicContact CB-CB 4.48Å; L235-F801 HydrophobicContact CB-CD1 4.35Å; L235-F801 HydrophobicContact CB-CG 4.21Å; L235-F801 HydrophobicContact CD1-CB 4.14Å; L235-F801 HydrophobicContact CD1-CD2 3.76Å; L235-F801 HydrophobicContact CD1-CE2 4.44Å; L235-F801 HydrophobicContact CD1-CG 4.05Å; A238-F801 HydrophobicContact CB-CE2 3.73Å; A238-F801 HydrophobicContact CB-CZ 3.9Å; L797-F801 HydrophobicContact CD2-CD2 4.31Å; L797-F801 HydrophobicContact CD2-CE2 3.97Å; L797-F801 WeakPolarHBondContact O-CB 3.49Å; L797-F801 WeakPolarHBondContact O-CD2 3.31Å; L797-F801 PolarHBondContact O-N 2.79Å; F801-K804 WeakPolarHBondContact O-CB 3.41Å; F801-K804 PolarHBondContact O-N 2.78Å; F801-K804 VanDerWaalsContact O-N 3.08Å; F801-I805 WeakPolarHBondContact O-CG1 3.49Å; F801-I805 PolarHBondContact O-N 3.26Å
802	G	87.1	Confident	89.1	Confident	10 Å²	10	45.9 Å²	45.9	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-53.1	-54.7	178.7	0	0	0	0	0	113.3	I798 K804 I805 M806	I798-G802 WeakPolarHBondContact O-CA 3.48Å; I798-G802 PolarHBondContact O-N 3.16Å; G802-K804 VanDerWaalsContact C-N 3.25Å; G802-K804 PolarHBondContact O-N 3.4Å; G802-I805 PolarHBondContact O-N 3.13Å; G802-M806 WeakPolarHBondContact O-CG 3.21Å; G802-M806 PolarHBondContact O-N 3.49Å
803	P	87.6	Confident	89.4	Confident	45 Å²	45	48 Å²	48	29%	0.292	23%	0.234	S	C	.	.	H	α-helix	trans	-58.2	-36.2	176.1	-23.8	32.2	0	0	0	113.1	I601 M606 L799 S807	I601-P803 HydrophobicContact CG2-CB 3.97Å; M606-P803 HydrophobicContact CE-CB 4.19Å; M606-P803 HydrophobicContact CE-CG 3.9Å; M606-P803 HydrophobicContact CG-CG 4.2Å; M606-P803 HydrophobicContact SD-CG 4.38Å; L799-P803 VanDerWaalsContact O-CD 3.28Å; L799-P803 WeakPolarHBondContact O-CD 3.33Å; P803-S807 VanDerWaalsContact O-CB 3.28Å; P803-S807 WeakPolarHBondContact O-CB 3.4Å; P803-S807 PolarHBondContact O-N 3.16Å; P803-S807 PolarHBondContact O-OG 2.86Å
804	K	90.4	Very high	89.6	Confident	100 Å²	100	48.5 Å²	48.5	44%	0.435	23%	0.234	S	C	.	.	H	α-helix	trans	-69.1	-43.1	179.3	-63	-179.8	-177	177	0	111.5	V231 F801 G802 S807	V231-K804 HydrophobicContact CG1-CB 3.77Å; F801-K804 WeakPolarHBondContact O-CB 3.41Å; F801-K804 PolarHBondContact O-N 2.78Å; F801-K804 VanDerWaalsContact O-N 3.08Å; G802-K804 VanDerWaalsContact C-N 3.25Å; G802-K804 PolarHBondContact O-N 3.4Å; K804-S807 PolarHBondContact O-N 3.33Å; K804-S807 PolarHBondContact O-OG 2.98Å
805	I	88.7	Confident	90	Very high	39 Å²	39	49 Å²	49	20%	0.2	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-53.4	174.6	-65.8	172.4	0	0	0	109.1	I228 V231 L235 F801 G802 S807 K808 V809	I228-I805 HydrophobicContact CB-CG2 4.5Å; I228-I805 HydrophobicContact CG2-CG2 4.16Å; V231-I805 HydrophobicContact CB-CG1 4.16Å; V231-I805 HydrophobicContact CG1-CD1 4.45Å; V231-I805 HydrophobicContact CG1-CG1 3.55Å; L235-I805 HydrophobicContact CD2-CD1 4.25Å; F801-I805 WeakPolarHBondContact O-CG1 3.49Å; F801-I805 PolarHBondContact O-N 3.26Å; G802-I805 PolarHBondContact O-N 3.13Å; I805-S807 PolarHBondContact O-N 3.09Å; I805-K808 PolarHBondContact O-N 2.94Å; I805-V809 WeakPolarHBondContact O-CG2 3.41Å; I805-V809 PolarHBondContact O-N 3.36Å
806	M	87.6	Confident	90.2	Very high	26 Å²	26	47.9 Å²	47.9	13%	0.128	23%	0.228	C	C	.	.	H	α-helix	trans	-58.7	-34.5	-179.3	-70	-156.6	-178	0	0	113.4	L595 I601 F604 M606 L609 G802 K808 V809	L595-M806 HydrophobicContact CD1-CB 4.21Å; L595-M806 HydrophobicContact CD1-CG 4.3Å; L595-M806 HydrophobicContact CD1-SD 4.1Å; I601-M806 HydrophobicContact CD1-CB 3.83Å; I601-M806 HydrophobicContact CG1-CB 3.99Å; F604-M806 HydrophobicContact CD1-CE 3.6Å; F604-M806 HydrophobicContact CD1-SD 3.99Å; F604-M806 HydrophobicContact CD2-CE 4.45Å; F604-M806 HydrophobicContact CE1-CE 3.27Å; F604-M806 HydrophobicContact CE1-SD 4.25Å; F604-M806 HydrophobicContact CE2-CE 4.17Å; F604-M806 HydrophobicContact CG-CE 4.19Å; F604-M806 HydrophobicContact CG-SD 4.14Å; F604-M806 HydrophobicContact CZ-CE 3.58Å; M606-M806 HydrophobicContact CE-CB 4.4Å; M606-M806 HydrophobicContact CE-CE 3.93Å; M606-M806 HydrophobicContact CE-CG 3.97Å; M606-M806 HydrophobicContact CE-SD 3.4Å; M606-M806 WeakPolarHBondContact CE-SD 3.43Å; M606-M806 HydrophobicContact SD-CE 3.89Å; M606-M806 HydrophobicContact SD-SD 4.17Å; L609-M806 HydrophobicContact CD1-CE 3.66Å; G802-M806 WeakPolarHBondContact O-CG 3.21Å; G802-M806 PolarHBondContact O-N 3.49Å; M806-K808 PolarHBondContact O-N 3.27Å; M806-V809 PolarHBondContact O-N 2.9Å
807	S	90	Very high	90.3	Very high	21 Å²	21	43.2 Å²	43.2	15%	0.147	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-20.7	178.3	74.4	0	0	0	0	113.8	G593 Q596 I601 P803 K804 I805	G593-S807 VanDerWaalsContact CA-O 3.3Å; G593-S807 WeakPolarHBondContact CA-O 3.5Å; G593-S807 PolarHBondContact N-O 3.49Å; Q596-S807 PolarHBondContact OE1-O 3.47Å; I601-S807 VanDerWaalsContact CD1-CA 3.47Å; P803-S807 VanDerWaalsContact O-CB 3.28Å; P803-S807 WeakPolarHBondContact O-CB 3.4Å; P803-S807 PolarHBondContact O-N 3.16Å; P803-S807 PolarHBondContact O-OG 2.86Å; K804-S807 PolarHBondContact O-N 3.33Å; K804-S807 PolarHBondContact O-OG 2.98Å; I805-S807 PolarHBondContact O-N 3.09Å
808	K	90.1	Very high	90.5	Very high	91 Å²	91	42.2 Å²	42.2	40%	0.396	21%	0.205	S	C	.	.	H	α-helix	trans	-103.2	-8.2	-179.9	-62.7	-60.2	-177.1	-180	0	113.5	D227 I228 I805 M806 G810	D227-K808 HydrophobicContact CB-CB 4.4Å; I228-K808 HydrophobicContact CG2-CB 4.06Å; I805-K808 PolarHBondContact O-N 2.94Å; M806-K808 PolarHBondContact O-N 3.27Å; K808-G810 PolarHBondContact O-N 2.93Å
809	V	89.8	Confident	90.7	Very high	22 Å²	22	41.8 Å²	41.8	13%	0.133	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	123.1	179.7	172.6	0	0	0	0	110.5	F220 T224 W408 G593 I594 I805 M806	F220-V809 HydrophobicContact CZ-CG1 3.99Å; T224-V809 HydrophobicContact CG2-CB 4.31Å; T224-V809 HydrophobicContact CG2-CG1 4.28Å; T224-V809 HydrophobicContact CG2-CG2 4.18Å; W408-V809 HydrophobicContact CH2-CG1 4.34Å; G593-V809 CarbonylContact C-O 3.45Å; G593-V809 WeakPolarHBondContact CA-O 3.49Å; I594-V809 PolarHBondContact N-O 3Å; I805-V809 WeakPolarHBondContact O-CG2 3.41Å; I805-V809 PolarHBondContact O-N 3.36Å; M806-V809 PolarHBondContact O-N 2.9Å
810	G	89.4	Confident	90.8	Very high	2 Å²	2	41.1 Å²	41.1	2%	0.021	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	58.6	168.6	0	0	0	0	0	114.8	Y216 F220 T224 I594 K808 C812	Y216-G810 PolarHBondContact OH-O 3.42Å; Y216-G810 VanDerWaalsContact OH-O 3.05Å; F220-G810 VanDerWaalsContact CE2-CA 3.47Å; T224-G810 PolarHBondContact OG1-N 3.42Å; I594-G810 PolarHBondContact N-O 3.04Å; I594-G810 VanDerWaalsContact N-O 3.17Å; K808-G810 PolarHBondContact O-N 2.93Å; G810-C812 PolarHBondContact O-N 3.25Å
811	Q	92.2	Very high	90.8	Very high	49 Å²	49	36.5 Å²	36.5	23%	0.229	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-45.8	119.5	174.4	-75.3	-173.3	12.3	0	0	112.2	Y216 D227 N591 Q592	Y216-Q811 WeakPolarHBondContact CE2-O 3.49Å; D227-Q811 PolarHBondContact OD1-NE2 3.49Å; D227-Q811 VanDerWaalsContact OD1-NE2 3.1Å; D227-Q811 WeakPolarHBondContact OD2-CG 3.26Å; D227-Q811 PolarHBondContact OD2-NE2 2.83Å; N591-Q811 PolarHBondContact ND2-OE1 2.8Å; N591-Q811 WeakPolarHBondContact OD1-CB 3.45Å; Q592-Q811 WeakPolarHBondContact O-CA 3.09Å
812	C	94	Very high	90.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.			trans	-105.2	17.4	-155.8	61.1	0	0	0	0	116.7	Y216 C588 N591 Q592 I594 G810 R814 L815 Y816	Y216-C812 HydrophobicContact CE2-CB 4.28Å; C588-C812 WeakPolarHBondContact CA-SG 3.41Å; C588-C812 HydrophobicContact CB-CB 3.9Å; C588-C812 WeakPolarHBondContact CB-O 3.48Å; C588-C812 WeakPolarHBondContact CB-SG 3.38Å; C588-C812 WeakPolarHBondContact SG-CB 3.2Å; C588-C812 CovalentContact SG-SG 2.03Å; C588-C812 PolarHBondContact SG-SG 2.84Å; N591-C812 PolarHBondContact OD1-N 3.32Å; Q592-C812 PolarHBondContact O-N 3.44Å; Q592-C812 PolarHBondContact O-SG 3.36Å; I594-C812 HydrophobicContact CB-CB 4.29Å; I594-C812 HydrophobicContact CD1-CB 3.82Å; G810-C812 PolarHBondContact O-N 3.25Å; C812-R814 PolarHBondContact O-N 2.88Å; C812-R814 VanDerWaalsContact O-N 3.13Å; C812-L815 HydrophobicContact CB-CB 4.49Å; C812-L815 HydrophobicContact CB-CD1 4.13Å; C812-L815 WeakPolarHBondContact O-CB 3.36Å; C812-L815 PolarHBondContact O-N 3.34Å; C812-Y816 PolarHBondContact O-N 2.89Å
813	Y	93.7	Very high	90.8	Very high	117 Å²	117	39.6 Å²	39.6	46%	0.459	19%	0.194	S	C	.	.	H	α-helix	trans	-54.2	-36.1	179.9	179.9	-97.4	0	0	0	114.4	C588 H589 N591 L815 Y816 A817	C588-Y813 WeakPolarHBondContact O-CA 3.37Å; C588-Y813 PolarHBondContact O-N 2.96Å; H589-Y813 WeakPolarHBondContact O-CD2 3.4Å; N591-Y813 WeakPolarHBondContact OD1-CB 3.45Å; N591-Y813 PolarHBondContact OD1-N 2.71Å; N591-Y813 VanDerWaalsContact OD1-N 3.08Å; Y813-L815 VanDerWaalsContact C-N 3.28Å; Y813-L815 PolarHBondContact O-N 3.29Å; Y813-Y816 HydrophobicContact CD2-CD1 4.31Å; Y813-Y816 HydrophobicContact CE2-CD1 4.05Å; Y813-Y816 HydrophobicContact CE2-CE1 4.46Å; Y813-Y816 WeakPolarHBondContact O-CB 3.29Å; Y813-Y816 PolarHBondContact O-N 3.1Å; Y813-A817 PolarHBondContact O-N 3.44Å
814	R	92.6	Very high	90.8	Very high	40 Å²	40	37.8 Å²	37.8	15%	0.151	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-32.5	176.1	-70.8	-170.6	-177.9	-75.4	3.8	113.3	Q212 Y216 E219 C812 A817 A818	Q212-R814 VanDerWaalsContact OE1-NH1 3.12Å; Y216-R814 HydrophobicContact CD2-CB 4.38Å; E219-R814 VanDerWaalsContact CD-NH2 3.3Å; E219-R814 IonicContact OE1-CZ 3.36Å; E219-R814 IonicContact OE1-NE 3.62Å; E219-R814 IonicContact OE1-NH2 3.75Å; E219-R814 PolarHBondContact OE1-NH2 2.84Å; E219-R814 IonicContact OE2-CZ 3.13Å; E219-R814 IonicContact OE2-NE 2.79Å; E219-R814 PolarHBondContact OE2-NE 3.25Å; E219-R814 IonicContact OE2-NH2 3.88Å; E219-R814 PolarHBondContact OE2-NH2 3.45Å; C812-R814 PolarHBondContact O-N 2.88Å; C812-R814 VanDerWaalsContact O-N 3.13Å; R814-A817 PolarHBondContact O-N 3.08Å; R814-A818 WeakPolarHBondContact O-CB 2.79Å; R814-A818 PolarHBondContact O-N 2.93Å
815	L	94	Very high	90.7	Very high	30 Å²	30	33 Å²	33	16%	0.157	16%	0.163	C	C	.	.	H	α-helix	trans	-69.7	-37.3	175	-65.5	-179.9	0	0	0	111.3	I213 Y216 I594 C812 Y813 A818 A819	I213-L815 HydrophobicContact CG1-CD2 4.39Å; Y216-L815 HydrophobicContact CD1-CD1 4.03Å; Y216-L815 HydrophobicContact CD1-CD2 3.7Å; Y216-L815 HydrophobicContact CD1-CG 3.84Å; Y216-L815 HydrophobicContact CD2-CG 4.16Å; Y216-L815 HydrophobicContact CE1-CD1 3.63Å; Y216-L815 HydrophobicContact CE1-CD2 4.15Å; Y216-L815 HydrophobicContact CE1-CG 3.96Å; Y216-L815 HydrophobicContact CE2-CD1 4.24Å; Y216-L815 HydrophobicContact CE2-CG 4.27Å; Y216-L815 HydrophobicContact CG-CD1 4.49Å; Y216-L815 HydrophobicContact CG-CD2 4.01Å; Y216-L815 HydrophobicContact CG-CG 3.93Å; I594-L815 HydrophobicContact CD1-CD1 3.75Å; C812-L815 HydrophobicContact CB-CB 4.49Å; C812-L815 HydrophobicContact CB-CD1 4.13Å; C812-L815 WeakPolarHBondContact O-CB 3.36Å; C812-L815 PolarHBondContact O-N 3.34Å; Y813-L815 VanDerWaalsContact C-N 3.28Å; Y813-L815 PolarHBondContact O-N 3.29Å; L815-A818 PolarHBondContact O-N 3.35Å; L815-A819 WeakPolarHBondContact O-CB 3.46Å; L815-A819 PolarHBondContact O-N 3.42Å
816	Y	93.5	Very high	90.7	Very high	42 Å²	42	35 Å²	35	17%	0.165	17%	0.173	C	C	.	.	H	α-helix	trans	-58.7	-52.1	169.8	165	-98.7	0	0	0	110.9	I584 L585 H589 C812 Y813 A818 A819 E820	I584-Y816 WeakPolarHBondContact O-CA 3.36Å; I584-Y816 WeakPolarHBondContact O-CB 3.38Å; L585-Y816 WeakPolarHBondContact O-CD2 3.44Å; L585-Y816 VanDerWaalsContact O-CE2 3.3Å; L585-Y816 WeakPolarHBondContact O-CE2 3.34Å; H589-Y816 HydrophobicContact CB-CD1 4.25Å; H589-Y816 HydrophobicContact CB-CD2 3.95Å; H589-Y816 HydrophobicContact CB-CE1 4.33Å; H589-Y816 HydrophobicContact CB-CE2 4.02Å; H589-Y816 HydrophobicContact CB-CG 4.06Å; H589-Y816 AromaticContact CD2-CE1 3.61Å; H589-Y816 AromaticContact CD2-CZ 3.63Å; C812-Y816 PolarHBondContact O-N 2.89Å; Y813-Y816 HydrophobicContact CD2-CD1 4.31Å; Y813-Y816 HydrophobicContact CE2-CD1 4.05Å; Y813-Y816 HydrophobicContact CE2-CE1 4.46Å; Y813-Y816 WeakPolarHBondContact O-CB 3.29Å; Y813-Y816 PolarHBondContact O-N 3.1Å; Y816-A818 VanDerWaalsContact C-N 3.29Å; Y816-A818 PolarHBondContact O-N 2.83Å; Y816-A819 PolarHBondContact O-N 3.32Å; Y816-A819 VanDerWaalsContact O-N 3.14Å; Y816-E820 PolarHBondContact O-N 2.96Å
817	A	92.1	Very high	90.8	Very high	12 Å²	12	34.6 Å²	34.6	10%	0.099	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-40.5	179.2	0	0	0	0	0	112	Q212 Y813 R814 E820 D821	Q212-A817 HydrophobicContact CG-CB 4.35Å; Y813-A817 PolarHBondContact O-N 3.44Å; R814-A817 PolarHBondContact O-N 3.08Å; A817-E820 PolarHBondContact O-N 3.49Å; A817-D821 WeakPolarHBondContact O-CB 3.49Å; A817-D821 PolarHBondContact O-N 3.08Å
818	A	92.7	Very high	90.6	Very high	2 Å²	2	36.7 Å²	36.7	2%	0.017	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-45.6	174.9	0	0	0	0	0	112.5	G209 Q212 I213 R814 L815 Y816 D821 L822	G209-A818 WeakPolarHBondContact O-CB 3.43Å; Q212-A818 HydrophobicContact CB-CB 3.79Å; I213-A818 HydrophobicContact CD1-CB 4.24Å; I213-A818 HydrophobicContact CG1-CB 3.64Å; R814-A818 WeakPolarHBondContact O-CB 2.79Å; R814-A818 PolarHBondContact O-N 2.93Å; L815-A818 PolarHBondContact O-N 3.35Å; Y816-A818 VanDerWaalsContact C-N 3.29Å; Y816-A818 PolarHBondContact O-N 2.83Å; A818-D821 PolarHBondContact O-N 3.11Å; A818-L822 WeakPolarHBondContact O-CB 3.31Å; A818-L822 VanDerWaalsContact O-CG 3.26Å; A818-L822 WeakPolarHBondContact O-CG 3.44Å; A818-L822 PolarHBondContact O-N 3.2Å
819	A	91	Very high	90.5	Very high	23 Å²	23	32.4 Å²	32.4	19%	0.19	16%	0.163	C	C	.	.	H	α-helix	trans	-65.4	-40.4	178.5	0	0	0	0	0	111.5	I584 L585 L815 Y816 N823	I584-A819 HydrophobicContact CG2-CB 3.66Å; L585-A819 HydrophobicContact CD2-CB 3.72Å; L815-A819 WeakPolarHBondContact O-CB 3.46Å; L815-A819 PolarHBondContact O-N 3.42Å; Y816-A819 PolarHBondContact O-N 3.32Å; Y816-A819 VanDerWaalsContact O-N 3.14Å; A819-N823 WeakPolarHBondContact O-CB 3.3Å; A819-N823 PolarHBondContact O-N 3.36Å
820	E	89.7	Confident	90.5	Very high	71 Å²	71	33.4 Å²	33.4	33%	0.332	17%	0.168	S	C	.	.	H	α-helix	trans	-62.7	-43.4	174.2	-163.7	-165.7	170.4	0	0	111.3	K199 Y816 A817 G824	K199-E820 IonicContact NZ-OE1 3.94Å; K199-E820 PolarHBondContact NZ-OE1 3.45Å; Y816-E820 PolarHBondContact O-N 2.96Å; A817-E820 PolarHBondContact O-N 3.49Å; E820-G824 WeakPolarHBondContact O-CA 3.32Å; E820-G824 PolarHBondContact O-N 3.24Å
821	D	90.8	Very high	90.5	Very high	10 Å²	10	33.4 Å²	33.4	5%	0.053	17%	0.167	C	C	.	.	H	α-helix	trans	-63.3	-47.8	178.2	-82.3	-32.5	0	0	0	112.2	R205 R208 A817 A818 G824 A825	R205-D821 WeakPolarHBondContact CD-OD1 3.37Å; R205-D821 IonicContact CZ-OD1 3.62Å; R205-D821 IonicContact NE-OD1 2.72Å; R205-D821 IonicContact NH1-OD1 3.69Å; R205-D821 PolarHBondContact NH1-OD1 3.03Å; R208-D821 WeakPolarHBondContact CD-OD2 3.35Å; R208-D821 VanDerWaalsContact CG-OD2 3.26Å; R208-D821 WeakPolarHBondContact CG-OD2 3.3Å; R208-D821 IonicContact NE-OD1 2.7Å; R208-D821 IonicContact NE-OD2 3.33Å; R208-D821 PolarHBondContact NE-OD2 3Å; A817-D821 WeakPolarHBondContact O-CB 3.49Å; A817-D821 PolarHBondContact O-N 3.08Å; A818-D821 PolarHBondContact O-N 3.11Å; D821-G824 PolarHBondContact O-N 2.83Å; D821-A825 VanDerWaalsContact O-CB 3.32Å; D821-A825 WeakPolarHBondContact O-CB 3.41Å; D821-A825 PolarHBondContact O-N 3.47Å
822	L	89.9	Confident	90.4	Very high	53 Å²	53	31.4 Å²	31.4	28%	0.277	16%	0.159	S	C	.	.	H	α-helix	trans	-65.9	-45	178.8	-70.4	169.5	0	0	0	111.7	I206 I213 A818 A825 I826	I206-L822 HydrophobicContact CB-CD2 4.3Å; I206-L822 HydrophobicContact CG1-CD2 4.15Å; I206-L822 HydrophobicContact CG2-CD2 4.14Å; I213-L822 HydrophobicContact CD1-CD1 4.46Å; A818-L822 WeakPolarHBondContact O-CB 3.31Å; A818-L822 VanDerWaalsContact O-CG 3.26Å; A818-L822 WeakPolarHBondContact O-CG 3.44Å; A818-L822 PolarHBondContact O-N 3.2Å; L822-A825 PolarHBondContact O-N 3.45Å; L822-I826 WeakPolarHBondContact O-CG1 3Å; L822-I826 PolarHBondContact O-N 2.92Å; L822-I826 VanDerWaalsContact O-N 3.12Å
823	N	87.9	Confident	90.2	Very high	36 Å²	36	31.5 Å²	31.5	19%	0.193	16%	0.159	C	C	.	.	H	α-helix	trans	-64.7	-43.4	177.4	-171	31.8	0	0	0	110.8	V520 A819 I826 C827	V520-N823 HydrophobicContact CG1-CB 4.48Å; A819-N823 WeakPolarHBondContact O-CB 3.3Å; A819-N823 PolarHBondContact O-N 3.36Å; N823-I826 PolarHBondContact O-N 3.2Å; N823-C827 WeakPolarHBondContact O-CA 3.33Å; N823-C827 WeakPolarHBondContact O-CB 3.09Å; N823-C827 PolarHBondContact O-N 2.88Å; N823-C827 PolarHBondContact OD1-SG 3.3Å
824	G	86.3	Confident	90	Very high	7 Å²	7	26.7 Å²	26.7	7%	0.072	14%	0.141	C	C	.	.	I	π-helix	trans	-58.8	-48.4	175.1	0	0	0	0	0	112.3	K199 E820 D821 I826 N828 G829	K199-G824 CarbonylContact O-C 3.38Å; E820-G824 WeakPolarHBondContact O-CA 3.32Å; E820-G824 PolarHBondContact O-N 3.24Å; D821-G824 PolarHBondContact O-N 2.83Å; G824-I826 PolarHBondContact O-N 3.15Å; G824-N828 WeakPolarHBondContact O-CA 3.3Å; G824-N828 VanDerWaalsContact O-CB 3.25Å; G824-N828 WeakPolarHBondContact O-CB 3.29Å; G824-N828 PolarHBondContact O-N 3.37Å; G824-G829 PolarHBondContact O-N 3.26Å
825	A	88.6	Confident	89.8	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.134	C	C	.	.	I	π-helix	trans	-56.4	-50.1	178.8	0	0	0	0	0	112.1	R205 I206 D821 L822 G829	R205-A825 HydrophobicContact CB-CB 3.74Å; I206-A825 HydrophobicContact CG1-CB 3.93Å; D821-A825 VanDerWaalsContact O-CB 3.32Å; D821-A825 WeakPolarHBondContact O-CB 3.41Å; D821-A825 PolarHBondContact O-N 3.47Å; L822-A825 PolarHBondContact O-N 3.45Å; A825-G829 WeakPolarHBondContact O-CA 3.31Å; A825-G829 PolarHBondContact O-N 2.84Å; A825-G829 VanDerWaalsContact O-N 3.15Å
826	I	89.6	Confident	89.5	Confident	81 Å²	81	23.3 Å²	23.3	42%	0.415	13%	0.127	S	C	.	.	I	π-helix	trans	-78.1	-51.4	-174.9	-62.4	171	0	0	0	110.4	L822 N823 G824 I830 V831	L822-I826 WeakPolarHBondContact O-CG1 3Å; L822-I826 PolarHBondContact O-N 2.92Å; L822-I826 VanDerWaalsContact O-N 3.12Å; N823-I826 PolarHBondContact O-N 3.2Å; G824-I826 PolarHBondContact O-N 3.15Å; I826-I830 WeakPolarHBondContact O-CB 3.26Å; I826-I830 PolarHBondContact O-N 2.74Å; I826-I830 VanDerWaalsContact O-N 3.1Å; I826-V831 HydrophobicContact CG2-CG2 4.34Å; I826-V831 PolarHBondContact O-N 3.15Å
827	C	88.9	Confident	89.3	Confident	17 Å²	17	21.3 Å²	21.3	12%	0.115	12%	0.119	C	C	.	.	I	π-helix	trans	-78.6	-39.3	-170	-64.4	0	0	0	0	113.3	C517 N823 S832	C517-C827 VanDerWaalsContact CA-SG 3.52Å; C517-C827 HydrophobicContact CB-CB 3.78Å; C517-C827 WeakPolarHBondContact CB-SG 3.49Å; C517-C827 WeakPolarHBondContact SG-CA 3.28Å; C517-C827 WeakPolarHBondContact SG-CB 3.22Å; C517-C827 CovalentContact SG-SG 2.03Å; C517-C827 PolarHBondContact SG-SG 2.88Å; N823-C827 WeakPolarHBondContact O-CA 3.33Å; N823-C827 WeakPolarHBondContact O-CB 3.09Å; N823-C827 PolarHBondContact O-N 2.88Å; N823-C827 PolarHBondContact OD1-SG 3.3Å; C827-S832 WeakPolarHBondContact O-CB 3.4Å; C827-S832 PolarHBondContact O-N 2.89Å
828	N	86.6	Confident	89.2	Confident	66 Å²	66	22.3 Å²	22.3	35%	0.353	12%	0.12	S	C	.	.	I	π-helix	trans	-88.5	-40.6	176.2	-59.8	-39	0	0	0	111.7	G824	G824-N828 WeakPolarHBondContact O-CA 3.3Å; G824-N828 VanDerWaalsContact O-CB 3.25Å; G824-N828 WeakPolarHBondContact O-CB 3.29Å; G824-N828 PolarHBondContact O-N 3.37Å
829	G	87	Confident	89.1	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	I	π-helix	trans	-71.7	-39.5	-177.7	0	0	0	0	0	114.6	N172 T200 G824 A825 V833	N172-G829 PolarHBondContact ND2-O 3.5Å; T200-G829 VanDerWaalsContact O-CA 3.29Å; T200-G829 WeakPolarHBondContact O-CA 3.48Å; G824-G829 PolarHBondContact O-N 3.26Å; A825-G829 WeakPolarHBondContact O-CA 3.31Å; A825-G829 PolarHBondContact O-N 2.84Å; A825-G829 VanDerWaalsContact O-N 3.15Å; G829-V833 WeakPolarHBondContact O-CG2 3.38Å
830	I	90.4	Very high	89.1	Confident	43 Å²	43	23.1 Å²	23.1	22%	0.221	12%	0.119	C	C	.	.	I	π-helix	trans	-110.6	-61.8	-175.2	-55.8	174.7	0	0	0	111.1	F169 L173 V202 I826 S832 V833 L834	F169-I830 HydrophobicContact CE2-CG2 4.39Å; L173-I830 HydrophobicContact CD2-CG1 4.48Å; V202-I830 HydrophobicContact CG1-CD1 4.01Å; V202-I830 HydrophobicContact CG1-CG1 4.47Å; V202-I830 HydrophobicContact CG2-CD1 4.14Å; V202-I830 HydrophobicContact CG2-CG1 3.68Å; I826-I830 WeakPolarHBondContact O-CB 3.26Å; I826-I830 PolarHBondContact O-N 2.74Å; I826-I830 VanDerWaalsContact O-N 3.1Å; I830-S832 PolarHBondContact O-N 3.06Å; I830-V833 PolarHBondContact O-N 3.45Å; I830-V833 VanDerWaalsContact O-N 3.12Å; I830-L834 HydrophobicContact CG2-CD1 3.76Å; I830-L834 HydrophobicContact CG2-CG 4.22Å; I830-L834 WeakPolarHBondContact O-CG 3.32Å; I830-L834 PolarHBondContact O-N 2.93Å
831	V	90.1	Very high	89.2	Confident	2 Å²	2	19.8 Å²	19.8	1%	0.012	10%	0.103	C	C	.	.	I	π-helix	trans	-65.5	-41.8	-167.4	176.5	0	0	0	0	112.1	L512 Y513 I826 V833 L834 N835	L512-V831 HydrophobicContact CB-CG1 4.28Å; L512-V831 HydrophobicContact CB-CG2 3.79Å; L512-V831 HydrophobicContact CD1-CG2 4.34Å; Y513-V831 HydrophobicContact CD2-CG1 4.32Å; Y513-V831 HydrophobicContact CG-CG1 4.47Å; I826-V831 HydrophobicContact CG2-CG2 4.34Å; I826-V831 PolarHBondContact O-N 3.15Å; V831-V833 VanDerWaalsContact C-N 3.28Å; V831-V833 PolarHBondContact O-N 3.45Å; V831-L834 PolarHBondContact O-N 3.42Å; V831-N835 WeakPolarHBondContact O-CB 3.21Å; V831-N835 PolarHBondContact O-N 3.31Å; V831-N835 PolarHBondContact O-ND2 3.43Å
832	S	88.5	Confident	89.2	Confident	8 Å²	8	20.3 Å²	20.3	6%	0.056	11%	0.111	C	C	.	.	H	α-helix	trans	-60.5	-39.6	175.6	-165.4	0	0	0	0	111.8	Y5 C827 I830 N835 G836	Y5-S832 WeakPolarHBondContact CD1-O 3.27Å; Y5-S832 VanDerWaalsContact CE1-O 3.29Å; Y5-S832 WeakPolarHBondContact CE1-O 3.42Å; C827-S832 WeakPolarHBondContact O-CB 3.4Å; C827-S832 PolarHBondContact O-N 2.89Å; I830-S832 PolarHBondContact O-N 3.06Å; S832-N835 PolarHBondContact O-N 2.95Å; S832-G836 PolarHBondContact O-N 3.07Å
833	V	89.7	Confident	89.3	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-73.3	-41.5	-178.2	-171.2	0	0	0	0	111.5	V165 F169 G829 I830 V831 N835 G836 F837	V165-V833 HydrophobicContact CG1-CG1 3.64Å; F169-V833 HydrophobicContact CB-CG1 3.66Å; F169-V833 HydrophobicContact CD2-CB 4.05Å; F169-V833 HydrophobicContact CD2-CG1 3.78Å; F169-V833 HydrophobicContact CG-CG1 4.1Å; G829-V833 WeakPolarHBondContact O-CG2 3.38Å; I830-V833 PolarHBondContact O-N 3.45Å; I830-V833 VanDerWaalsContact O-N 3.12Å; V831-V833 VanDerWaalsContact C-N 3.28Å; V831-V833 PolarHBondContact O-N 3.45Å; V833-N835 PolarHBondContact O-N 3.49Å; V833-G836 WeakPolarHBondContact O-CA 3.4Å; V833-G836 PolarHBondContact O-N 3.46Å; V833-F837 HydrophobicContact CG1-CD2 4.26Å; V833-F837 HydrophobicContact CG1-CE2 3.91Å; V833-F837 WeakPolarHBondContact O-CD2 3.37Å; V833-F837 PolarHBondContact O-N 3.31Å
834	L	90.1	Very high	89.5	Confident	16 Å²	16	19.9 Å²	19.9	8%	0.084	10%	0.103	C	C	.	.	H	α-helix	trans	-57.7	-37.6	170.3	-67.1	177.6	0	0	0	112.2	F169 F505 I508 L512 I830 V831 G836 F837 W838	F169-L834 HydrophobicContact CE2-CD2 4.46Å; F169-L834 HydrophobicContact CZ-CD2 4.45Å; F505-L834 HydrophobicContact CD1-CD2 3.79Å; F505-L834 HydrophobicContact CE1-CD2 3.91Å; I508-L834 HydrophobicContact CG2-CD1 4.28Å; L512-L834 HydrophobicContact CD1-CD1 4.29Å; I830-L834 HydrophobicContact CG2-CD1 3.76Å; I830-L834 HydrophobicContact CG2-CG 4.22Å; I830-L834 WeakPolarHBondContact O-CG 3.32Å; I830-L834 PolarHBondContact O-N 2.93Å; V831-L834 PolarHBondContact O-N 3.42Å; L834-G836 VanDerWaalsContact C-N 3.34Å; L834-F837 HydrophobicContact CD2-CD2 4.37Å; L834-F837 WeakPolarHBondContact O-CB 3.4Å; L834-F837 PolarHBondContact O-N 2.8Å; L834-W838 PolarHBondContact O-N 2.94Å
835	N	87.9	Confident	89.7	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-67.4	-33.1	173.4	-78.8	-51.8	0	0	0	113.2	A8 G509 V831 S832 V833 W838 F839	A8-N835 HydrophobicContact CB-CB 4Å; A8-N835 WeakPolarHBondContact CB-O 3.48Å; G509-N835 PolarHBondContact O-ND2 3.27Å; G509-N835 VanDerWaalsContact O-ND2 3.09Å; G509-N835 PolarHBondContact O-OD1 2.76Å; V831-N835 WeakPolarHBondContact O-CB 3.21Å; V831-N835 PolarHBondContact O-N 3.31Å; V831-N835 PolarHBondContact O-ND2 3.43Å; S832-N835 PolarHBondContact O-N 2.95Å; V833-N835 PolarHBondContact O-N 3.49Å; N835-W838 VanDerWaalsContact CA-CD1 3.48Å; N835-W838 PolarHBondContact O-NE1 2.64Å; N835-W838 VanDerWaalsContact O-NE1 3.16Å; N835-W838 PolarHBondContact OD1-NE1 2.8Å; N835-F839 WeakPolarHBondContact O-CB 3.47Å; N835-F839 PolarHBondContact O-N 2.76Å
836	G	88.1	Confident	89.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.8	-40.1	169.5	0	0	0	0	0	113.2	S832 V833 L834 F839 L840	S832-G836 PolarHBondContact O-N 3.07Å; V833-G836 WeakPolarHBondContact O-CA 3.4Å; V833-G836 PolarHBondContact O-N 3.46Å; L834-G836 VanDerWaalsContact C-N 3.34Å; G836-F839 PolarHBondContact O-N 3.01Å; G836-L840 WeakPolarHBondContact O-CB 3.36Å; G836-L840 WeakPolarHBondContact O-CG 3.24Å; G836-L840 PolarHBondContact O-N 2.89Å
837	F	90.3	Very high	89.8	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-58.5	-55.2	179.9	-84.6	-64.8	0	0	0	112.5	V165 C166 F169 F444 F505 V833 L834 F839 L840 F841	V165-F837 HydrophobicContact CB-CE1 4.43Å; V165-F837 HydrophobicContact CG1-CD1 4.07Å; V165-F837 HydrophobicContact CG1-CD2 4.03Å; V165-F837 HydrophobicContact CG1-CE1 3.97Å; V165-F837 HydrophobicContact CG1-CE2 3.93Å; V165-F837 HydrophobicContact CG1-CG 4.1Å; V165-F837 HydrophobicContact CG1-CZ 3.9Å; C166-F837 VanDerWaalsContact SG-CE1 3.54Å; F169-F837 HydrophobicContact CB-CE2 3.82Å; F169-F837 HydrophobicContact CB-CZ 4.01Å; F169-F837 HydrophobicContact CD1-CE2 4.07Å; F169-F837 HydrophobicContact CD1-CZ 4.39Å; F169-F837 HydrophobicContact CD2-CE2 4.28Å; F169-F837 AromaticContact CG-CE2 3.8Å; F169-F837 HydrophobicContact CG-CE2 3.8Å; F169-F837 HydrophobicContact CG-CZ 4.31Å; F444-F837 HydrophobicContact CE1-CE1 4.31Å; F444-F837 HydrophobicContact CE1-CE2 4.11Å; F444-F837 AromaticContact CE1-CZ 3.75Å; F444-F837 HydrophobicContact CE1-CZ 3.75Å; F444-F837 HydrophobicContact CZ-CZ 4.33Å; F505-F837 HydrophobicContact CB-CB 4.29Å; F505-F837 HydrophobicContact CD1-CB 4.3Å; F505-F837 HydrophobicContact CD2-CB 4.12Å; F505-F837 HydrophobicContact CG-CB 3.98Å; V833-F837 HydrophobicContact CG1-CD2 4.26Å; V833-F837 HydrophobicContact CG1-CE2 3.91Å; V833-F837 WeakPolarHBondContact O-CD2 3.37Å; V833-F837 PolarHBondContact O-N 3.31Å; L834-F837 HydrophobicContact CD2-CD2 4.37Å; L834-F837 WeakPolarHBondContact O-CB 3.4Å; L834-F837 PolarHBondContact O-N 2.8Å; F837-F839 VanDerWaalsContact C-N 3.26Å; F837-F839 PolarHBondContact O-N 2.76Å; F837-L840 PolarHBondContact O-N 3.45Å; F837-F841 HydrophobicContact CB-CD2 4.28Å; F837-F841 HydrophobicContact CB-CE2 4.22Å; F837-F841 HydrophobicContact CD1-CD2 4.47Å; F837-F841 AromaticContact CD1-CE2 3.76Å; F837-F841 HydrophobicContact CD1-CE2 3.76Å; F837-F841 HydrophobicContact CD1-CZ 4.5Å; F837-F841 HydrophobicContact CG-CE2 4.41Å; F837-F841 WeakPolarHBondContact O-CD2 3.46Å; F837-F841 PolarHBondContact O-N 3.39Å
838	W	90	Very high	89.8	Confident	33 Å²	33	20.4 Å²	20.4	13%	0.125	10%	0.1	C	C	.	.	H	α-helix	trans	-62.5	-38.4	-177.4	78.7	-104.7	0	0	0	111.9	A8 I11 V12 A502 F505 Y506 L834 N835 L840 G842	A8-W838 HydrophobicContact CB-CZ2 4.2Å; I11-W838 HydrophobicContact CB-CH2 4.25Å; I11-W838 HydrophobicContact CB-CZ2 4.34Å; I11-W838 HydrophobicContact CD1-CH2 4Å; I11-W838 HydrophobicContact CG2-CH2 3.85Å; I11-W838 HydrophobicContact CG2-CZ2 4.23Å; V12-W838 HydrophobicContact CG2-CZ2 4.15Å; A502-W838 WeakPolarHBondContact O-CB 3.33Å; F505-W838 HydrophobicContact CB-CB 3.7Å; Y506-W838 AromaticContact CD2-CD2 3.73Å; Y506-W838 HydrophobicContact CD2-CD2 3.73Å; Y506-W838 AromaticContact CD2-CE2 3.61Å; Y506-W838 HydrophobicContact CD2-CE3 4.07Å; Y506-W838 HydrophobicContact CD2-CG 4.19Å; Y506-W838 HydrophobicContact CD2-CH2 4.26Å; Y506-W838 AromaticContact CD2-CZ2 3.91Å; Y506-W838 HydrophobicContact CD2-CZ2 3.91Å; Y506-W838 HydrophobicContact CD2-CZ3 4.32Å; Y506-W838 AromaticContact CD2-NE1 3.88Å; Y506-W838 HydrophobicContact CE2-CH2 4.46Å; Y506-W838 HydrophobicContact CE2-CZ2 4.21Å; Y506-W838 HydrophobicContact CG-CD2 4.27Å; Y506-W838 HydrophobicContact CG-CE3 4.47Å; Y506-W838 HydrophobicContact CG-CG 4.47Å; L834-W838 PolarHBondContact O-N 2.94Å; N835-W838 VanDerWaalsContact CA-CD1 3.48Å; N835-W838 PolarHBondContact O-NE1 2.64Å; N835-W838 VanDerWaalsContact O-NE1 3.16Å; N835-W838 PolarHBondContact OD1-NE1 2.8Å; W838-L840 VanDerWaalsContact C-N 3.33Å; W838-L840 PolarHBondContact O-N 3.23Å; W838-G842 PolarHBondContact O-N 3.01Å
839	F	90.4	Very high	89.9	Confident	42 Å²	42	18 Å²	18	18%	0.184	9%	0.088	C	C	.	.	H	α-helix	trans	-62.7	-43.4	179.8	-172.7	-91.8	0	0	0	110.7	I4 A8 I11 N835 G836 F837 W843	I4-F839 HydrophobicContact CG2-CB 4.46Å; I4-F839 HydrophobicContact CG2-CD1 3.6Å; I4-F839 HydrophobicContact CG2-CE1 4.14Å; I4-F839 HydrophobicContact CG2-CG 4.24Å; A8-F839 HydrophobicContact CB-CB 4.25Å; A8-F839 HydrophobicContact CB-CD2 4.46Å; I11-F839 HydrophobicContact CD1-CD2 4.08Å; I11-F839 HydrophobicContact CD1-CE2 3.76Å; N835-F839 WeakPolarHBondContact O-CB 3.47Å; N835-F839 PolarHBondContact O-N 2.76Å; G836-F839 PolarHBondContact O-N 3.01Å; F837-F839 VanDerWaalsContact C-N 3.26Å; F837-F839 PolarHBondContact O-N 2.76Å; F839-W843 HydrophobicContact CD1-CE3 4.21Å; F839-W843 AromaticContact CE1-CE3 3.59Å; F839-W843 HydrophobicContact CE1-CE3 3.59Å; F839-W843 AromaticContact CE1-CZ3 3.94Å; F839-W843 HydrophobicContact CE1-CZ3 3.94Å; F839-W843 HydrophobicContact CZ-CE3 4.45Å; F839-W843 WeakPolarHBondContact O-CB 3.41Å; F839-W843 PolarHBondContact O-N 3.35Å
840	L	91.2	Very high	89.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-72	-44.6	178.5	-73.3	169.7	0	0	0	113.2	I4 L161 V165 W452 G836 F837 W838 G842 W843 V844	I4-L840 HydrophobicContact CD1-CD2 4.32Å; L161-L840 HydrophobicContact CB-CD1 4.17Å; L161-L840 HydrophobicContact CB-CD2 3.83Å; L161-L840 HydrophobicContact CD1-CD2 4.34Å; V165-L840 HydrophobicContact CB-CD1 4.21Å; V165-L840 HydrophobicContact CG2-CD1 3.2Å; W452-L840 HydrophobicContact CH2-CB 4.44Å; G836-L840 WeakPolarHBondContact O-CB 3.36Å; G836-L840 WeakPolarHBondContact O-CG 3.24Å; G836-L840 PolarHBondContact O-N 2.89Å; F837-L840 PolarHBondContact O-N 3.45Å; W838-L840 VanDerWaalsContact C-N 3.33Å; W838-L840 PolarHBondContact O-N 3.23Å; L840-G842 VanDerWaalsContact C-N 3.28Å; L840-G842 PolarHBondContact O-N 3.15Å; L840-W843 PolarHBondContact O-N 3.43Å; L840-V844 VanDerWaalsContact O-CB 3.31Å; L840-V844 WeakPolarHBondContact O-CB 3.47Å; L840-V844 WeakPolarHBondContact O-CG2 3.49Å; L840-V844 PolarHBondContact O-N 2.78Å
841	F	91.7	Very high	89.7	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.4	-40.8	174	-75.9	-66.3	0	0	0	111.2	F451 W452 S498 L501 A502 F505 F837 T845	F451-F841 HydrophobicContact CD1-CD1 4.46Å; F451-F841 AromaticContact CD1-CE1 3.66Å; F451-F841 HydrophobicContact CD1-CE1 3.66Å; F451-F841 AromaticContact CE1-CD1 3.7Å; F451-F841 HydrophobicContact CE1-CD1 3.7Å; F451-F841 AromaticContact CE1-CE1 3.34Å; F451-F841 HydrophobicContact CE1-CE1 3.34Å; F451-F841 HydrophobicContact CE2-CE1 4.48Å; F451-F841 HydrophobicContact CG-CE1 4.38Å; F451-F841 AromaticContact CZ-CD1 3.91Å; F451-F841 HydrophobicContact CZ-CD1 3.91Å; F451-F841 AromaticContact CZ-CE1 3.79Å; F451-F841 HydrophobicContact CZ-CE1 3.79Å; W452-F841 HydrophobicContact CH2-CD1 4.09Å; W452-F841 HydrophobicContact CH2-CE1 4.17Å; W452-F841 HydrophobicContact CZ2-CD1 4.2Å; W452-F841 AromaticContact CZ2-CE1 3.87Å; W452-F841 HydrophobicContact CZ2-CE1 3.87Å; W452-F841 HydrophobicContact CZ2-CZ 4.08Å; S498-F841 PolarHBondContact OG-O 2.9Å; L501-F841 HydrophobicContact CD1-CE1 4.21Å; L501-F841 HydrophobicContact CD1-CZ 4.23Å; A502-F841 HydrophobicContact CB-CB 3.61Å; F505-F841 AromaticContact CD2-CD2 3.88Å; F505-F841 HydrophobicContact CD2-CD2 3.88Å; F505-F841 AromaticContact CD2-CE2 3.77Å; F505-F841 HydrophobicContact CD2-CE2 3.77Å; F505-F841 HydrophobicContact CE2-CD2 4.21Å; F505-F841 AromaticContact CE2-CE2 3.63Å; F505-F841 HydrophobicContact CE2-CE2 3.63Å; F505-F841 HydrophobicContact CE2-CZ 4.44Å; F837-F841 HydrophobicContact CB-CD2 4.28Å; F837-F841 HydrophobicContact CB-CE2 4.22Å; F837-F841 HydrophobicContact CD1-CD2 4.47Å; F837-F841 AromaticContact CD1-CE2 3.76Å; F837-F841 HydrophobicContact CD1-CE2 3.76Å; F837-F841 HydrophobicContact CD1-CZ 4.5Å; F837-F841 HydrophobicContact CG-CE2 4.41Å; F837-F841 WeakPolarHBondContact O-CD2 3.46Å; F837-F841 PolarHBondContact O-N 3.39Å; F841-T845 WeakPolarHBondContact O-CB 3.35Å; F841-T845 PolarHBondContact O-N 3.32Å; F841-T845 PolarHBondContact O-OG1 2.93Å
842	G	90.9	Very high	89.4	Confident	21 Å²	21	18.9 Å²	18.9	22%	0.216	9%	0.092	C	C	.	.	H	α-helix	trans	-61.3	-49.1	174.4	0	0	0	0	0	112.2	W838 L840 T845 F846	W838-G842 PolarHBondContact O-N 3.01Å; L840-G842 VanDerWaalsContact C-N 3.28Å; L840-G842 PolarHBondContact O-N 3.15Å; G842-T845 PolarHBondContact O-N 3.13Å; G842-F846 WeakPolarHBondContact O-CB 3.34Å; G842-F846 PolarHBondContact O-N 2.91Å
843	W	91.8	Very high	89.1	Confident	80 Å²	80	22.3 Å²	22.3	30%	0.303	11%	0.11	S	C	.	.	H	α-helix	trans	-57.4	-52.9	175.7	-173.2	-26.1	0	0	0	111.2	L154 A158 F839 L840 T845 F846 I847	L154-W843 HydrophobicContact CD2-CZ2 4.37Å; A158-W843 HydrophobicContact CB-CD2 4.4Å; A158-W843 HydrophobicContact CB-CG 4.31Å; F839-W843 HydrophobicContact CD1-CE3 4.21Å; F839-W843 AromaticContact CE1-CE3 3.59Å; F839-W843 HydrophobicContact CE1-CE3 3.59Å; F839-W843 AromaticContact CE1-CZ3 3.94Å; F839-W843 HydrophobicContact CE1-CZ3 3.94Å; F839-W843 HydrophobicContact CZ-CE3 4.45Å; F839-W843 WeakPolarHBondContact O-CB 3.41Å; F839-W843 PolarHBondContact O-N 3.35Å; L840-W843 PolarHBondContact O-N 3.43Å; W843-T845 VanDerWaalsContact C-N 3.28Å; W843-T845 PolarHBondContact O-N 3.43Å; W843-F846 WeakPolarHBondContact O-CB 3.35Å; W843-F846 PolarHBondContact O-N 2.8Å; W843-F846 VanDerWaalsContact O-N 3.09Å; W843-I847 PolarHBondContact O-N 3.06Å
844	V	91.6	Very high	88.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-40.6	-178.3	166.6	0	0	0	0	111	L155 A158 W452 I455 L840 G848	L155-V844 HydrophobicContact CD1-CB 4.2Å; L155-V844 HydrophobicContact CD1-CG1 3.9Å; L155-V844 HydrophobicContact CD1-CG2 4.23Å; A158-V844 HydrophobicContact CB-CG2 3.61Å; W452-V844 HydrophobicContact CH2-CG2 4.02Å; W452-V844 HydrophobicContact CZ3-CB 4.29Å; W452-V844 HydrophobicContact CZ3-CG1 4.17Å; W452-V844 HydrophobicContact CZ3-CG2 3.62Å; I455-V844 HydrophobicContact CG1-CG1 4.41Å; I455-V844 HydrophobicContact CG2-CG1 4.06Å; L840-V844 VanDerWaalsContact O-CB 3.31Å; L840-V844 WeakPolarHBondContact O-CB 3.47Å; L840-V844 WeakPolarHBondContact O-CG2 3.49Å; L840-V844 PolarHBondContact O-N 2.78Å; V844-G848 VanDerWaalsContact O-CA 3.31Å; V844-G848 WeakPolarHBondContact O-CA 3.35Å; V844-G848 PolarHBondContact O-N 3.23Å
845	T	89.6	Confident	88.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.8	-49.6	173.9	-51.3	0	0	0	0	110.5	L77 L495 S498 I499 F841 G842 W843 G848 T849	L77-T845 HydrophobicContact CD1-CG2 4.45Å; L495-T845 HydrophobicContact CB-CG2 4.45Å; S498-T845 WeakPolarHBondContact CB-OG1 3.41Å; S498-T845 PolarHBondContact OG-OG1 3.49Å; I499-T845 HydrophobicContact CB-CG2 3.82Å; I499-T845 HydrophobicContact CD1-CG2 4.35Å; I499-T845 HydrophobicContact CG1-CG2 4.44Å; F841-T845 WeakPolarHBondContact O-CB 3.35Å; F841-T845 PolarHBondContact O-N 3.32Å; F841-T845 PolarHBondContact O-OG1 2.93Å; G842-T845 PolarHBondContact O-N 3.13Å; W843-T845 VanDerWaalsContact C-N 3.28Å; W843-T845 PolarHBondContact O-N 3.43Å; T845-G848 PolarHBondContact O-N 3.27Å; T845-T849 HydrophobicContact CG2-CG2 4.22Å; T845-T849 WeakPolarHBondContact O-CB 3.26Å; T845-T849 WeakPolarHBondContact O-CG2 3.36Å; T845-T849 PolarHBondContact O-N 2.95Å; T845-T849 PolarHBondContact O-OG1 3.05Å
846	F	90.4	Very high	87.7	Confident	101 Å²	101	26.4 Å²	26.4	44%	0.443	13%	0.128	S	C	.	.	H	α-helix	trans	-58.4	-54.7	-179.1	-179.4	-104.9	0	0	0	112.1	W73 G842 W843 T849 L850	W73-F846 AromaticContact CH2-CD2 3.56Å; W73-F846 HydrophobicContact CH2-CD2 3.56Å; W73-F846 HydrophobicContact CH2-CE2 4.1Å; W73-F846 HydrophobicContact CZ2-CD2 4.23Å; W73-F846 HydrophobicContact CZ3-CD2 4.42Å; G842-F846 WeakPolarHBondContact O-CB 3.34Å; G842-F846 PolarHBondContact O-N 2.91Å; W843-F846 WeakPolarHBondContact O-CB 3.35Å; W843-F846 PolarHBondContact O-N 2.8Å; W843-F846 VanDerWaalsContact O-N 3.09Å; F846-T849 PolarHBondContact O-OG1 3.2Å; F846-L850 HydrophobicContact CD1-CD1 4.26Å; F846-L850 HydrophobicContact CE1-CD1 3.7Å; F846-L850 HydrophobicContact CE2-CD1 4.39Å; F846-L850 HydrophobicContact CZ-CD1 3.77Å; F846-L850 WeakPolarHBondContact O-CG 3.46Å; F846-L850 PolarHBondContact O-N 3.3Å
847	I	90.5	Very high	87.1	Confident	12 Å²	12	31.5 Å²	31.5	6%	0.062	16%	0.155	C	C	.	.	H	α-helix	trans	-69.8	-40.8	-178.7	-62.2	-61.7	0	0	0	111.2	L151 L155 W843 T849 L850 I851	L151-I847 HydrophobicContact CB-CG2 4.34Å; L151-I847 HydrophobicContact CD2-CD1 3.88Å; L151-I847 HydrophobicContact CD2-CG2 4.22Å; L151-I847 VanDerWaalsContact O-CG2 3.32Å; L151-I847 WeakPolarHBondContact O-CG2 3.5Å; L155-I847 HydrophobicContact CB-CG2 3.86Å; L155-I847 HydrophobicContact CD1-CG2 4.47Å; W843-I847 PolarHBondContact O-N 3.06Å; I847-T849 VanDerWaalsContact C-N 3.33Å; I847-T849 PolarHBondContact O-N 3.04Å; I847-L850 PolarHBondContact O-N 3.04Å; I847-I851 HydrophobicContact CG2-CD1 3.67Å; I847-I851 HydrophobicContact CG2-CG1 4.25Å; I847-I851 VanDerWaalsContact O-CG1 3.3Å; I847-I851 WeakPolarHBondContact O-CG1 3.36Å; I847-I851 PolarHBondContact O-N 2.86Å
848	G	89.1	Confident	86.1	Confident	4 Å²	4	34.3 Å²	34.3	4%	0.041	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-40.9	178	0	0	0	0	0	112.7	V844 T845 I851 M852	V844-G848 VanDerWaalsContact O-CA 3.31Å; V844-G848 WeakPolarHBondContact O-CA 3.35Å; V844-G848 PolarHBondContact O-N 3.23Å; T845-G848 PolarHBondContact O-N 3.27Å; G848-I851 PolarHBondContact O-N 3.26Å; G848-M852 VanDerWaalsContact O-CB 3.3Å; G848-M852 WeakPolarHBondContact O-CB 3.43Å; G848-M852 WeakPolarHBondContact O-CG 3.19Å; G848-M852 PolarHBondContact O-N 3.27Å
849	T	88.4	Confident	85.2	Confident	14 Å²	14	33.6 Å²	33.6	9%	0.086	17%	0.168	C	C	.	.	H	α-helix	trans	-66.5	-42.4	176.9	54	0	0	0	0	112.5	L77 L495 T845 F846 I847 L853	L77-T849 HydrophobicContact CD1-CG2 4.11Å; L77-T849 HydrophobicContact CD2-CG2 3.42Å; L77-T849 VanDerWaalsContact CD2-CG2 3.42Å; L77-T849 HydrophobicContact CG-CG2 4.36Å; L495-T849 HydrophobicContact CB-CG2 4.34Å; L495-T849 HydrophobicContact CD1-CG2 3.84Å; T845-T849 HydrophobicContact CG2-CG2 4.22Å; T845-T849 WeakPolarHBondContact O-CB 3.26Å; T845-T849 WeakPolarHBondContact O-CG2 3.36Å; T845-T849 PolarHBondContact O-N 2.95Å; T845-T849 PolarHBondContact O-OG1 3.05Å; F846-T849 PolarHBondContact O-OG1 3.2Å; I847-T849 VanDerWaalsContact C-N 3.33Å; I847-T849 PolarHBondContact O-N 3.04Å; T849-L853 WeakPolarHBondContact O-CB 3.36Å; T849-L853 PolarHBondContact O-N 3.48Å
850	L	88	Confident	84.1	Confident	55 Å²	55	33.3 Å²	33.3	29%	0.288	17%	0.168	S	C	.	.	H	α-helix	trans	-59.6	-50.9	174.3	-69.2	176.7	0	0	0	111.2	F846 I847 L853 F854	F846-L850 HydrophobicContact CD1-CD1 4.26Å; F846-L850 HydrophobicContact CE1-CD1 3.7Å; F846-L850 HydrophobicContact CE2-CD1 4.39Å; F846-L850 HydrophobicContact CZ-CD1 3.77Å; F846-L850 WeakPolarHBondContact O-CG 3.46Å; F846-L850 PolarHBondContact O-N 3.3Å; I847-L850 PolarHBondContact O-N 3.04Å; L850-L853 PolarHBondContact O-N 3.26Å; L850-F854 HydrophobicContact CB-CD2 4.29Å; L850-F854 HydrophobicContact CB-CE2 4.19Å; L850-F854 HydrophobicContact CD2-CE2 4.16Å; L850-F854 WeakPolarHBondContact O-CB 3.32Å; L850-F854 WeakPolarHBondContact O-CD2 3.33Å; L850-F854 WeakPolarHBondContact O-CG 3.22Å; L850-F854 PolarHBondContact O-N 2.71Å
851	I	85.6	Confident	82.8	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-51.9	179.7	-65.3	167.2	0	0	0	110.4	L148 L151 L155 L462 I847 G848 L853 F854 S855	L148-I851 HydrophobicContact CD1-CG2 4.18Å; L151-I851 HydrophobicContact CB-CD1 3.81Å; L151-I851 HydrophobicContact CB-CG1 3.52Å; L151-I851 HydrophobicContact CD1-CG1 4.2Å; L151-I851 HydrophobicContact CG-CG1 4.42Å; L151-I851 WeakPolarHBondContact O-CD1 3.26Å; L155-I851 HydrophobicContact CB-CD1 3.9Å; L155-I851 HydrophobicContact CD2-CD1 3.62Å; L155-I851 HydrophobicContact CG-CD1 4.41Å; L462-I851 HydrophobicContact CD1-CG2 3.82Å; I847-I851 HydrophobicContact CG2-CD1 3.67Å; I847-I851 HydrophobicContact CG2-CG1 4.25Å; I847-I851 VanDerWaalsContact O-CG1 3.3Å; I847-I851 WeakPolarHBondContact O-CG1 3.36Å; I847-I851 PolarHBondContact O-N 2.86Å; G848-I851 PolarHBondContact O-N 3.26Å; I851-L853 VanDerWaalsContact C-N 3.28Å; I851-L853 PolarHBondContact O-N 2.99Å; I851-F854 PolarHBondContact O-N 3.18Å; I851-S855 VanDerWaalsContact O-CB 3.25Å; I851-S855 WeakPolarHBondContact O-CB 3.49Å; I851-S855 PolarHBondContact O-N 3.47Å; I851-S855 PolarHBondContact O-OG 3.05Å
852	M	83.7	Confident	80.9	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.039	21%	0.208	C	C	.	.	H	α-helix	trans	-57.6	-42.6	-178.6	-74.7	-62.1	-69.2	0	0	112	I458 L462 A488 F492 L495 G848 L856	I458-M852 HydrophobicContact CG2-SD 4.15Å; L462-M852 HydrophobicContact CD1-CG 4.34Å; L462-M852 HydrophobicContact CD1-SD 3.37Å; L462-M852 WeakPolarHBondContact CD1-SD 3.26Å; L462-M852 HydrophobicContact CD2-SD 3.73Å; L462-M852 HydrophobicContact CG-SD 4.03Å; A488-M852 HydrophobicContact CB-CE 3.43Å; A488-M852 VanDerWaalsContact CB-CE 3.43Å; F492-M852 HydrophobicContact CD1-CB 4.44Å; F492-M852 HydrophobicContact CE1-CB 3.63Å; F492-M852 HydrophobicContact CE1-CG 4.48Å; F492-M852 HydrophobicContact CZ-CB 3.77Å; L495-M852 HydrophobicContact CD1-CG 4.14Å; G848-M852 VanDerWaalsContact O-CB 3.3Å; G848-M852 WeakPolarHBondContact O-CB 3.43Å; G848-M852 WeakPolarHBondContact O-CG 3.19Å; G848-M852 PolarHBondContact O-N 3.27Å; M852-L856 VanDerWaalsContact O-CB 3.25Å; M852-L856 WeakPolarHBondContact O-CB 3.23Å; M852-L856 WeakPolarHBondContact O-CD1 3.2Å; M852-L856 VanDerWaalsContact O-CG 3.23Å; M852-L856 WeakPolarHBondContact O-CG 3.16Å; M852-L856 PolarHBondContact O-N 3.3Å
853	L	83.3	Confident	78.8	Confident	80 Å²	80	46.5 Å²	46.5	42%	0.419	23%	0.23	S	C	.	.	H	α-helix	trans	-67.8	-47.4	179.8	-166.6	142.2	0	0	0	111.2	T849 L850 I851 L856 L857	T849-L853 WeakPolarHBondContact O-CB 3.36Å; T849-L853 PolarHBondContact O-N 3.48Å; L850-L853 PolarHBondContact O-N 3.26Å; I851-L853 VanDerWaalsContact C-N 3.28Å; I851-L853 PolarHBondContact O-N 2.99Å; L853-L856 PolarHBondContact O-N 3.18Å; L853-L857 HydrophobicContact CD2-CD1 3.6Å; L853-L857 HydrophobicContact CD2-CG 4.37Å; L853-L857 WeakPolarHBondContact O-CB 3.33Å; L853-L857 VanDerWaalsContact O-CG 3.24Å; L853-L857 WeakPolarHBondContact O-CG 3.46Å; L853-L857 PolarHBondContact O-N 2.78Å
854	F	81.3	Confident	76.6	Confident	82 Å²	82	46.8 Å²	46.8	36%	0.36	24%	0.242	S	C	.	.	H	α-helix	trans	-64.7	-45.1	176.6	-71.9	-56.6	0	0	0	112.5	L148 L151 L850 I851 L856 L857 L858	L148-F854 HydrophobicContact CD1-CB 4.01Å; L151-F854 HydrophobicContact CD1-CD2 4.35Å; L850-F854 HydrophobicContact CB-CD2 4.29Å; L850-F854 HydrophobicContact CB-CE2 4.19Å; L850-F854 HydrophobicContact CD2-CE2 4.16Å; L850-F854 WeakPolarHBondContact O-CB 3.32Å; L850-F854 WeakPolarHBondContact O-CD2 3.33Å; L850-F854 WeakPolarHBondContact O-CG 3.22Å; L850-F854 PolarHBondContact O-N 2.71Å; I851-F854 PolarHBondContact O-N 3.18Å; F854-L856 VanDerWaalsContact C-N 3.34Å; F854-L856 PolarHBondContact O-N 3.12Å; F854-L857 PolarHBondContact O-N 3.45Å; F854-L858 WeakPolarHBondContact O-CB 3.5Å; F854-L858 VanDerWaalsContact O-CG 3.3Å; F854-L858 WeakPolarHBondContact O-CG 3.3Å; F854-L858 PolarHBondContact O-N 2.74Å
855	S	78.5	Confident	74.2	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-43.3	176.3	-65.5	0	0	0	0	111.6	I851 L858 L859	I851-S855 VanDerWaalsContact O-CB 3.25Å; I851-S855 WeakPolarHBondContact O-CB 3.49Å; I851-S855 PolarHBondContact O-N 3.47Å; I851-S855 PolarHBondContact O-OG 3.05Å; S855-L858 PolarHBondContact O-N 3.01Å; S855-L859 VanDerWaalsContact O-CB 3.26Å; S855-L859 WeakPolarHBondContact O-CB 3.11Å; S855-L859 WeakPolarHBondContact O-CD1 3.41Å; S855-L859 VanDerWaalsContact O-CG 3.24Å; S855-L859 WeakPolarHBondContact O-CG 3.48Å; S855-L859 PolarHBondContact O-N 3.01Å
856	L	77.8	Confident	71.9	Confident	20 Å²	20	57.2 Å²	57.2	11%	0.105	30%	0.297	C	S	.	.	H	α-helix	trans	-64.2	-44.8	175.1	-80.5	168.9	0	0	0	111.8	T84 A488 F492 M852 L853 F854 L858 M860	T84-L856 HydrophobicContact CG2-CD1 4.23Å; A488-L856 HydrophobicContact CB-CD1 3.93Å; A488-L856 HydrophobicContact CB-CD2 3.77Å; A488-L856 HydrophobicContact CB-CG 4.13Å; F492-L856 HydrophobicContact CE2-CD1 3.38Å; F492-L856 HydrophobicContact CZ-CD1 3.65Å; M852-L856 VanDerWaalsContact O-CB 3.25Å; M852-L856 WeakPolarHBondContact O-CB 3.23Å; M852-L856 WeakPolarHBondContact O-CD1 3.2Å; M852-L856 VanDerWaalsContact O-CG 3.23Å; M852-L856 WeakPolarHBondContact O-CG 3.16Å; M852-L856 PolarHBondContact O-N 3.3Å; L853-L856 PolarHBondContact O-N 3.18Å; F854-L856 VanDerWaalsContact C-N 3.34Å; F854-L856 PolarHBondContact O-N 3.12Å; L856-L858 VanDerWaalsContact C-N 3.3Å; L856-L858 PolarHBondContact O-N 2.93Å; L856-M860 HydrophobicContact CD2-CG 4.49Å; L856-M860 WeakPolarHBondContact O-CB 3.09Å; L856-M860 WeakPolarHBondContact O-CG 3.49Å; L856-M860 PolarHBondContact O-N 3.41Å
857	L	75.4	Confident	69.7	Low	107 Å²	107	59.8 Å²	59.8	56%	0.56	31%	0.31	S	S	*	.	H	α-helix	trans	-59.1	-43	177.4	-73.4	173.3	0	0	0	111.4	L853 F854 H861	L853-L857 HydrophobicContact CD2-CD1 3.6Å; L853-L857 HydrophobicContact CD2-CG 4.37Å; L853-L857 WeakPolarHBondContact O-CB 3.33Å; L853-L857 VanDerWaalsContact O-CG 3.24Å; L853-L857 WeakPolarHBondContact O-CG 3.46Å; L853-L857 PolarHBondContact O-N 2.78Å; F854-L857 PolarHBondContact O-N 3.45Å; L857-H861 WeakPolarHBondContact O-CB 3.24Å; L857-H861 PolarHBondContact O-N 2.86Å
858	L	70.2	Confident	67.4	Low	58 Å²	58	63.7 Å²	63.7	30%	0.304	34%	0.338	S	S	.	.	H	α-helix	trans	-67.8	-51.8	178.2	-70.1	170.5	0	0	0	112.2	L148 F854 S855 L856 M860 H861	L148-L858 HydrophobicContact CD2-CD1 4.18Å; F854-L858 WeakPolarHBondContact O-CB 3.5Å; F854-L858 VanDerWaalsContact O-CG 3.3Å; F854-L858 WeakPolarHBondContact O-CG 3.3Å; F854-L858 PolarHBondContact O-N 2.74Å; S855-L858 PolarHBondContact O-N 3.01Å; L856-L858 VanDerWaalsContact C-N 3.3Å; L856-L858 PolarHBondContact O-N 2.93Å; L858-M860 VanDerWaalsContact C-N 3.28Å; L858-M860 PolarHBondContact O-N 3.47Å; L858-H861 PolarHBondContact O-N 2.85Å
859	L	69.5	Low	65.2	Low	18 Å²	18	66.8 Å²	66.8	9%	0.094	36%	0.359	C	S	.	.	H	α-helix	trans	-64.6	-33.4	-178.7	-72.4	165.6	0	0	0	112.1	L465 Y469 I476 I484 S855	L465-L859 HydrophobicContact CB-CD1 4.47Å; Y469-L859 HydrophobicContact CD2-CD2 3.75Å; Y469-L859 HydrophobicContact CG-CD2 4.09Å; I476-L859 HydrophobicContact CD1-CD2 4.1Å; I484-L859 HydrophobicContact CG2-CD1 4.13Å; S855-L859 VanDerWaalsContact O-CB 3.26Å; S855-L859 WeakPolarHBondContact O-CB 3.11Å; S855-L859 WeakPolarHBondContact O-CD1 3.41Å; S855-L859 VanDerWaalsContact O-CG 3.24Å; S855-L859 WeakPolarHBondContact O-CG 3.48Å; S855-L859 PolarHBondContact O-N 3.01Å
860	M	67.7	Low	63	Low	37 Å²	37	70.4 Å²	70.4	18%	0.182	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-1.9	-178.3	-61.5	-63.9	-63.7	0	0	113.7	R481 R485 L856 L858 K862	R481-M860 HydrophobicContact CG-CE 4.05Å; R481-M860 HydrophobicContact CG-SD 3.57Å; R481-M860 VanDerWaalsContact CG-SD 3.57Å; R481-M860 PolarHBondContact NE-SD 3.4Å; R481-M860 VanDerWaalsContact NH2-C 3.34Å; R481-M860 PolarHBondContact NH2-O 3.32Å; R485-M860 HydrophobicContact CG-CE 4.46Å; R485-M860 HydrophobicContact CG-SD 4.35Å; L856-M860 HydrophobicContact CD2-CG 4.49Å; L856-M860 WeakPolarHBondContact O-CB 3.09Å; L856-M860 WeakPolarHBondContact O-CG 3.49Å; L856-M860 PolarHBondContact O-N 3.41Å; L858-M860 VanDerWaalsContact C-N 3.28Å; L858-M860 PolarHBondContact O-N 3.47Å; M860-K862 VanDerWaalsContact C-N 3.34Å
861	H	63.1	Low	61	Low	89 Å²	89	72.1 Å²	72.1	41%	0.412	39%	0.394	S	S	.	.			trans	-72.2	-25.6	178.3	-166.4	-90.5	0	0	0	113.1	R131 L857 L858 T863	R131-H861 PolarHBondContact NH2-CD2 3.28Å; R131-H861 VanDerWaalsContact NH2-CD2 3.27Å; R131-H861 PolarHBondContact NH2-NE2 2.91Å; L857-H861 WeakPolarHBondContact O-CB 3.24Å; L857-H861 PolarHBondContact O-N 2.86Å; L858-H861 PolarHBondContact O-N 2.85Å; H861-T863 PolarHBondContact O-N 3.1Å
862	K	53.5	Low	58.9	Low	100 Å²	100	79.8 Å²	79.8	44%	0.435	43%	0.43	S	S	.	.	S	Bend	trans	-70.6	121.4	179.4	-72.9	-173	-178.8	176.7	0	110.9	T474 R481 M860	T474-K862 PolarHBondContact O-NZ 3.12Å; R481-K862 PolarHBondContact NH1-O 3.39Å; R481-K862 PolarHBondContact NH2-O 2.99Å; M860-K862 VanDerWaalsContact C-N 3.34Å
863	T	45.1	Very low	56.8	Low	109 Å²	109	88.1 Å²	88.1	67%	0.669	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-64.1	135.3	174.8	42.3	0	0	0	0	109.8	H861 I865	H861-T863 PolarHBondContact O-N 3.1Å; T863-I865 PolarHBondContact O-N 3.35Å
864	P	46.8	Very low	54.7	Low	86 Å²	86	88.5 Å²	88.5	56%	0.558	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-60.2	136.7	166.2	27.3	-30.8	0	0	0	108.4	D866	P864-D866 PolarHBondContact O-N 3.44Å
865	I	40.7	Very low	52.6	Low	90 Å²	90	94 Å²	94	46%	0.462	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-57.2	122.7	169.7	-70.6	-179.4	0	0	0	107.4	E475 T863 Q867	E475-I865 WeakPolarHBondContact OE1-CD1 2.95Å; E475-I865 WeakPolarHBondContact OE2-CD1 3.46Å; T863-I865 PolarHBondContact O-N 3.35Å; I865-Q867 PolarHBondContact O-N 3.2Å
866	D	41.6	Very low	50.6	Low	129 Å²	129	102.3 Å²	102.3	69%	0.69	53%	0.533	S	S	*	.			trans	-58	111	162.4	-79.6	-34.2	0	0	0	106.9	P864 S868 S869	P864-D866 PolarHBondContact O-N 3.44Å; D866-S868 PolarHBondContact O-N 3.04Å; D866-S869 PolarHBondContact O-N 2.05Å
867	Q	43.5	Very low	48.7	Very low	155 Å²	155	112.1 Å²	112.1	72%	0.724	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	2.5	177.7	-76.4	-178.9	-24.2	0	0	113.4	I865 S869 T870	I865-Q867 PolarHBondContact O-N 3.2Å; Q867-S869 PolarHBondContact O-N 2.73Å; Q867-T870 PolarHBondContact O-N 3.37Å; Q867-T870 PolarHBondContact O-OG1 3.48Å
868	S	43.8	Very low	46.8	Very low	94 Å²	94	114.5 Å²	114.5	66%	0.657	58%	0.582	S	S	*	*	H	α-helix	trans	-64.3	-19.9	170.7	57.2	0	0	0	0	112.9	D866	D866-S868 PolarHBondContact O-N 3.04Å
869	S	43	Very low	45.4	Very low	69 Å²	69	119 Å²	119	48%	0.483	61%	0.605	S	S	.	*	H	α-helix	trans	-87.3	-13.4	176.8	65.7	0	0	0	0	114.9	D866 Q867	D866-S869 PolarHBondContact O-N 2.05Å; Q867-S869 PolarHBondContact O-N 2.73Å
870	T	40.9	Very low	43.6	Very low	90 Å²	90	127.4 Å²	127.4	55%	0.552	64%	0.641	S	S	*	*	H	α-helix	trans	-89.6	-18.5	174.3	37.6	0	0	0	0	113.8	Q867 E872 K873	Q867-T870 PolarHBondContact O-N 3.37Å; Q867-T870 PolarHBondContact O-OG1 3.48Å; T870-E872 VanDerWaalsContact C-N 3.26Å; T870-E872 PolarHBondContact O-N 3.13Å; T870-K873 PolarHBondContact O-N 3.25Å
871	V	45.9	Very low	42	Very low	91 Å²	91	135.2 Å²	135.2	55%	0.552	68%	0.676	S	S	*	*	H	α-helix	trans	-67.9	-29.7	173.2	-179.1	0	0	0	0	111.2	K873 S874	V871-K873 VanDerWaalsContact C-N 3.29Å; V871-K873 PolarHBondContact O-N 2.74Å; V871-S874 PolarHBondContact O-N 3.11Å
872	E	41.3	Very low	40.5	Very low	162 Å²	162	139.7 Å²	139.7	76%	0.757	70%	0.695	S	S	*	*	H	α-helix	trans	-71	-20.9	179.2	-129.7	175.2	-171.6	0	0	113.8	T870	T870-E872 VanDerWaalsContact C-N 3.26Å; T870-E872 PolarHBondContact O-N 3.13Å
873	K	39.6	Very low	39.5	Very low	183 Å²	183	141.2 Å²	141.2	80%	0.796	71%	0.708	S	S	*	*	H	α-helix	trans	-93.7	-16.8	176.3	-74.6	-174.3	177.5	179.1	0	114.4	T870 V871	T870-K873 PolarHBondContact O-N 3.25Å; V871-K873 VanDerWaalsContact C-N 3.29Å; V871-K873 PolarHBondContact O-N 2.74Å
874	S	38.8	Very low	39	Very low	88 Å²	88	143.8 Å²	143.8	62%	0.615	72%	0.716	S	S	*	*	H	α-helix	trans	-80.4	-24.9	177.5	-175.6	0	0	0	0	113.1	V871 H876	V871-S874 PolarHBondContact O-N 3.11Å; S874-H876 VanDerWaalsContact C-N 3.3Å; S874-H876 PolarHBondContact O-N 2.91Å
875	Y	37.6	Very low	38.9	Very low	196 Å²	196	145.4 Å²	145.4	77%	0.769	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-9.5	-178.4	-106.6	-86.6	0	0	0	114.4
876	H	36.9	Very low	38.5	Very low	178 Å²	178	146.3 Å²	146.3	82%	0.824	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	4.3	-176.8	-104.1	-30.7	0	0	0	116.5	S874	S874-H876 VanDerWaalsContact C-N 3.3Å; S874-H876 PolarHBondContact O-N 2.91Å
877	R	37.5	Very low	37.8	Very low	226 Å²	226	149.7 Å²	149.7	85%	0.853	75%	0.754	S	S	*	*	S	Bend	trans	-106.7	-7.1	-177.9	-136.4	177.4	-162.4	170.8	4	116.8
878	N	36.4	Very low	37.2	Very low	157 Å²	157	145.5 Å²	145.5	84%	0.84	75%	0.753	S	S	*	*	S	Bend	trans	-102.6	20.8	-176.7	-83.3	-5.9	0	0	0	115.7
879	I	39.5	Very low	36.4	Very low	153 Å²	153	147.2 Å²	147.2	79%	0.785	76%	0.759	S	S	*	*	S	Bend	trans	-125.3	72.4	170.1	-50.8	176.4	0	0	0	108.8
880	K	33	Very low	35.7	Very low	193 Å²	193	152.1 Å²	152.1	84%	0.839	78%	0.775	S	S	*	*			trans	177.8	78.1	155.6	-105	176.2	-178.8	-175.5	0	109.7
881	H	33	Very low	35.2	Very low	202 Å²	202	154.9 Å²	154.9	94%	0.935	79%	0.791	S	S	*	*			trans	-164.9	88	150.8	-94.9	-50.5	0	0	0	108
882	K	31.9	Very low	34.3	Very low	183 Å²	183	155.2 Å²	155.2	80%	0.796	80%	0.798	S	S	*	*			trans	-137.3	130.6	161	-136.1	-173.5	178.3	-177.3	0	107.4
883	D	32.5	Very low	33.8	Very low	132 Å²	132	153.5 Å²	153.5	71%	0.706	80%	0.799	S	S	*	*			trans	79.1	106.8	162.5	-47.1	-36.7	0	0	0	117.4
884	I	35.9	Very low	33.4	Very low	163 Å²	163	152.3 Å²	152.3	84%	0.836	80%	0.801	S	S	*	*				-177.8	135.3	98.4	-81.7	153.9	0	0	0	109.6
885	P	43	Very low	33.4	Very low	119 Å²	119	153.6 Å²	153.6	77%	0.773	81%	0.807	S	S	*	*			trans	-99.3	147.7	179.3	37	-31.1	0	0	0	113.5
886	S	31.9	Very low	33.4	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	80%	0.801	S	S	*	*			trans	-167.1	113.4	151.8	65.1	0	0	0	0	111.3
887	M	28.8	Very low	33.5	Very low	201 Å²	201	148.8 Å²	148.8	99%	0.99	80%	0.802	S	S	*	*				53.6	124.5	116.2	-79.3	-169.9	92.8	0	0	117.9
888	G	29.7	Very low	33.7	Very low	67 Å²	67	145.8 Å²	145.8	69%	0.691	80%	0.802	S	S	*	*			trans	147.2	82.2	149.4	0	0	0	0	0	117
889	T	27.4	Very low	33.9	Very low	129 Å²	129	145.5 Å²	145.5	79%	0.791	80%	0.796	S	S	*	*			trans	46.8	116.6	136.3	29.7	0	0	0	0	122.4
890	E	27.2	Very low	34	Very low	173 Å²	173	142.4 Å²	142.4	81%	0.808	79%	0.793	S	S	*	*				41	114.2	128.5	-64.7	-178.9	169.1	0	0	119.9
891	T	30.5	Very low	34.6	Very low	147 Å²	147	140.9 Å²	140.9	90%	0.902	79%	0.793	S	S	*	*				-170.7	144.5	115.5	14.8	0	0	0	0	112.7
892	S	27	Very low	35	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	78%	0.781	S	S	*	*			trans	-42.5	144.1	177.3	55.7	0	0	0	0	117.5
893	T	30.6	Very low	35.1	Very low	127 Å²	127	135.8 Å²	135.8	78%	0.779	78%	0.782	S	S	*	*				178.2	113.2	111.6	25.1	0	0	0	0	113.1
894	N	32.6	Very low	35.3	Very low	157 Å²	157	145.1 Å²	145.1	84%	0.84	81%	0.807	S	S	*	*			trans	62.8	143	139.8	-79.3	-18.6	0	0	0	125
895	P	37.8	Very low	35.3	Very low	116 Å²	116	144.2 Å²	144.2	75%	0.753	81%	0.805	S	S	*	*			trans	-99.6	142.5	-168.8	38.2	-27.7	0	0	0	113
896	S	38	Very low	34.9	Very low	91 Å²	91	145.5 Å²	145.5	64%	0.636	81%	0.807	S	S	*	*			trans	-160.8	43.8	161.9	56.3	0	0	0	0	113
897	E	38.3	Very low	35	Very low	182 Å²	182	147.6 Å²	147.6	85%	0.85	81%	0.81	S	S	*	*			trans	-93.7	-4.1	166.5	-81.2	-168.2	151.2	0	0	113.3	E899 A900	E897-E899 PolarHBondContact O-N 2.93Å; E897-A900 PolarHBondContact O-N 3.35Å
898	L	42.4	Very low	35.4	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-3	167.3	-149.1	80.8	0	0	0	112.9
899	E	41.6	Very low	35.7	Very low	152 Å²	152	149.3 Å²	149.3	71%	0.71	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-13.5	178.3	-143.3	168.3	-167.4	0	0	113.3	E897 L901	E897-E899 PolarHBondContact O-N 2.93Å; E899-L901 VanDerWaalsContact C-N 3.34Å
900	A	41.3	Very low	36.3	Very low	87 Å²	87	150.6 Å²	150.6	72%	0.719	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-12.2	177.8	0	0	0	0	0	113.8	E897	E897-A900 PolarHBondContact O-N 3.35Å
901	L	44.7	Very low	36.9	Very low	161 Å²	161	149 Å²	149	84%	0.843	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-1.6	174.8	-97.4	160.6	0	0	0	113.8	E899	E899-L901 VanDerWaalsContact C-N 3.34Å
902	N	41.2	Very low	37.4	Very low	128 Å²	128	149.2 Å²	149.2	68%	0.684	80%	0.799	S	S	*	*	S	Bend	trans	-120.7	9.8	-175.1	-149.2	21.8	0	0	0	116.8
903	N	34.7	Very low	38.3	Very low	151 Å²	151	153.4 Å²	153.4	81%	0.807	81%	0.809	S	S	*	*			trans	-164.8	90.2	169.6	-89.5	-39.6	0	0	0	114.2
904	R	36.5	Very low	39	Very low	327 Å²	327	155.8 Å²	155.8	100%	1.234	81%	0.811	S	S	*	*			trans	177.9	0	142.7	-107.6	176.8	-178.4	177.8	3.1	110.8

Retrieved 904 of 904 residues in 2873.6 ms (Link to these results)

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