A0A096N3U7_PAPAN Loading...

V-type proton ATPase subunit a

Essential component of the vacuolar proton pump (V-ATPase), a multimeric enzyme that catalyzes the translocation of protons across the membranes. Required for assembly and activity of the V-ATPase.

AlphaFold DB (A0A2K5NTV8), UniProt , Accession A0A096N3U7, Species PAPAN (Papio anubis, Olive baboon), Gene ATP6V0A4, Length 838 aa.

						>A0A096N3U7_PAPAN|A0A096N3U7|ATP6V0A4
MASVFRSEEMCLSQLFLQVEAAYCCVAELGELGLVQFKDLNMNVNSFQRKFVNEVRRCESLERILRFLEDEMQNEIAVQLPEKSPLTPLPREMITLETVLEKLEGELQEANQNQQALKKSFLELTELKYLLKKTQDFFETETNLADDFFTEDTSGLLELKAVPAHMTGKLGFIAGVINRERMASFERLLWRICRGNVYLKFSEMDAPLEDPVTKEEIQKNIFIIFYQGEQLRQKIKKICDGFRATVYPCPEPAVERREMLESVNVRLEDLITVITQTESHRQRLLQEAAANWHSWLIKVQKMKAVYHILNMCNIDVTQQCVIAEIWFPVADATRIKRALEQGMELSGSSMAPIMTTVQSKTAPPTFNRTNKFTAGFQNIVDAYGVGSYREINPAPYTIITFPFLFAVMFGDCGHGTVMLLAALWMVLNERRLLSQKTDNEIWNTFFHGRYLILLMGIFSIYTGLIYNDCFSKSLNIFGSSWSVQPMFRNGTWNTHVMEENPYLQLDPAIPGVYFGNPYPFGIDPIWNLASNKLTFLNSYKMKMSVILGIVQMVFGVILSLFNHIYFRRTLNIILQFIPEMIFILCLFGYLVFMIIFKWCCFDVHVSQHAPSILIHFINMFLFNYSDSSNAPLYKHQQEVQSFFVVMALISVPWMLLIKPFILRARHRKSQLQASRIQEDATENIEGDSSSPSSGSGQRTSAHGAQDDHGEEFNFGDIFVHQAIHTIEYCLGCISNTASYLRLWALSLAHAQLSEVLWTMVMNNGLQMRGWGGIVGVFIIFAVFAVLTVAILLIMEGLSAFLHALRLHWVEFQNKFYVGDGYKFSPFSFKHILDGTAEE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	74.1	Confident	253 Å²	253	66.6 Å²	66.6	100%	1.246	36%	0.355	S	S	*	.				0	71.1	0	-67.2	-178.6	-163.1	0	0	109.3
2	A	44.1	Very low	75.5	Confident	80 Å²	80	61.6 Å²	61.6	66%	0.661	33%	0.328	S	S	*	.			trans	-133.4	7.9	-169.2	0	0	0	0	0	114.4
3	S	58.7	Low	76.6	Confident	20 Å²	20	56.8 Å²	56.8	14%	0.14	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	6.5	-166.2	53	0	0	0	0	117	R6 E8	S3-R6 CarbonylContact C-O 3.52Å; S3-E8 WeakPolarHBondContact CB-OE1 3.33Å; S3-E8 PolarHBondContact OG-OE1 2.79Å
4	V	67.8	Low	77.6	Confident	52 Å²	52	56.6 Å²	56.6	32%	0.315	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-31	173.9	-158.5	0	0	0	0	111	T373 N392 P395	V4-T373 HydrophobicContact CG1-CG2 4.36Å; V4-N392 WeakPolarHBondContact O-CB 3.48Å; V4-N392 PolarHBondContact O-ND2 3.39Å; V4-P395 HydrophobicContact CB-CG 4.47Å; V4-P395 HydrophobicContact CG1-CG 3.86Å; V4-P395 WeakPolarHBondContact O-CG 3.43Å
5	F	82.1	Confident	78.4	Confident	122 Å²	122	52.9 Å²	52.9	54%	0.535	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-30.1	-178.6	-73.7	-74.3	0	0	0	113.6	I391 N392 P395	F5-I391 WeakPolarHBondContact O-CA 3.38Å; F5-N392 PolarHBondContact O-N 3.38Å; F5-P395 HydrophobicContact CD1-CG 4.33Å; F5-P395 HydrophobicContact CE1-CB 4.35Å
6	R	84.5	Confident	79.1	Confident	41 Å²	41	53.2 Å²	53.2	16%	0.155	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-144.6	159	178.1	-66.2	-176.5	-176.3	-102.7	-0.5	109.2	S3 R389 E390 I391 F561 Y565	S3-R6 CarbonylContact C-O 3.52Å; R6-R389 PolarHBondContact NH1-O 2.96Å; R6-E390 WeakPolarHBondContact CA-O 3.34Å; R6-I391 HydrophobicContact CG-CG1 4.39Å; R6-F561 PolarHBondContact NH2-O 2.74Å; R6-Y565 VanDerWaalsContact CZ-CG 3.44Å
7	S	86.1	Confident	79.6	Confident	11 Å²	11	50.2 Å²	50.2	8%	0.077	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-59.2	152.4	175	78.7	0	0	0	0	112.5	F366 N367 R389	S7-F366 WeakPolarHBondContact CA-O 3.36Å; S7-N367 VanDerWaalsContact CA-OD1 3.28Å; S7-N367 WeakPolarHBondContact CA-OD1 3.44Å; S7-R389 VanDerWaalsContact OG-CA 3.29Å; S7-R389 WeakPolarHBondContact OG-CA 3.32Å; S7-R389 PolarHBondContact OG-N 2.96Å
8	E	87.2	Confident	80	Confident	19 Å²	19	50.2 Å²	50.2	9%	0.089	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-65.6	153.5	174.7	-58.1	-140.9	139.8	0	0	111.7	S3 M10 F366 R368 Y388	S3-E8 WeakPolarHBondContact CB-OE1 3.33Å; S3-E8 PolarHBondContact OG-OE1 2.79Å; E8-M10 PolarHBondContact O-N 3.13Å; E8-F366 HydrophobicContact CB-CD1 4.19Å; E8-F366 HydrophobicContact CG-CD1 3.85Å; E8-F366 HydrophobicContact CG-CE1 4.49Å; E8-F366 PolarHBondContact N-O 2.91Å; E8-R368 WeakPolarHBondContact OE1-CD 3.47Å; E8-R368 VanDerWaalsContact OE1-CG 3.28Å; E8-R368 WeakPolarHBondContact OE1-CG 3.43Å; E8-R368 IonicContact OE1-CZ 3.79Å; E8-R368 IonicContact OE1-NE 2.72Å; E8-R368 PolarHBondContact OE1-NE 3.01Å; E8-R368 IonicContact OE1-NH2 3.98Å; E8-R368 IonicContact OE2-CZ 2.72Å; E8-R368 IonicContact OE2-NE 3.63Å; E8-R368 PolarHBondContact OE2-NE 3.08Å; E8-R368 IonicContact OE2-NH2 3.98Å; E8-R368 PolarHBondContact OE2-NH2 3.03Å; E8-Y388 VanDerWaalsContact O-CE2 3.22Å; E8-Y388 WeakPolarHBondContact O-CE2 3.3Å
9	E	88	Confident	80.3	Confident	94 Å²	94	51.1 Å²	51.1	44%	0.439	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-74.8	119.6	171.2	-68.8	-175.5	171.3	0	0	109.5	P328 V329 Y388 R389	E9-P328 WeakPolarHBondContact O-CA 3.48Å; E9-V329 HydrophobicContact CB-CB 4.48Å; E9-V329 HydrophobicContact CB-CG2 4.15Å; E9-V329 WeakPolarHBondContact O-CG2 3.4Å; E9-V329 PolarHBondContact O-N 2.73Å; E9-Y388 VanDerWaalsContact CA-OH 3.31Å; E9-Y388 WeakPolarHBondContact CA-OH 3.24Å; E9-R389 IonicContact OE1-CZ 3.35Å; E9-R389 IonicContact OE1-NE 3.49Å; E9-R389 IonicContact OE1-NH1 3.68Å; E9-R389 PolarHBondContact OE1-NH1 3.41Å; E9-R389 IonicContact OE1-NH2 3.78Å; E9-R389 PolarHBondContact OE1-NH2 2.92Å
10	M	89.8	Confident	80.4	Confident	15 Å²	15	55.7 Å²	55.7	7%	0.074	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	145	176.3	-69	-57.1	-168.4	0	0	111.3	E8 W326 P328 P363 P364 F366 Y388 F823	E8-M10 PolarHBondContact O-N 3.13Å; M10-W326 HydrophobicContact CB-CE3 4.02Å; M10-W326 HydrophobicContact CB-CZ3 4.31Å; M10-P328 HydrophobicContact CE-CG 4.3Å; M10-P328 HydrophobicContact SD-CB 4.37Å; M10-P328 HydrophobicContact SD-CG 4.06Å; M10-P363 HydrophobicContact CB-CB 3.88Å; M10-P363 HydrophobicContact CG-CB 4.48Å; M10-P364 HydrophobicContact CE-CG 4.32Å; M10-P364 HydrophobicContact CG-CG 4.26Å; M10-P364 WeakPolarHBondContact CG-O 3.24Å; M10-F366 HydrophobicContact CE-CB 3.1Å; M10-F366 HydrophobicContact CE-CD1 4.26Å; M10-F366 HydrophobicContact CE-CG 3.97Å; M10-Y388 HydrophobicContact CB-CE2 4.05Å; M10-Y388 HydrophobicContact CG-CE2 4.07Å; M10-Y388 PolarHBondContact N-OH 3.22Å; M10-F823 HydrophobicContact CE-CB 4.09Å; M10-F823 HydrophobicContact CE-CD1 4.11Å; M10-F823 HydrophobicContact CE-CD2 3.56Å; M10-F823 HydrophobicContact CE-CE1 4.42Å; M10-F823 HydrophobicContact CE-CE2 3.93Å; M10-F823 HydrophobicContact CE-CG 3.65Å; M10-F823 HydrophobicContact CE-CZ 4.34Å
11	C	88.3	Confident	80.7	Confident	26 Å²	26	53.2 Å²	53.2	18%	0.176	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.5	170.8	-170.3	0	0	0	0	109.5	F327 V329	C11-F327 HydrophobicContact CB-CE2 4.33Å; C11-F327 HydrophobicContact CB-CZ 4.31Å; C11-F327 PolarHBondContact N-O 3.33Å; C11-F327 PolarHBondContact O-N 3.15Å; C11-V329 HydrophobicContact CB-CG2 3.87Å
12	L	91.1	Very high	83	Confident	6 Å²	6	41.4 Å²	41.4	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123.6	165.4	-175.4	67.9	0	0	0	107.7	E324 I325 W326 V357	L12-E324 HydrophobicContact CD1-CB 4.27Å; L12-I325 WeakPolarHBondContact CA-O 3.31Å; L12-W326 HydrophobicContact CB-CD2 4.31Å; L12-W326 HydrophobicContact CB-CE3 3.9Å; L12-W326 HydrophobicContact CB-CH2 3.71Å; L12-W326 HydrophobicContact CB-CZ2 4.11Å; L12-W326 HydrophobicContact CB-CZ3 3.58Å; L12-W326 HydrophobicContact CD1-CD2 3.93Å; L12-W326 HydrophobicContact CD1-CE3 4.39Å; L12-W326 HydrophobicContact CD1-CG 4.33Å; L12-W326 HydrophobicContact CD1-CH2 4.48Å; L12-W326 HydrophobicContact CD1-CZ2 4.03Å; L12-W326 HydrophobicContact CD2-CZ2 4.41Å; L12-W326 HydrophobicContact CG-CH2 4.48Å; L12-W326 HydrophobicContact CG-CZ2 4.42Å; L12-V357 HydrophobicContact CD2-CB 4.39Å; L12-V357 HydrophobicContact CD2-CG1 4.44Å; L12-V357 PolarHBondContact O-N 2.91Å
13	S	89.9	Confident	85.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	147.8	169.9	-52.4	0	0	0	0	111.5	I325 F327 T355	S13-I325 PolarHBondContact N-O 3.31Å; S13-I325 WeakPolarHBondContact O-CG1 3.48Å; S13-I325 PolarHBondContact O-N 3.21Å; S13-F327 WeakPolarHBondContact OG-CE1 3.4Å; S13-F327 VanDerWaalsContact OG-CZ 3.28Å; S13-F327 WeakPolarHBondContact OG-CZ 3.42Å; S13-T355 CarbonylContact C-O 3.51Å; S13-T355 VanDerWaalsContact CA-O 3.23Å; S13-T355 WeakPolarHBondContact CA-O 2.85Å; S13-T355 WeakPolarHBondContact CB-O 3.23Å
14	Q	90.8	Very high	86.5	Confident	54 Å²	54	38 Å²	38	25%	0.252	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.7	167.6	-79.5	173.6	-7.7	0	0	109	F16 A323 E324 M354 T355 V357	Q14-F16 HydrophobicContact CB-CE2 4.25Å; Q14-A323 CarbonylContact C-O 3.53Å; Q14-A323 WeakPolarHBondContact CA-O 3.22Å; Q14-E324 HydrophobicContact CG-CG 3.62Å; Q14-E324 PolarHBondContact NE2-OE1 3.22Å; Q14-M354 WeakPolarHBondContact O-CA 3.36Å; Q14-T355 PolarHBondContact N-O 3.35Å; Q14-T355 PolarHBondContact O-N 3Å; Q14-V357 HydrophobicContact CB-CG2 4.08Å; Q14-V357 HydrophobicContact CG-CG2 3.65Å
15	L	89.7	Confident	87.5	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.4	172.4	-75.6	173.3	0	0	0	109.6	L29 I322 A323 I325 L339 I353 M354	L15-L29 HydrophobicContact CD1-CD1 4.18Å; L15-I322 WeakPolarHBondContact O-CA 3.47Å; L15-A323 HydrophobicContact CB-CB 4.32Å; L15-A323 PolarHBondContact N-O 3.41Å; L15-A323 PolarHBondContact O-N 3.24Å; L15-I325 HydrophobicContact CD1-CD1 3.37Å; L15-I325 HydrophobicContact CD1-CG1 3.82Å; L15-I325 HydrophobicContact CD1-CG2 3.97Å; L15-I325 HydrophobicContact CD2-CD1 4.39Å; L15-I325 HydrophobicContact CG-CD1 3.77Å; L15-I325 HydrophobicContact CG-CG1 3.97Å; L15-L339 HydrophobicContact CD2-CD1 3.58Å; L15-I353 WeakPolarHBondContact CA-O 3.48Å; L15-M354 HydrophobicContact CD2-CB 3.85Å; L15-M354 HydrophobicContact CD2-CG 3.9Å; L15-M354 HydrophobicContact CD2-SD 4.43Å
16	F	89.4	Confident	87.8	Confident	58 Å²	58	29.8 Å²	29.8	25%	0.254	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.6	168	-62.8	-90.1	0	0	0	108.5	Q14 I322 P352 I353	Q14-F16 HydrophobicContact CB-CE2 4.25Å; F16-I322 HydrophobicContact CD1-CD1 4.4Å; F16-I322 HydrophobicContact CD1-CG1 3.89Å; F16-I322 HydrophobicContact CE1-CD1 3.91Å; F16-I322 HydrophobicContact CE1-CG1 3.83Å; F16-I322 HydrophobicContact CE1-CG2 4.35Å; F16-P352 WeakPolarHBondContact O-CA 3.3Å; F16-I353 HydrophobicContact CB-CB 4.29Å; F16-I353 HydrophobicContact CD2-CB 4.34Å; F16-I353 PolarHBondContact N-O 2.91Å; F16-I353 PolarHBondContact O-N 3.39Å
17	L	88.1	Confident	88.1	Confident	2 Å²	2	28 Å²	28	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.7	-179.7	-57.8	172	0	0	0	109.1	A22 C25 V26 C320 V321 L339 P352	L17-A22 HydrophobicContact CB-CB 4.23Å; L17-C25 HydrophobicContact CD1-CB 4.43Å; L17-C25 HydrophobicContact CD2-CB 3.94Å; L17-V26 HydrophobicContact CD1-CG2 4.3Å; L17-C320 CarbonylContact O-C 3.58Å; L17-C320 WeakPolarHBondContact O-CA 3.23Å; L17-V321 HydrophobicContact CB-CB 4.33Å; L17-V321 PolarHBondContact N-O 2.86Å; L17-V321 PolarHBondContact O-N 3.43Å; L17-L339 HydrophobicContact CD2-CD2 4.06Å; L17-P352 HydrophobicContact CD2-CB 3.71Å
18	Q	87.1	Confident	88.1	Confident	51 Å²	51	28.9 Å²	28.9	24%	0.238	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	144.9	168.6	-169	-179.5	-8.2	0	0	109.7	E20 A21 A22 S348	Q18-E20 PolarHBondContact O-N 2.64Å; Q18-E20 VanDerWaalsContact O-N 3.17Å; Q18-A21 PolarHBondContact O-N 3.28Å; Q18-A21 VanDerWaalsContact O-N 3.07Å; Q18-A22 WeakPolarHBondContact O-CB 3.43Å; Q18-A22 PolarHBondContact O-N 3.19Å; Q18-S348 PolarHBondContact OE1-OG 3.47Å
19	V	84.4	Confident	88.2	Confident	67 Å²	67	28 Å²	28	41%	0.406	14%	0.141	S	C	.	.	H	α-helix	trans	-54.7	-37.6	-177.4	171.4	0	0	0	0	113.1	Q319 V321	V19-Q319 VanDerWaalsContact CG2-O 3.26Å; V19-Q319 WeakPolarHBondContact CG2-O 3.4Å; V19-Q319 PolarHBondContact N-O 3.01Å; V19-V321 HydrophobicContact CG2-CG2 4.04Å
20	E	83.3	Confident	88.2	Confident	142 Å²	142	23.6 Å²	23.6	66%	0.664	12%	0.12	S	C	*	.	H	α-helix	trans	-69.5	-35.5	179.4	-63	-179.4	169.6	0	0	113.2	Q18	Q18-E20 PolarHBondContact O-N 2.64Å; Q18-E20 VanDerWaalsContact O-N 3.17Å
21	A	85.8	Confident	88	Confident	5 Å²	5	25.6 Å²	25.6	4%	0.041	13%	0.129	C	C	.	.	H	α-helix	trans	-88.7	-18	179.6	0	0	0	0	0	112.8	Q18 Y23 C24 C25 S346	Q18-A21 PolarHBondContact O-N 3.28Å; Q18-A21 VanDerWaalsContact O-N 3.07Å; A21-Y23 VanDerWaalsContact C-N 3.29Å; A21-Y23 PolarHBondContact O-N 3.37Å; A21-C24 PolarHBondContact O-N 2.96Å; A21-C25 WeakPolarHBondContact O-CB 3.45Å; A21-C25 PolarHBondContact O-N 3.06Å; A21-C25 PolarHBondContact O-SG 3.42Å; A21-C25 VanDerWaalsContact O-SG 3.34Å; A21-S346 WeakPolarHBondContact CB-OG 3.36Å
22	A	86.5	Confident	88	Confident	4 Å²	4	26.8 Å²	26.8	3%	0.033	13%	0.133	C	C	.	.	H	α-helix	trans	-55.4	-42.5	-172.2	0	0	0	0	0	112.6	L17 Q18 V26 L309 V321	L17-A22 HydrophobicContact CB-CB 4.23Å; Q18-A22 WeakPolarHBondContact O-CB 3.43Å; Q18-A22 PolarHBondContact O-N 3.19Å; A22-V26 WeakPolarHBondContact O-CB 3.48Å; A22-V26 WeakPolarHBondContact O-CG2 3.21Å; A22-V26 PolarHBondContact O-N 3.01Å; A22-L309 HydrophobicContact CB-CD2 3.99Å; A22-V321 HydrophobicContact CB-CB 4.42Å; A22-V321 HydrophobicContact CB-CG2 3.99Å
23	Y	89.1	Confident	87.7	Confident	16 Å²	16	27 Å²	27	6%	0.063	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-50.7	178.6	-173.1	-86.4	0	0	0	112.3	A21 V26 A27 P88 P90 M302 V305 Y306 L309	A21-Y23 VanDerWaalsContact C-N 3.29Å; A21-Y23 PolarHBondContact O-N 3.37Å; Y23-V26 PolarHBondContact O-N 3.36Å; Y23-A27 WeakPolarHBondContact O-CB 3.32Å; Y23-A27 PolarHBondContact O-N 3.02Å; Y23-P88 WeakPolarHBondContact CE1-O 3.46Å; Y23-P90 HydrophobicContact CD1-CG 3.54Å; Y23-P90 HydrophobicContact CD2-CG 4.06Å; Y23-P90 HydrophobicContact CE1-CG 3.83Å; Y23-P90 HydrophobicContact CE2-CG 4.32Å; Y23-P90 HydrophobicContact CG-CG 3.66Å; Y23-M302 WeakPolarHBondContact OH-CG 3.44Å; Y23-V305 HydrophobicContact CD2-CG1 3.56Å; Y23-V305 HydrophobicContact CE2-CB 4.08Å; Y23-V305 HydrophobicContact CE2-CG1 3.55Å; Y23-V305 HydrophobicContact CG-CG1 4.18Å; Y23-Y306 HydrophobicContact CD2-CD1 4.32Å; Y23-Y306 AromaticContact CD2-CE1 3.68Å; Y23-Y306 HydrophobicContact CD2-CE1 3.68Å; Y23-Y306 HydrophobicContact CE2-CD1 4.21Å; Y23-Y306 HydrophobicContact CE2-CD2 4.5Å; Y23-Y306 AromaticContact CE2-CE1 3.61Å; Y23-Y306 HydrophobicContact CE2-CE1 3.61Å; Y23-Y306 AromaticContact CE2-CE2 3.98Å; Y23-Y306 HydrophobicContact CE2-CE2 3.98Å; Y23-Y306 AromaticContact CE2-CZ 3.51Å; Y23-L309 HydrophobicContact CD2-CD1 4.18Å
24	C	87.9	Confident	87.6	Confident	13 Å²	13	28.6 Å²	28.6	9%	0.088	15%	0.145	C	C	.	.	H	α-helix	trans	-65.3	-40.9	-179.5	-65.7	0	0	0	0	111.9	A21 A27 E28 G342	A21-C24 PolarHBondContact O-N 2.96Å; C24-A27 PolarHBondContact O-N 3.33Å; C24-E28 PolarHBondContact O-N 3.46Å; C24-G342 VanDerWaalsContact CB-O 3.32Å; C24-G342 WeakPolarHBondContact CB-O 3.44Å
25	C	87.9	Confident	87.5	Confident	1 Å²	1	26 Å²	26	1%	0.007	13%	0.133	C	C	.	.	H	α-helix	trans	-63.8	-45.4	176.2	-68.1	0	0	0	0	111.8	L17 A21 A27 E28 L29 L339	L17-C25 HydrophobicContact CD1-CB 4.43Å; L17-C25 HydrophobicContact CD2-CB 3.94Å; A21-C25 WeakPolarHBondContact O-CB 3.45Å; A21-C25 PolarHBondContact O-N 3.06Å; A21-C25 PolarHBondContact O-SG 3.42Å; A21-C25 VanDerWaalsContact O-SG 3.34Å; C25-A27 VanDerWaalsContact C-N 3.31Å; C25-A27 PolarHBondContact O-N 3.36Å; C25-E28 PolarHBondContact O-N 2.9Å; C25-L29 WeakPolarHBondContact O-CB 3.43Å; C25-L29 VanDerWaalsContact O-CG 3.23Å; C25-L29 WeakPolarHBondContact O-CG 2.87Å; C25-L29 PolarHBondContact O-N 3.21Å; C25-L339 HydrophobicContact CB-CD2 3.98Å
26	V	89.8	Confident	87.6	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-35.9	177.7	174	0	0	0	0	111.2	L17 A22 Y23 L29 G30 V305 I308 L309 F826	L17-V26 HydrophobicContact CD1-CG2 4.3Å; A22-V26 WeakPolarHBondContact O-CB 3.48Å; A22-V26 WeakPolarHBondContact O-CG2 3.21Å; A22-V26 PolarHBondContact O-N 3.01Å; Y23-V26 PolarHBondContact O-N 3.36Å; V26-L29 PolarHBondContact O-N 2.86Å; V26-G30 PolarHBondContact O-N 3.07Å; V26-V305 HydrophobicContact CB-CG1 4.15Å; V26-V305 HydrophobicContact CG1-CB 4.44Å; V26-V305 HydrophobicContact CG1-CG1 3.9Å; V26-V305 HydrophobicContact CG1-CG2 4.42Å; V26-I308 HydrophobicContact CG1-CB 3.99Å; V26-I308 HydrophobicContact CG1-CG2 3.78Å; V26-L309 HydrophobicContact CG2-CD2 4.03Å; V26-F826 HydrophobicContact CG1-CE1 4.02Å
27	A	89.1	Confident	87.7	Confident	3 Å²	3	25.6 Å²	25.6	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-60.6	-49.9	173.7	0	0	0	0	0	112	Y23 C24 C25 L29 G30 E31 T87 V305 F828	Y23-A27 WeakPolarHBondContact O-CB 3.32Å; Y23-A27 PolarHBondContact O-N 3.02Å; C24-A27 PolarHBondContact O-N 3.33Å; C25-A27 VanDerWaalsContact C-N 3.31Å; C25-A27 PolarHBondContact O-N 3.36Å; A27-L29 VanDerWaalsContact C-N 3.33Å; A27-L29 PolarHBondContact O-N 3.28Å; A27-G30 WeakPolarHBondContact O-CA 3.48Å; A27-G30 PolarHBondContact O-N 3.03Å; A27-G30 VanDerWaalsContact O-N 3.07Å; A27-E31 PolarHBondContact O-N 3.09Å; A27-T87 HydrophobicContact CB-CG2 4.01Å; A27-V305 HydrophobicContact CB-CG2 4.33Å; A27-F828 VanDerWaalsContact O-CE2 3.28Å; A27-F828 WeakPolarHBondContact O-CE2 3.46Å
28	E	87.6	Confident	87.7	Confident	31 Å²	31	29 Å²	29	15%	0.145	15%	0.146	C	C	.	.	H	α-helix	trans	-64.2	-36.6	176.8	-71.8	-61.5	159.3	0	0	112.5	C24 C25 G30 E31 L32 A338 L345	C24-E28 PolarHBondContact O-N 3.46Å; C25-E28 PolarHBondContact O-N 2.9Å; E28-G30 VanDerWaalsContact C-N 3.29Å; E28-G30 PolarHBondContact O-N 3.29Å; E28-E31 PolarHBondContact O-N 2.91Å; E28-L32 WeakPolarHBondContact O-CB 3.44Å; E28-L32 PolarHBondContact O-N 3.04Å; E28-A338 HydrophobicContact CB-CB 4.47Å; E28-L345 HydrophobicContact CG-CD1 4.38Å; E28-L345 WeakPolarHBondContact OE1-CD1 3.33Å
29	L	88.5	Confident	87.8	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-36.9	172.1	-71	177.6	0	0	0	112.2	L15 C25 V26 A27 L32 G33 V35 F37 I335 L339	L15-L29 HydrophobicContact CD1-CD1 4.18Å; C25-L29 WeakPolarHBondContact O-CB 3.43Å; C25-L29 VanDerWaalsContact O-CG 3.23Å; C25-L29 WeakPolarHBondContact O-CG 2.87Å; C25-L29 PolarHBondContact O-N 3.21Å; V26-L29 PolarHBondContact O-N 2.86Å; A27-L29 VanDerWaalsContact C-N 3.33Å; A27-L29 PolarHBondContact O-N 3.28Å; L29-L32 PolarHBondContact O-N 2.97Å; L29-G33 PolarHBondContact O-N 3.5Å; L29-V35 HydrophobicContact CD2-CG2 4.14Å; L29-F37 HydrophobicContact CD1-CZ 4.04Å; L29-I335 HydrophobicContact CD2-CG2 3.86Å; L29-L339 HydrophobicContact CD1-CD2 3.99Å; L29-L339 HydrophobicContact CD2-CD2 4.25Å; L29-L339 HydrophobicContact CD2-CG 4.26Å; L29-L339 HydrophobicContact CG-CD2 4.17Å
30	G	87.9	Confident	87.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-71.2	-33.5	175.8	0	0	0	0	0	114.2	V26 A27 E28 L32 F826 S827 F828	V26-G30 PolarHBondContact O-N 3.07Å; A27-G30 WeakPolarHBondContact O-CA 3.48Å; A27-G30 PolarHBondContact O-N 3.03Å; A27-G30 VanDerWaalsContact O-N 3.07Å; E28-G30 VanDerWaalsContact C-N 3.29Å; E28-G30 PolarHBondContact O-N 3.29Å; G30-L32 VanDerWaalsContact C-N 3.35Å; G30-F826 VanDerWaalsContact CA-CE1 3.43Å; G30-S827 WeakPolarHBondContact O-CA 3.24Å; G30-F828 PolarHBondContact O-N 3.3Å; G30-F828 VanDerWaalsContact O-N 3.13Å
31	E	86.9	Confident	87.9	Confident	57 Å²	57	22.8 Å²	22.8	27%	0.266	12%	0.117	S	C	.	.	H	α-helix	trans	-68.2	-37.5	171.5	-72.1	-62.9	164.9	0	0	111.4	A27 E28 K301 F828	A27-E31 PolarHBondContact O-N 3.09Å; E28-E31 PolarHBondContact O-N 2.91Å; E31-K301 IonicContact OE1-NZ 3.73Å; E31-K301 PolarHBondContact OE1-NZ 3.45Å; E31-K301 IonicContact OE2-NZ 2.77Å; E31-F828 HydrophobicContact CG-CD2 3.93Å; E31-F828 HydrophobicContact CG-CE2 3.97Å; E31-F828 WeakPolarHBondContact OE1-CD2 3.41Å
32	L	86.5	Confident	87.6	Confident	52 Å²	52	29.8 Å²	29.8	27%	0.272	15%	0.15	S	C	.	.	H	α-helix	trans	-72.9	-40.5	179.1	-179.8	142.5	0	0	0	112.6	E28 L29 G30 L34 R334 I335 A338	E28-L32 WeakPolarHBondContact O-CB 3.44Å; E28-L32 PolarHBondContact O-N 3.04Å; L29-L32 PolarHBondContact O-N 2.97Å; G30-L32 VanDerWaalsContact C-N 3.35Å; L32-L34 HydrophobicContact CD2-CB 3.48Å; L32-L34 VanDerWaalsContact CD2-CB 3.48Å; L32-L34 HydrophobicContact CD2-CD1 3.65Å; L32-L34 HydrophobicContact CD2-CG 3.51Å; L32-L34 HydrophobicContact CG-CD1 4.21Å; L32-L34 HydrophobicContact CG-CG 4.27Å; L32-R334 HydrophobicContact CD1-CB 4.12Å; L32-I335 HydrophobicContact CD2-CG1 4.08Å; L32-A338 HydrophobicContact CD1-CB 3.84Å
33	G	85.6	Confident	87.4	Confident	9 Å²	9	37.5 Å²	37.5	9%	0.093	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	33.2	167.9	0	0	0	0	0	116.3	L29 P825 F826	L29-G33 PolarHBondContact O-N 3.5Å; G33-P825 VanDerWaalsContact O-CB 3.24Å; G33-P825 WeakPolarHBondContact O-CB 3.15Å; G33-F826 WeakPolarHBondContact CA-O 3.49Å
34	L	87.1	Confident	87.2	Confident	34 Å²	34	39.3 Å²	39.3	18%	0.178	20%	0.203	C	C	.	.			trans	-123.7	12	-176.3	-57.1	177.1	0	0	0	113.7	L32 D331 F823	L32-L34 HydrophobicContact CD2-CB 3.48Å; L32-L34 VanDerWaalsContact CD2-CB 3.48Å; L32-L34 HydrophobicContact CD2-CD1 3.65Å; L32-L34 HydrophobicContact CD2-CG 3.51Å; L32-L34 HydrophobicContact CG-CD1 4.21Å; L32-L34 HydrophobicContact CG-CG 4.27Å; L34-D331 HydrophobicContact CD1-CB 3.8Å; L34-F823 WeakPolarHBondContact O-CZ 3.4Å
35	V	90.1	Very high	87.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.			trans	-125.9	131.2	-171.5	-178.5	0	0	0	0	110	L29 F37 I325 F327 I335 F826	L29-V35 HydrophobicContact CD2-CG2 4.14Å; V35-F37 HydrophobicContact CG1-CE2 4.21Å; V35-F37 HydrophobicContact CG1-CZ 4.44Å; V35-I325 HydrophobicContact CG1-CB 3.47Å; V35-I325 VanDerWaalsContact CG1-CB 3.47Å; V35-I325 HydrophobicContact CG1-CD1 3.75Å; V35-I325 HydrophobicContact CG1-CG1 4.24Å; V35-I325 HydrophobicContact CG1-CG2 3.48Å; V35-I325 VanDerWaalsContact CG1-CG2 3.48Å; V35-I325 HydrophobicContact CG2-CD1 4.45Å; V35-F327 HydrophobicContact CG2-CB 4.42Å; V35-I335 HydrophobicContact CG2-CD1 3.73Å; V35-I335 HydrophobicContact CG2-CG1 4.03Å; V35-I335 HydrophobicContact CG2-CG2 4.46Å; V35-F826 WeakPolarHBondContact O-CB 3.33Å; V35-F826 PolarHBondContact O-N 2.98Å
36	Q	91.8	Very high	86.7	Confident	28 Å²	28	47.3 Å²	47.3	13%	0.131	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.3	170.6	-178.8	177.6	13.1	0	0	109	I325 W326 F823 S824	Q36-I325 WeakPolarHBondContact O-CA 3.18Å; Q36-W326 HydrophobicContact CB-CB 4.29Å; Q36-W326 PolarHBondContact N-O 2.94Å; Q36-W326 PolarHBondContact O-N 3.06Å; Q36-F823 HydrophobicContact CB-CD2 3.9Å; Q36-F823 HydrophobicContact CB-CE2 3.44Å; Q36-F823 VanDerWaalsContact CB-CE2 3.44Å; Q36-F823 HydrophobicContact CB-CZ 4.22Å; Q36-S824 WeakPolarHBondContact CG-O 3.41Å; Q36-S824 PolarHBondContact NE2-OG 3.01Å
37	F	91	Very high	86.2	Confident	21 Å²	21	54.7 Å²	54.7	9%	0.092	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	140	177.3	-70.2	-93.3	0	0	0	110.3	L29 V35 I308 M311 A323 I325 F826	L29-F37 HydrophobicContact CD1-CZ 4.04Å; V35-F37 HydrophobicContact CG1-CE2 4.21Å; V35-F37 HydrophobicContact CG1-CZ 4.44Å; F37-I308 HydrophobicContact CD1-CG2 3.7Å; F37-I308 HydrophobicContact CD2-CD1 4Å; F37-I308 HydrophobicContact CD2-CG1 4.33Å; F37-I308 HydrophobicContact CD2-CG2 3.57Å; F37-I308 HydrophobicContact CE1-CG2 3.68Å; F37-I308 HydrophobicContact CE2-CG1 4.49Å; F37-I308 HydrophobicContact CE2-CG2 3.55Å; F37-I308 HydrophobicContact CG-CD1 4.48Å; F37-I308 HydrophobicContact CG-CG2 3.65Å; F37-I308 HydrophobicContact CZ-CG2 3.61Å; F37-M311 HydrophobicContact CB-CE 4.31Å; F37-A323 HydrophobicContact CD1-CB 4.18Å; F37-A323 HydrophobicContact CE1-CB 4.12Å; F37-I325 HydrophobicContact CD1-CG2 3.56Å; F37-I325 HydrophobicContact CE1-CG2 3.6Å; F37-I325 HydrophobicContact CG-CG2 4.15Å; F37-I325 HydrophobicContact CZ-CG2 4.22Å; F37-F826 HydrophobicContact CD2-CB 4.07Å; F37-F826 HydrophobicContact CD2-CG 4.43Å; F37-F826 HydrophobicContact CE2-CB 4.13Å; F37-F826 AromaticContact CE2-CD1 3.96Å; F37-F826 HydrophobicContact CE2-CD1 3.96Å; F37-F826 HydrophobicContact CE2-CG 4.24Å
38	K	88.8	Confident	85.9	Confident	75 Å²	75	61.2 Å²	61.2	33%	0.326	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	132.4	169.9	-179	177.1	163	-152.4	0	108.9	L40 E324	K38-L40 PolarHBondContact O-N 3.2Å; K38-E324 HydrophobicContact CB-CB 4.08Å; K38-E324 HydrophobicContact CD-CB 4.45Å; K38-E324 WeakPolarHBondContact CD-OE2 3.39Å; K38-E324 PolarHBondContact N-O 3.36Å; K38-E324 IonicContact NZ-OE2 2.96Å; K38-E324 PolarHBondContact NZ-OE2 3.32Å
39	D	88.6	Confident	85.8	Confident	43 Å²	43	61.9 Å²	61.9	23%	0.23	31%	0.314	C	S	.	.			trans	-69.4	115.1	175.8	-165	-11.5	0	0	0	109.8	N41 M42 R49 M311	D39-N41 WeakPolarHBondContact OD1-CA 3.34Å; D39-N41 PolarHBondContact OD1-N 3.17Å; D39-M42 HydrophobicContact CB-CG 4.17Å; D39-R49 IonicContact OD1-NH2 2.74Å; D39-R49 IonicContact OD2-CZ 2.96Å; D39-R49 IonicContact OD2-NH1 3.9Å; D39-R49 IonicContact OD2-NH2 3.56Å; D39-R49 PolarHBondContact OD2-NH2 3.45Å; D39-M311 HydrophobicContact CB-CG 4.39Å; D39-M311 HydrophobicContact CB-SD 4.34Å
40	L	86.1	Confident	85.5	Confident	56 Å²	56	69.5 Å²	69.5	29%	0.293	35%	0.347	S	S	.	.	S	Bend	trans	-86.1	-14.8	175.9	-67.7	174.1	0	0	0	112	K38 M311 N313 I322 E324	K38-L40 PolarHBondContact O-N 3.2Å; L40-M311 PolarHBondContact N-O 3.12Å; L40-M311 VanDerWaalsContact N-O 3.16Å; L40-N313 HydrophobicContact CB-CB 4.15Å; L40-N313 HydrophobicContact CD1-CB 3.91Å; L40-I322 WeakPolarHBondContact CD1-O 3.33Å; L40-E324 HydrophobicContact CD2-CB 4.09Å; L40-E324 HydrophobicContact CD2-CG 3.88Å
41	N	83.5	Confident	85.3	Confident	30 Å²	30	71 Å²	71	16%	0.16	35%	0.354	C	S	.	.			trans	-112.9	40.7	-171.3	-61.1	-32.3	0	0	0	111.8	D39 N43 V44 R49 N310 C312	D39-N41 WeakPolarHBondContact OD1-CA 3.34Å; D39-N41 PolarHBondContact OD1-N 3.17Å; N41-N43 VanDerWaalsContact C-N 3.25Å; N41-N43 PolarHBondContact O-N 3.14Å; N41-V44 HydrophobicContact CB-CB 4.41Å; N41-V44 HydrophobicContact CB-CG2 4.49Å; N41-V44 PolarHBondContact O-N 3.41Å; N41-R49 PolarHBondContact O-NH2 3Å; N41-N310 PolarHBondContact ND2-O 2.89Å; N41-C312 PolarHBondContact ND2-O 3.15Å
42	M	78.5	Confident	85.4	Confident	151 Å²	151	69.7 Å²	69.7	74%	0.744	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-30.9	-178.9	-66.6	-171.8	72.5	0	0	113.5	D39 V44	D39-M42 HydrophobicContact CB-CG 4.17Å; M42-V44 VanDerWaalsContact C-N 3.3Å; M42-V44 PolarHBondContact O-N 3.3Å
43	N	82.8	Confident	85.5	Confident	166 Å²	166	72.8 Å²	72.8	89%	0.888	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-2.6	-177.5	-63.3	-22.8	0	0	0	113.5	N41	N41-N43 VanDerWaalsContact C-N 3.25Å; N41-N43 PolarHBondContact O-N 3.14Å
44	V	85.7	Confident	85.6	Confident	54 Å²	54	75.1 Å²	75.1	33%	0.327	38%	0.375	S	S	.	.	S	Bend	trans	-107.3	128.5	-174.7	-177.1	0	0	0	0	109.7	N41 M42 Q48	N41-V44 HydrophobicContact CB-CB 4.41Å; N41-V44 HydrophobicContact CB-CG2 4.49Å; N41-V44 PolarHBondContact O-N 3.41Å; M42-V44 VanDerWaalsContact C-N 3.3Å; M42-V44 PolarHBondContact O-N 3.3Å; V44-Q48 HydrophobicContact CG1-CB 3.64Å
45	N	85.1	Confident	85.7	Confident	110 Å²	110	74.3 Å²	74.3	59%	0.588	37%	0.372	S	S	*	.			trans	-60	145.8	176.4	-75.7	-18.9	0	0	0	111.2	F47 Q48	N45-F47 PolarHBondContact O-N 3.06Å; N45-F47 VanDerWaalsContact O-N 3.1Å; N45-Q48 PolarHBondContact O-N 3.2Å
46	S	78.8	Confident	85.7	Confident	72 Å²	72	81.2 Å²	81.2	50%	0.503	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-49.8	-41.1	-178.6	55.6	0	0	0	0	113.4	Q48 R49 V52	S46-Q48 VanDerWaalsContact C-N 3.33Å; S46-Q48 PolarHBondContact O-N 3.29Å; S46-R49 WeakPolarHBondContact O-CB 3.21Å; S46-R49 PolarHBondContact O-N 3.25Å; S46-V52 WeakPolarHBondContact O-CG2 3.4Å
47	F	80.9	Confident	85.6	Confident	156 Å²	156	84 Å²	84	68%	0.684	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-68.6	-23.4	179.9	-62.6	-75.6	0	0	0	115.4	N45 R49	N45-F47 PolarHBondContact O-N 3.06Å; N45-F47 VanDerWaalsContact O-N 3.1Å; F47-R49 VanDerWaalsContact C-N 3.3Å
48	Q	83.2	Confident	85.5	Confident	140 Å²	140	83 Å²	83	65%	0.654	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-85.6	-8.3	-178.8	-68.6	174.6	-13.2	0	0	112.1	V44 N45 S46	V44-Q48 HydrophobicContact CG1-CB 3.64Å; N45-Q48 PolarHBondContact O-N 3.2Å; S46-Q48 VanDerWaalsContact C-N 3.33Å; S46-Q48 PolarHBondContact O-N 3.29Å
49	R	83.9	Confident	85.5	Confident	44 Å²	44	84 Å²	84	17%	0.166	41%	0.408	C	S	.	.	S	Bend	trans	-68.5	149.8	177.3	-59.1	-176.4	177.3	-163.5	-8.2	110.6	D39 N41 S46 F47 F51 V52 N310	D39-R49 IonicContact OD1-NH2 2.74Å; D39-R49 IonicContact OD2-CZ 2.96Å; D39-R49 IonicContact OD2-NH1 3.9Å; D39-R49 IonicContact OD2-NH2 3.56Å; D39-R49 PolarHBondContact OD2-NH2 3.45Å; N41-R49 PolarHBondContact O-NH2 3Å; S46-R49 WeakPolarHBondContact O-CB 3.21Å; S46-R49 PolarHBondContact O-N 3.25Å; F47-R49 VanDerWaalsContact C-N 3.3Å; R49-F51 PolarHBondContact O-N 3.14Å; R49-V52 HydrophobicContact CB-CG2 3.9Å; R49-V52 WeakPolarHBondContact O-CG2 3.41Å; R49-N310 HydrophobicContact CB-CB 4.36Å
50	K	82.1	Confident	85.6	Confident	161 Å²	161	84 Å²	84	70%	0.7	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-39.4	-168.5	-176.4	62.9	176.1	-176.9	0	113.9	I314	K50-I314 HydrophobicContact CB-CD1 3.83Å; K50-I314 HydrophobicContact CG-CD1 3.93Å
51	F	85.1	Confident	85.7	Confident	33 Å²	33	81.3 Å²	81.3	15%	0.145	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	19.6	-172.2	-57	-75.1	0	0	0	113.6	R49 N53 E54 V55 L309 N310 I314	R49-F51 PolarHBondContact O-N 3.14Å; F51-N53 VanDerWaalsContact C-N 3.31Å; F51-N53 PolarHBondContact O-N 3.4Å; F51-E54 WeakPolarHBondContact CD1-OE2 3.45Å; F51-E54 PolarHBondContact O-N 3.27Å; F51-V55 WeakPolarHBondContact O-CG2 3.21Å; F51-V55 PolarHBondContact O-N 3.12Å; F51-V55 VanDerWaalsContact O-N 3.11Å; F51-L309 HydrophobicContact CD2-CB 3.71Å; F51-L309 HydrophobicContact CE2-CB 3.77Å; F51-L309 HydrophobicContact CG-CB 4.45Å; F51-N310 WeakPolarHBondContact CA-OD1 3.32Å; F51-N310 VanDerWaalsContact CB-OD1 3.28Å; F51-N310 WeakPolarHBondContact CB-OD1 3.42Å; F51-N310 PolarHBondContact N-OD1 2.92Å; F51-I314 HydrophobicContact CD2-CD1 4.49Å; F51-I314 HydrophobicContact CE2-CD1 3.66Å; F51-I314 HydrophobicContact CZ-CD1 4.09Å
52	V	88.5	Confident	86	Confident	28 Å²	28	80.9 Å²	80.9	17%	0.17	40%	0.395	C	S	.	.	H	α-helix	trans	-62.7	-38	-179.9	174.7	0	0	0	0	112.2	S46 R49 E54 V55 R56	S46-V52 WeakPolarHBondContact O-CG2 3.4Å; R49-V52 HydrophobicContact CB-CG2 3.9Å; R49-V52 WeakPolarHBondContact O-CG2 3.41Å; V52-E54 VanDerWaalsContact C-N 3.28Å; V52-E54 PolarHBondContact O-N 3.29Å; V52-V55 PolarHBondContact O-N 3.36Å; V52-R56 WeakPolarHBondContact O-CB 3.5Å; V52-R56 PolarHBondContact O-N 3.28Å
53	N	89	Confident	86.6	Confident	117 Å²	117	80.5 Å²	80.5	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-63.3	-37.3	178.7	-69.1	-20.7	0	0	0	111.7	F51 R56 R57	F51-N53 VanDerWaalsContact C-N 3.31Å; F51-N53 PolarHBondContact O-N 3.4Å; N53-R56 PolarHBondContact O-N 3.48Å; N53-R57 WeakPolarHBondContact O-CG 3.46Å; N53-R57 PolarHBondContact O-N 2.9Å; N53-R57 VanDerWaalsContact O-N 3.09Å
54	E	87.7	Confident	86.9	Confident	58 Å²	58	72.8 Å²	72.8	27%	0.271	34%	0.344	S	S	.	.	H	α-helix	trans	-72.4	-40.8	178.3	-67.5	174.6	174.3	0	0	111.2	F51 V52 R56 R57 C58 Y306	F51-E54 WeakPolarHBondContact CD1-OE2 3.45Å; F51-E54 PolarHBondContact O-N 3.27Å; V52-E54 VanDerWaalsContact C-N 3.28Å; V52-E54 PolarHBondContact O-N 3.29Å; E54-R56 VanDerWaalsContact C-N 3.33Å; E54-R56 PolarHBondContact O-N 2.87Å; E54-R57 WeakPolarHBondContact O-CB 3.43Å; E54-R57 PolarHBondContact O-N 2.86Å; E54-C58 PolarHBondContact O-N 2.95Å; E54-C58 PolarHBondContact O-SG 3.35Å; E54-Y306 HydrophobicContact CB-CD1 4.16Å; E54-Y306 HydrophobicContact CB-CD2 4.14Å; E54-Y306 HydrophobicContact CB-CE1 4.24Å; E54-Y306 HydrophobicContact CB-CE2 4.18Å; E54-Y306 HydrophobicContact CB-CG 4.12Å; E54-Y306 WeakPolarHBondContact OE2-CD1 3.4Å; E54-Y306 WeakPolarHBondContact OE2-CE1 3.44Å
55	V	88.4	Confident	87	Confident	18 Å²	18	70.2 Å²	70.2	11%	0.109	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-44.2	172.2	176	0	0	0	0	111.1	F51 V52 R57 C58 E59	F51-V55 WeakPolarHBondContact O-CG2 3.21Å; F51-V55 PolarHBondContact O-N 3.12Å; F51-V55 VanDerWaalsContact O-N 3.11Å; V52-V55 PolarHBondContact O-N 3.36Å; V55-R57 VanDerWaalsContact C-N 3.3Å; V55-R57 PolarHBondContact O-N 2.92Å; V55-C58 WeakPolarHBondContact O-CB 3.19Å; V55-C58 PolarHBondContact O-N 3.39Å; V55-C58 VanDerWaalsContact O-N 3.15Å; V55-E59 WeakPolarHBondContact O-CG 3.44Å; V55-E59 PolarHBondContact O-N 2.95Å
56	R	89.6	Confident	87.1	Confident	145 Å²	145	72.6 Å²	72.6	55%	0.547	33%	0.329	S	S	.	.	H	α-helix	trans	-61.8	-37	176.9	-175.9	179.8	-73	177.4	-2.6	112.3	V52 N53 E54 E59 S60	V52-R56 WeakPolarHBondContact O-CB 3.5Å; V52-R56 PolarHBondContact O-N 3.28Å; N53-R56 PolarHBondContact O-N 3.48Å; E54-R56 VanDerWaalsContact C-N 3.33Å; E54-R56 PolarHBondContact O-N 2.87Å; R56-E59 PolarHBondContact O-N 2.8Å; R56-S60 PolarHBondContact O-N 3.43Å; R56-S60 PolarHBondContact O-OG 2.94Å
57	R	89.6	Confident	87.6	Confident	86 Å²	86	71.6 Å²	71.6	33%	0.325	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-41.9	173.7	-71	175	80.3	-175.5	13.7	111.5	N53 E54 V55 E59 S60 L61 E97	N53-R57 WeakPolarHBondContact O-CG 3.46Å; N53-R57 PolarHBondContact O-N 2.9Å; N53-R57 VanDerWaalsContact O-N 3.09Å; E54-R57 WeakPolarHBondContact O-CB 3.43Å; E54-R57 PolarHBondContact O-N 2.86Å; V55-R57 VanDerWaalsContact C-N 3.3Å; V55-R57 PolarHBondContact O-N 2.92Å; R57-E59 VanDerWaalsContact C-N 3.32Å; R57-E59 PolarHBondContact O-N 3.13Å; R57-S60 WeakPolarHBondContact CA-OG 3.3Å; R57-S60 PolarHBondContact O-N 3.14Å; R57-S60 PolarHBondContact O-OG 3.12Å; R57-L61 WeakPolarHBondContact O-CG 3.46Å; R57-L61 PolarHBondContact O-N 2.89Å; R57-E97 IonicContact CZ-OE1 3.69Å; R57-E97 IonicContact CZ-OE2 3.64Å; R57-E97 VanDerWaalsContact CZ-OE2 3.27Å; R57-E97 IonicContact NE-OE1 3.35Å; R57-E97 PolarHBondContact NE-OE1 3.36Å; R57-E97 IonicContact NE-OE2 2.65Å; R57-E97 IonicContact NH2-OE1 2.64Å; R57-E97 PolarHBondContact NH2-OE1 3.11Å; R57-E97 IonicContact NH2-OE2 3.97Å; R57-E97 PolarHBondContact NH2-OE2 3.26Å
58	C	88.7	Confident	87.8	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-40.2	173.4	-64.5	0	0	0	0	111.7	E54 V55 L61 E62 V299 K303	E54-C58 PolarHBondContact O-N 2.95Å; E54-C58 PolarHBondContact O-SG 3.35Å; V55-C58 WeakPolarHBondContact O-CB 3.19Å; V55-C58 PolarHBondContact O-N 3.39Å; V55-C58 VanDerWaalsContact O-N 3.15Å; C58-L61 PolarHBondContact O-N 3.46Å; C58-E62 WeakPolarHBondContact O-CG 3.41Å; C58-E62 PolarHBondContact O-N 3.1Å; C58-V299 HydrophobicContact CB-CG1 4.37Å; C58-V299 WeakPolarHBondContact O-CG1 3.39Å; C58-K303 HydrophobicContact CB-CB 3.88Å; C58-K303 HydrophobicContact CB-CG 4.34Å
59	E	89.3	Confident	87.8	Confident	95 Å²	95	60.9 Å²	60.9	44%	0.444	27%	0.268	S	S	.	.	H	α-helix	trans	-64.4	-38.1	175.7	-73.8	176.6	169.3	0	0	113	V55 R56 R57 L61 E62 R63 K303	V55-E59 WeakPolarHBondContact O-CG 3.44Å; V55-E59 PolarHBondContact O-N 2.95Å; R56-E59 PolarHBondContact O-N 2.8Å; R57-E59 VanDerWaalsContact C-N 3.32Å; R57-E59 PolarHBondContact O-N 3.13Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-E62 PolarHBondContact O-N 3.33Å; E59-R63 PolarHBondContact O-N 3.16Å; E59-K303 HydrophobicContact CG-CD 4.49Å; E59-K303 IonicContact OE1-NZ 2.96Å
60	S	90.8	Very high	87.8	Confident	43 Å²	43	63.5 Å²	63.5	30%	0.301	29%	0.285	S	S	.	.	H	α-helix	trans	-65	-39.1	173.8	58.6	0	0	0	0	111.4	R56 R57 R63 I64	R56-S60 PolarHBondContact O-N 3.43Å; R56-S60 PolarHBondContact O-OG 2.94Å; R57-S60 WeakPolarHBondContact CA-OG 3.3Å; R57-S60 PolarHBondContact O-N 3.14Å; R57-S60 PolarHBondContact O-OG 3.12Å; S60-R63 WeakPolarHBondContact O-CB 3.26Å; S60-R63 PolarHBondContact O-N 2.89Å; S60-I64 WeakPolarHBondContact O-CG1 3.38Å; S60-I64 PolarHBondContact O-N 3.43Å
61	L	89.4	Confident	87.6	Confident	1 Å²	1	58 Å²	58	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-40.9	173.3	-63	176.4	0	0	0	111.8	R57 C58 E59 R63 I64 L65 E97 L100 V299	R57-L61 WeakPolarHBondContact O-CG 3.46Å; R57-L61 PolarHBondContact O-N 2.89Å; C58-L61 PolarHBondContact O-N 3.46Å; E59-L61 VanDerWaalsContact C-N 3.33Å; L61-R63 VanDerWaalsContact C-N 3.3Å; L61-R63 PolarHBondContact O-N 2.92Å; L61-I64 HydrophobicContact CD2-CD1 4.5Å; L61-I64 PolarHBondContact O-N 3.07Å; L61-L65 WeakPolarHBondContact O-CB 3.07Å; L61-L65 VanDerWaalsContact O-CG 3.23Å; L61-L65 WeakPolarHBondContact O-CG 3.43Å; L61-L65 PolarHBondContact O-N 2.9Å; L61-E97 HydrophobicContact CD2-CB 4Å; L61-E97 HydrophobicContact CD2-CG 4.11Å; L61-L100 HydrophobicContact CB-CD1 4.39Å; L61-L100 HydrophobicContact CD2-CB 4.3Å; L61-L100 HydrophobicContact CD2-CD1 3.92Å; L61-V299 HydrophobicContact CB-CG1 4Å; L61-V299 HydrophobicContact CB-CG2 4.12Å; L61-V299 HydrophobicContact CD1-CG2 4.31Å
62	E	88.5	Confident	87.2	Confident	20 Å²	20	56.4 Å²	56.4	9%	0.093	26%	0.255	C	S	.	.	H	α-helix	trans	-61.2	-37.8	173.2	-73.2	-177.2	165.8	0	0	112.2	C58 E59 L65 R66 V299 K303	C58-E62 WeakPolarHBondContact O-CG 3.41Å; C58-E62 PolarHBondContact O-N 3.1Å; E59-E62 PolarHBondContact O-N 3.33Å; E62-L65 PolarHBondContact O-N 3.48Å; E62-R66 WeakPolarHBondContact O-CG 3.31Å; E62-R66 PolarHBondContact O-N 3.42Å; E62-V299 HydrophobicContact CG-CG1 3.58Å; E62-K303 VanDerWaalsContact OE1-CD 3.25Å; E62-K303 WeakPolarHBondContact OE1-CD 3.45Å; E62-K303 IonicContact OE1-NZ 3.57Å; E62-K303 IonicContact OE2-NZ 3.62Å; E62-K303 PolarHBondContact OE2-NZ 3.04Å
63	R	91.8	Very high	86.3	Confident	143 Å²	143	61.6 Å²	61.6	54%	0.54	28%	0.277	S	S	.	.	H	α-helix	trans	-63.4	-48	175.5	-178.1	-165.8	71.2	91.3	9.7	111.4	E59 S60 L61 L65 R66 F67 E104	E59-R63 PolarHBondContact O-N 3.16Å; S60-R63 WeakPolarHBondContact O-CB 3.26Å; S60-R63 PolarHBondContact O-N 2.89Å; L61-R63 VanDerWaalsContact C-N 3.3Å; L61-R63 PolarHBondContact O-N 2.92Å; R63-L65 PolarHBondContact O-N 3.42Å; R63-R66 PolarHBondContact O-N 3.29Å; R63-F67 PolarHBondContact O-N 3.49Å; R63-F67 VanDerWaalsContact O-N 3.07Å; R63-E104 IonicContact CZ-OE1 3.27Å; R63-E104 IonicContact NH1-OE1 3.09Å; R63-E104 IonicContact NH2-OE1 2.55Å; R63-E104 PolarHBondContact NH2-OE1 2.88Å; R63-E104 IonicContact NH2-OE2 3.51Å
64	I	89.4	Confident	85	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-43.1	175.9	-65.6	173.6	0	0	0	109.4	S60 L61 F67 L68 L100 E101 E104	S60-I64 WeakPolarHBondContact O-CG1 3.38Å; S60-I64 PolarHBondContact O-N 3.43Å; L61-I64 HydrophobicContact CD2-CD1 4.5Å; L61-I64 PolarHBondContact O-N 3.07Å; I64-F67 WeakPolarHBondContact O-CB 3.24Å; I64-F67 PolarHBondContact O-N 2.75Å; I64-L68 WeakPolarHBondContact O-CG 3.32Å; I64-L68 PolarHBondContact O-N 3Å; I64-L68 VanDerWaalsContact O-N 3.11Å; I64-L100 HydrophobicContact CG2-CB 4.21Å; I64-E101 HydrophobicContact CD1-CG 4.16Å; I64-E104 WeakPolarHBondContact CD1-OE2 3.26Å; I64-E104 VanDerWaalsContact CG1-OE2 3.26Å; I64-E104 WeakPolarHBondContact CG1-OE2 3.32Å; I64-E104 HydrophobicContact CG2-CB 3.92Å; I64-E104 HydrophobicContact CG2-CG 4.35Å
65	L	87.7	Confident	83.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-54.6	178.9	-76.3	171.7	0	0	0	110	L61 E62 R63 F67 L68 E69 L100 W292 W295 L296 V299	L61-L65 WeakPolarHBondContact O-CB 3.07Å; L61-L65 VanDerWaalsContact O-CG 3.23Å; L61-L65 WeakPolarHBondContact O-CG 3.43Å; L61-L65 PolarHBondContact O-N 2.9Å; E62-L65 PolarHBondContact O-N 3.48Å; R63-L65 PolarHBondContact O-N 3.42Å; L65-F67 PolarHBondContact O-N 3.01Å; L65-F67 VanDerWaalsContact O-N 3.12Å; L65-L68 HydrophobicContact CD2-CD1 4.4Å; L65-L68 WeakPolarHBondContact O-CA 3.38Å; L65-L68 WeakPolarHBondContact O-CB 3.29Å; L65-L68 PolarHBondContact O-N 3.12Å; L65-E69 PolarHBondContact O-N 3.31Å; L65-L100 HydrophobicContact CD2-CD1 4.24Å; L65-L100 HydrophobicContact CD2-CD2 3.71Å; L65-L100 HydrophobicContact CG-CD1 4.28Å; L65-L100 HydrophobicContact CG-CD2 4.42Å; L65-W292 HydrophobicContact CB-CE3 4.45Å; L65-W292 HydrophobicContact CB-CH2 3.42Å; L65-W292 VanDerWaalsContact CB-CH2 3.42Å; L65-W292 HydrophobicContact CB-CZ3 3.31Å; L65-W292 HydrophobicContact CD2-CE3 3.58Å; L65-W292 HydrophobicContact CD2-CH2 4.12Å; L65-W292 HydrophobicContact CD2-CZ3 3.24Å; L65-W292 HydrophobicContact CG-CH2 4.31Å; L65-W292 HydrophobicContact CG-CZ3 3.83Å; L65-W292 WeakPolarHBondContact O-CH2 3.41Å; L65-W292 WeakPolarHBondContact O-CZ3 3.3Å; L65-W295 HydrophobicContact CD2-CB 3.96Å; L65-W295 HydrophobicContact CD2-CE3 4.41Å; L65-L296 HydrophobicContact CD1-CD1 4.34Å; L65-V299 HydrophobicContact CD1-CB 4.13Å; L65-V299 HydrophobicContact CD1-CG2 3.88Å
66	R	87.4	Confident	82.1	Confident	161 Å²	161	64 Å²	64	61%	0.608	29%	0.288	S	S	*	.	H	α-helix	trans	-53.1	-38.6	178.5	-73.4	179.3	-171.3	173.2	2.1	113.1	E62 R63 L68 E69 D70	E62-R66 WeakPolarHBondContact O-CG 3.31Å; E62-R66 PolarHBondContact O-N 3.42Å; R63-R66 PolarHBondContact O-N 3.29Å; R66-L68 PolarHBondContact O-N 3.2Å; R66-E69 WeakPolarHBondContact O-CB 3.47Å; R66-E69 PolarHBondContact O-N 3.32Å; R66-E69 VanDerWaalsContact O-N 3.16Å; R66-D70 PolarHBondContact O-N 2.88Å
67	F	87.8	Confident	80.4	Confident	50 Å²	50	61.6 Å²	61.6	22%	0.219	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-43	173.2	168.3	-102.8	0	0	0	112.7	R63 I64 L65 E69 D70 E71 E104 Q108	R63-F67 PolarHBondContact O-N 3.49Å; R63-F67 VanDerWaalsContact O-N 3.07Å; I64-F67 WeakPolarHBondContact O-CB 3.24Å; I64-F67 PolarHBondContact O-N 2.75Å; L65-F67 PolarHBondContact O-N 3.01Å; L65-F67 VanDerWaalsContact O-N 3.12Å; F67-E69 VanDerWaalsContact C-N 3.32Å; F67-E69 PolarHBondContact O-N 3.05Å; F67-D70 PolarHBondContact O-N 2.86Å; F67-E71 HydrophobicContact CE1-CG 4.44Å; F67-E71 HydrophobicContact CE2-CG 4.07Å; F67-E71 HydrophobicContact CZ-CG 4.01Å; F67-E71 WeakPolarHBondContact O-CG 3.25Å; F67-E71 PolarHBondContact O-N 2.57Å; F67-E71 VanDerWaalsContact O-N 3.16Å; F67-E104 HydrophobicContact CD1-CG 4.28Å; F67-E104 HydrophobicContact CE1-CG 4.36Å; F67-Q108 HydrophobicContact CE1-CG 4.32Å; F67-Q108 HydrophobicContact CZ-CG 4.09Å
68	L	85	Confident	78.8	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-36.9	173.6	-63.1	171.8	0	0	0	112.1	I64 L65 R66 E71 M72 L100 L107 W292	I64-L68 WeakPolarHBondContact O-CG 3.32Å; I64-L68 PolarHBondContact O-N 3Å; I64-L68 VanDerWaalsContact O-N 3.11Å; L65-L68 HydrophobicContact CD2-CD1 4.4Å; L65-L68 WeakPolarHBondContact O-CA 3.38Å; L65-L68 WeakPolarHBondContact O-CB 3.29Å; L65-L68 PolarHBondContact O-N 3.12Å; R66-L68 PolarHBondContact O-N 3.2Å; L68-E71 PolarHBondContact O-N 3.41Å; L68-M72 WeakPolarHBondContact O-CB 3.46Å; L68-M72 WeakPolarHBondContact O-CG 3.49Å; L68-M72 PolarHBondContact O-N 3.11Å; L68-L100 HydrophobicContact CD1-CD2 4.14Å; L68-L107 HydrophobicContact CD2-CD1 3.25Å; L68-W292 HydrophobicContact CB-CE3 4.09Å; L68-W292 HydrophobicContact CB-CZ3 3.86Å; L68-W292 HydrophobicContact CD1-CE3 4.43Å; L68-W292 HydrophobicContact CD1-CZ3 4.39Å
69	E	84.4	Confident	77.1	Confident	71 Å²	71	68.2 Å²	68.2	33%	0.332	34%	0.337	S	S	.	.	H	α-helix	trans	-61.8	-47.4	176	-168.8	171.9	-170.7	0	0	111.7	L65 R66 F67 E71 M72 Q73 W292	L65-E69 PolarHBondContact O-N 3.31Å; R66-E69 WeakPolarHBondContact O-CB 3.47Å; R66-E69 PolarHBondContact O-N 3.32Å; R66-E69 VanDerWaalsContact O-N 3.16Å; F67-E69 VanDerWaalsContact C-N 3.32Å; F67-E69 PolarHBondContact O-N 3.05Å; E69-E71 VanDerWaalsContact C-N 3.3Å; E69-E71 PolarHBondContact O-N 3.38Å; E69-M72 PolarHBondContact O-N 2.93Å; E69-M72 VanDerWaalsContact O-N 3.14Å; E69-Q73 HydrophobicContact CG-CG 4.46Å; E69-Q73 WeakPolarHBondContact O-CG 3.33Å; E69-Q73 PolarHBondContact O-N 3.36Å; E69-W292 HydrophobicContact CB-CH2 3.82Å; E69-W292 HydrophobicContact CB-CZ2 3.63Å; E69-W292 HydrophobicContact CG-CZ2 4.05Å
70	D	82.8	Confident	75.4	Confident	98 Å²	98	70.1 Å²	70.1	52%	0.524	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-39.6	178.2	-69	-22.9	0	0	0	111.7	R66 F67 N74	R66-D70 PolarHBondContact O-N 2.88Å; F67-D70 PolarHBondContact O-N 2.86Å; D70-N74 PolarHBondContact O-ND2 2.86Å
71	E	79	Confident	73.5	Confident	45 Å²	45	70.9 Å²	70.9	21%	0.21	35%	0.354	C	S	.	.	H	α-helix	trans	-69.5	-36.8	175.6	-70.3	-72.7	144.9	0	0	112	F67 L68 E69 N111 L285	F67-E71 HydrophobicContact CE1-CG 4.44Å; F67-E71 HydrophobicContact CE2-CG 4.07Å; F67-E71 HydrophobicContact CZ-CG 4.01Å; F67-E71 WeakPolarHBondContact O-CG 3.25Å; F67-E71 PolarHBondContact O-N 2.57Å; F67-E71 VanDerWaalsContact O-N 3.16Å; L68-E71 PolarHBondContact O-N 3.41Å; E69-E71 VanDerWaalsContact C-N 3.3Å; E69-E71 PolarHBondContact O-N 3.38Å; E71-N111 VanDerWaalsContact CD-ND2 3.33Å; E71-N111 PolarHBondContact OE1-ND2 2.94Å; E71-N111 PolarHBondContact OE2-ND2 2.96Å; E71-L285 HydrophobicContact CB-CD2 4.26Å
72	M	77.2	Confident	71.4	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.005	40%	0.397	C	S	.	.	H	α-helix	trans	-74.9	-37.3	-179	-75.8	173.5	47.9	0	0	113.6	L68 E69 N74 E75 I76 V78 L285 A289 W292	L68-M72 WeakPolarHBondContact O-CB 3.46Å; L68-M72 WeakPolarHBondContact O-CG 3.49Å; L68-M72 PolarHBondContact O-N 3.11Å; E69-M72 PolarHBondContact O-N 2.93Å; E69-M72 VanDerWaalsContact O-N 3.14Å; M72-N74 PolarHBondContact O-N 3.1Å; M72-N74 VanDerWaalsContact O-N 3.07Å; M72-E75 PolarHBondContact O-N 3.04Å; M72-I76 PolarHBondContact O-N 3.03Å; M72-V78 HydrophobicContact CE-CB 4.34Å; M72-V78 HydrophobicContact CE-CG1 4.19Å; M72-V78 HydrophobicContact CE-CG2 3.36Å; M72-L285 HydrophobicContact CG-CD2 4.16Å; M72-A289 VanDerWaalsContact CE-CA 3.48Å; M72-A289 HydrophobicContact CE-CB 3.43Å; M72-A289 VanDerWaalsContact CE-CB 3.43Å; M72-A289 HydrophobicContact SD-CB 4.1Å; M72-W292 HydrophobicContact CE-CB 4.25Å; M72-W292 HydrophobicContact CE-CG 4.17Å; M72-W292 HydrophobicContact SD-CB 4.35Å; M72-W292 HydrophobicContact SD-CG 4.34Å
73	Q	68.9	Low	69.7	Low	137 Å²	137	87.8 Å²	87.8	64%	0.64	43%	0.43	S	S	*	.	H	α-helix	trans	-56.5	-27	-179.2	-81	-176.1	6.9	0	0	112.7	E69	E69-Q73 HydrophobicContact CG-CG 4.46Å; E69-Q73 WeakPolarHBondContact O-CG 3.33Å; E69-Q73 PolarHBondContact O-N 3.36Å
74	N	61.4	Low	68	Low	112 Å²	112	84.8 Å²	84.8	60%	0.599	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-16	-179.4	-68.4	-47.8	0	0	0	114.1	D70 M72	D70-N74 PolarHBondContact O-ND2 2.86Å; M72-N74 PolarHBondContact O-N 3.1Å; M72-N74 VanDerWaalsContact O-N 3.07Å
75	E	57.9	Low	66.8	Low	84 Å²	84	85.8 Å²	85.8	39%	0.393	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.6	-27.2	-165	-67	-174	178	0	0	116.8	M72 R281 L285	M72-E75 PolarHBondContact O-N 3.04Å; E75-R281 IonicContact OE1-CZ 3.64Å; E75-R281 IonicContact OE1-NH1 3.64Å; E75-R281 PolarHBondContact OE1-NH1 2.74Å; E75-R281 IonicContact OE1-NH2 3.56Å; E75-R281 PolarHBondContact OE1-NH2 3.01Å; E75-R281 IonicContact OE2-CZ 2.76Å; E75-R281 IonicContact OE2-NH1 2.62Å; E75-R281 PolarHBondContact OE2-NH1 2.92Å; E75-R281 IonicContact OE2-NH2 3.97Å; E75-R281 PolarHBondContact OE2-NH2 3.23Å; E75-L285 WeakPolarHBondContact OE2-CD1 3.38Å
76	I	57.3	Low	65.6	Low	48 Å²	48	91.4 Å²	91.4	25%	0.246	47%	0.467	C	S	.	.			trans	-137.9	133.1	-171	-54.8	177.5	0	0	0	111.5	M72 V78 L285 Q286	M72-I76 PolarHBondContact O-N 3.03Å; I76-V78 PolarHBondContact O-N 3.47Å; I76-L285 HydrophobicContact CD1-CB 3.91Å; I76-Q286 HydrophobicContact CD1-CG 3.84Å
77	A	53.7	Low	64.5	Low	93 Å²	93	84.6 Å²	84.6	77%	0.769	44%	0.443	S	S	*	.			trans	-72.9	110.4	168.6	0	0	0	0	0	110.4	Q79	A77-Q79 PolarHBondContact O-N 3.07Å
78	V	56	Low	63.9	Low	55 Å²	55	82.4 Å²	82.4	33%	0.333	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-66.1	126.5	178.9	-171.1	0	0	0	0	110.3	M72 I76	M72-V78 HydrophobicContact CE-CB 4.34Å; M72-V78 HydrophobicContact CE-CG1 4.19Å; M72-V78 HydrophobicContact CE-CG2 3.36Å; I76-V78 PolarHBondContact O-N 3.47Å
79	Q	53	Low	63.4	Low	170 Å²	170	86.3 Å²	86.3	79%	0.794	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-83.6	119.4	172.4	-65.7	-178.1	3.8	0	0	109.1	A77 P81	A77-Q79 PolarHBondContact O-N 3.07Å; Q79-P81 WeakPolarHBondContact O-CD 3.24Å
80	L	54	Low	62.9	Low	135 Å²	135	85.2 Å²	85.2	71%	0.707	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-76.2	121.5	172.8	-76.5	103.3	0	0	0	110.1
81	P	51.1	Low	62.7	Low	59 Å²	59	91 Å²	91	38%	0.383	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-62.9	140.9	168.7	-15.9	28.2	0	0	0	111.8	Q79 K83 H293	Q79-P81 WeakPolarHBondContact O-CD 3.24Å; P81-K83 VanDerWaalsContact C-N 3.26Å; P81-K83 PolarHBondContact O-N 3.39Å; P81-H293 VanDerWaalsContact CD-CD2 3.42Å; P81-H293 WeakPolarHBondContact CD-CD2 3.5Å; P81-H293 HydrophobicContact CG-CB 4.11Å
82	E	45.5	Very low	62.7	Low	198 Å²	198	92.2 Å²	92.2	93%	0.925	47%	0.474	S	S	*	.	S	Bend	trans	-72.3	-9.5	179	-72.4	-174.2	151.4	0	0	114.7
83	K	53.4	Low	62.9	Low	179 Å²	179	92.5 Å²	92.5	78%	0.778	48%	0.475	S	S	*	.	S	Bend	trans	-132.3	131	-174.6	-72.2	-177	-179.1	175.8	0	112.6	P81	P81-K83 VanDerWaalsContact C-N 3.26Å; P81-K83 PolarHBondContact O-N 3.39Å
84	S	55.1	Low	63.7	Low	79 Å²	79	90.3 Å²	90.3	55%	0.552	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-66.4	129	169.6	47.8	0	0	0	0	110.3
85	P	63.5	Low	64.9	Low	25 Å²	25	88.9 Å²	88.9	16%	0.162	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-66.4	151.2	174.5	26.9	-34.5	0	0	0	111.3	I297 K298 K301	P85-I297 HydrophobicContact CG-CB 4.08Å; P85-I297 HydrophobicContact CG-CG2 3.83Å; P85-K298 HydrophobicContact CB-CG 4.42Å; P85-K298 HydrophobicContact CG-CG 4.07Å; P85-K301 PolarHBondContact O-NZ 3.06Å
86	L	63.3	Low	66.2	Low	119 Å²	119	85.6 Å²	85.6	62%	0.623	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-59.2	150.1	170.1	-168.2	73.7	0	0	0	109.9	P88	L86-P88 WeakPolarHBondContact O-CD 3.32Å
87	T	65.2	Low	67.7	Low	18 Å²	18	84.4 Å²	84.4	11%	0.11	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-54.4	122.5	171.2	42.8	0	0	0	0	110.6	A27 K301 F828	A27-T87 HydrophobicContact CB-CG2 4.01Å; T87-K301 HydrophobicContact CG2-CB 4.27Å; T87-K301 HydrophobicContact CG2-CD 3.79Å; T87-F828 HydrophobicContact CG2-CD2 4.16Å; T87-F828 HydrophobicContact CG2-CE2 3.37Å; T87-F828 HydrophobicContact CG2-CZ 3.64Å
88	P	73.8	Confident	69.5	Low	3 Å²	3	83.8 Å²	83.8	2%	0.019	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-70.4	149.9	178.8	28.3	-34.9	0	0	0	111.2	Y23 L86 E92 K298 M302	Y23-P88 WeakPolarHBondContact CE1-O 3.46Å; L86-P88 WeakPolarHBondContact O-CD 3.32Å; P88-E92 HydrophobicContact CB-CB 4.09Å; P88-E92 VanDerWaalsContact CB-OE2 3.25Å; P88-E92 WeakPolarHBondContact CB-OE2 3.38Å; P88-K298 HydrophobicContact CB-CD 4.32Å; P88-K298 HydrophobicContact CG-CB 3.99Å; P88-K298 HydrophobicContact CG-CD 4.29Å; P88-K298 HydrophobicContact CG-CG 4.02Å; P88-M302 HydrophobicContact CB-CE 3.53Å; P88-M302 HydrophobicContact CG-CE 3.11Å; P88-M302 HydrophobicContact CG-CG 3.79Å; P88-M302 HydrophobicContact CG-SD 4.24Å
89	L	74.5	Confident	71.1	Confident	84 Å²	84	84.2 Å²	84.2	44%	0.44	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-69.9	155.1	171.4	-74.5	151.7	0	0	0	110.6	R91 E92	L89-R91 PolarHBondContact O-N 3.43Å; L89-E92 WeakPolarHBondContact O-CB 3.39Å; L89-E92 PolarHBondContact O-N 3.23Å
90	P	74.9	Confident	72.8	Confident	48 Å²	48	76.1 Å²	76.1	31%	0.312	39%	0.392	S	S	.	.	H	α-helix	trans	-55.7	-28.6	177.1	-27.1	35.3	0	0	0	114	Y23 E92 M93	Y23-P90 HydrophobicContact CD1-CG 3.54Å; Y23-P90 HydrophobicContact CD2-CG 4.06Å; Y23-P90 HydrophobicContact CE1-CG 3.83Å; Y23-P90 HydrophobicContact CE2-CG 4.32Å; Y23-P90 HydrophobicContact CG-CG 3.66Å; P90-E92 VanDerWaalsContact C-N 3.33Å; P90-E92 PolarHBondContact O-N 3.41Å; P90-M93 WeakPolarHBondContact O-CB 3.43Å; P90-M93 PolarHBondContact O-N 3.1Å
91	R	77.8	Confident	74.5	Confident	218 Å²	218	74.5 Å²	74.5	82%	0.823	38%	0.381	S	S	*	.	H	α-helix	trans	-66.2	-33.8	176.1	-67.3	-175.9	177.9	178.6	0.8	112.9	L89 M93 I94	L89-R91 PolarHBondContact O-N 3.43Å; R91-M93 PolarHBondContact O-N 3.22Å; R91-I94 PolarHBondContact O-N 3.33Å
92	E	78.6	Confident	76.4	Confident	71 Å²	71	78 Å²	78	33%	0.332	39%	0.391	S	S	.	.	H	α-helix	trans	-70.2	-21.6	178.3	-64.2	-177.5	-166.1	0	0	111.9	P88 L89 P90 I94 T95 L96 K298	P88-E92 HydrophobicContact CB-CB 4.09Å; P88-E92 VanDerWaalsContact CB-OE2 3.25Å; P88-E92 WeakPolarHBondContact CB-OE2 3.38Å; L89-E92 WeakPolarHBondContact O-CB 3.39Å; L89-E92 PolarHBondContact O-N 3.23Å; P90-E92 VanDerWaalsContact C-N 3.33Å; P90-E92 PolarHBondContact O-N 3.41Å; E92-I94 VanDerWaalsContact C-N 3.34Å; E92-I94 PolarHBondContact O-N 3.44Å; E92-T95 WeakPolarHBondContact CA-OG1 3.44Å; E92-T95 PolarHBondContact O-N 2.89Å; E92-T95 PolarHBondContact O-OG1 3.23Å; E92-L96 WeakPolarHBondContact O-CB 3.28Å; E92-L96 WeakPolarHBondContact O-CG 3.19Å; E92-L96 PolarHBondContact O-N 3.29Å; E92-K298 IonicContact OE2-NZ 3.55Å
93	M	81.1	Confident	78.4	Confident	7 Å²	7	69.3 Å²	69.3	3%	0.034	35%	0.35	C	S	.	.	H	α-helix	trans	-58.9	-46	175.9	-172.6	179.6	72.2	0	0	111.7	P90 R91 T95 L96 E97 M302 Y306	P90-M93 WeakPolarHBondContact O-CB 3.43Å; P90-M93 PolarHBondContact O-N 3.1Å; R91-M93 PolarHBondContact O-N 3.22Å; M93-T95 VanDerWaalsContact C-N 3.31Å; M93-T95 PolarHBondContact O-N 2.73Å; M93-L96 PolarHBondContact O-N 2.96Å; M93-E97 WeakPolarHBondContact O-CB 3.33Å; M93-E97 PolarHBondContact O-N 3.14Å; M93-M302 HydrophobicContact CB-CE 3.77Å; M93-M302 HydrophobicContact CB-SD 3.82Å; M93-M302 HydrophobicContact CG-CE 4.33Å; M93-M302 HydrophobicContact CG-SD 3.77Å; M93-M302 HydrophobicContact SD-SD 4.26Å; M93-Y306 HydrophobicContact SD-CE2 4.01Å
94	I	85.8	Confident	80.1	Confident	92 Å²	92	61.9 Å²	61.9	47%	0.472	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-41.2	-179.2	-56.1	170.1	0	0	0	109.7	R91 E92 E97 T98	R91-I94 PolarHBondContact O-N 3.33Å; E92-I94 VanDerWaalsContact C-N 3.34Å; E92-I94 PolarHBondContact O-N 3.44Å; I94-E97 PolarHBondContact O-N 2.94Å; I94-T98 WeakPolarHBondContact O-CG2 3.45Å; I94-T98 PolarHBondContact O-N 3.4Å; I94-T98 PolarHBondContact O-OG1 2.93Å
95	T	88	Confident	81.8	Confident	82 Å²	82	59.7 Å²	59.7	50%	0.503	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-41	176.9	59.3	0	0	0	0	111.9	E92 M93 T98 V99	E92-T95 WeakPolarHBondContact CA-OG1 3.44Å; E92-T95 PolarHBondContact O-N 2.89Å; E92-T95 PolarHBondContact O-OG1 3.23Å; M93-T95 VanDerWaalsContact C-N 3.31Å; M93-T95 PolarHBondContact O-N 2.73Å; T95-T98 PolarHBondContact O-N 2.92Å; T95-T98 PolarHBondContact O-OG1 3.25Å; T95-V99 WeakPolarHBondContact O-CG2 3.27Å; T95-V99 PolarHBondContact O-N 3.47Å; T95-V99 VanDerWaalsContact O-N 3.14Å
96	L	85.5	Confident	83.1	Confident	14 Å²	14	61.8 Å²	61.8	7%	0.073	32%	0.316	C	S	.	.	H	α-helix	trans	-64.3	-42.1	177.2	-77.5	166.4	0	0	0	111.8	E92 M93 V99 L100 W295 K298 M302	E92-L96 WeakPolarHBondContact O-CB 3.28Å; E92-L96 WeakPolarHBondContact O-CG 3.19Å; E92-L96 PolarHBondContact O-N 3.29Å; M93-L96 PolarHBondContact O-N 2.96Å; L96-V99 PolarHBondContact O-N 3.3Å; L96-L100 WeakPolarHBondContact O-CB 3.49Å; L96-L100 WeakPolarHBondContact O-CG 3.36Å; L96-L100 PolarHBondContact O-N 3.49Å; L96-W295 HydrophobicContact CD2-CG 4.18Å; L96-K298 HydrophobicContact CD1-CB 4.5Å; L96-K298 HydrophobicContact CD1-CD 4.19Å; L96-M302 HydrophobicContact CD1-CE 3.9Å
97	E	88.1	Confident	84.2	Confident	23 Å²	23	56.1 Å²	56.1	11%	0.107	29%	0.286	C	S	.	.	H	α-helix	trans	-60	-48.2	176.5	-175.5	175.5	-168.1	0	0	111.3	R57 L61 M93 I94 V99 L100 E101	R57-E97 IonicContact CZ-OE1 3.69Å; R57-E97 IonicContact CZ-OE2 3.64Å; R57-E97 VanDerWaalsContact CZ-OE2 3.27Å; R57-E97 IonicContact NE-OE1 3.35Å; R57-E97 PolarHBondContact NE-OE1 3.36Å; R57-E97 IonicContact NE-OE2 2.65Å; R57-E97 IonicContact NH2-OE1 2.64Å; R57-E97 PolarHBondContact NH2-OE1 3.11Å; R57-E97 IonicContact NH2-OE2 3.97Å; R57-E97 PolarHBondContact NH2-OE2 3.26Å; L61-E97 HydrophobicContact CD2-CB 4Å; L61-E97 HydrophobicContact CD2-CG 4.11Å; M93-E97 WeakPolarHBondContact O-CB 3.33Å; M93-E97 PolarHBondContact O-N 3.14Å; I94-E97 PolarHBondContact O-N 2.94Å; E97-V99 VanDerWaalsContact C-N 3.27Å; E97-V99 PolarHBondContact O-N 3.5Å; E97-L100 PolarHBondContact O-N 3.41Å; E97-E101 HydrophobicContact CG-CG 4.49Å; E97-E101 WeakPolarHBondContact O-CB 3.34Å; E97-E101 WeakPolarHBondContact O-CG 3.49Å; E97-E101 PolarHBondContact O-N 3.09Å
98	T	90.8	Very high	85.3	Confident	81 Å²	81	58.9 Å²	58.9	50%	0.497	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-35.2	177.5	58.5	0	0	0	0	113.4	I94 T95 K102	I94-T98 WeakPolarHBondContact O-CG2 3.45Å; I94-T98 PolarHBondContact O-N 3.4Å; I94-T98 PolarHBondContact O-OG1 2.93Å; T95-T98 PolarHBondContact O-N 2.92Å; T95-T98 PolarHBondContact O-OG1 3.25Å; T98-K102 WeakPolarHBondContact O-CB 3.46Å; T98-K102 PolarHBondContact O-N 3.38Å
99	V	89.2	Confident	86.1	Confident	64 Å²	64	64.5 Å²	64.5	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-73.6	-45.2	178.6	171.8	0	0	0	0	110.7	T95 L96 E97 K102 L103 W295	T95-V99 WeakPolarHBondContact O-CG2 3.27Å; T95-V99 PolarHBondContact O-N 3.47Å; T95-V99 VanDerWaalsContact O-N 3.14Å; L96-V99 PolarHBondContact O-N 3.3Å; E97-V99 VanDerWaalsContact C-N 3.27Å; E97-V99 PolarHBondContact O-N 3.5Å; V99-K102 PolarHBondContact O-N 2.55Å; V99-L103 HydrophobicContact CG1-CD1 3.93Å; V99-L103 WeakPolarHBondContact O-CB 3.47Å; V99-L103 WeakPolarHBondContact O-CG 2.97Å; V99-L103 PolarHBondContact O-N 3.43Å; V99-W295 HydrophobicContact CG1-CH2 4.35Å; V99-W295 HydrophobicContact CG1-CZ2 4.17Å
100	L	88.7	Confident	86.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-69.2	-41.9	-178.2	-73.3	171.5	0	0	0	112.4	L61 I64 L65 L68 L96 E97 K102 L103 E104 W295	L61-L100 HydrophobicContact CB-CD1 4.39Å; L61-L100 HydrophobicContact CD2-CB 4.3Å; L61-L100 HydrophobicContact CD2-CD1 3.92Å; I64-L100 HydrophobicContact CG2-CB 4.21Å; L65-L100 HydrophobicContact CD2-CD1 4.24Å; L65-L100 HydrophobicContact CD2-CD2 3.71Å; L65-L100 HydrophobicContact CG-CD1 4.28Å; L65-L100 HydrophobicContact CG-CD2 4.42Å; L68-L100 HydrophobicContact CD1-CD2 4.14Å; L96-L100 WeakPolarHBondContact O-CB 3.49Å; L96-L100 WeakPolarHBondContact O-CG 3.36Å; L96-L100 PolarHBondContact O-N 3.49Å; E97-L100 PolarHBondContact O-N 3.41Å; L100-K102 VanDerWaalsContact C-N 3.33Å; L100-K102 PolarHBondContact O-N 2.95Å; L100-L103 PolarHBondContact O-N 3.36Å; L100-E104 WeakPolarHBondContact O-CB 3.37Å; L100-E104 PolarHBondContact O-N 3.47Å; L100-W295 HydrophobicContact CD2-CD2 4.27Å; L100-W295 HydrophobicContact CD2-CE3 3.74Å; L100-W295 HydrophobicContact CD2-CZ3 4.09Å
101	E	90.6	Very high	87.2	Confident	101 Å²	101	60.4 Å²	60.4	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-64.7	-39	175.6	-72	-179.6	165.7	0	0	111.7	I64 E97 G105	I64-E101 HydrophobicContact CD1-CG 4.16Å; E97-E101 HydrophobicContact CG-CG 4.49Å; E97-E101 WeakPolarHBondContact O-CB 3.34Å; E97-E101 WeakPolarHBondContact O-CG 3.49Å; E97-E101 PolarHBondContact O-N 3.09Å; E101-G105 PolarHBondContact O-N 3.18Å
102	K	91.3	Very high	87.8	Confident	133 Å²	133	56.1 Å²	56.1	58%	0.578	29%	0.29	S	S	*	.	H	α-helix	trans	-63.8	-45.4	175.4	-176.9	179.5	171.1	-173.5	0	111.4	T98 V99 L100 G105 E106	T98-K102 WeakPolarHBondContact O-CB 3.46Å; T98-K102 PolarHBondContact O-N 3.38Å; V99-K102 PolarHBondContact O-N 2.55Å; L100-K102 VanDerWaalsContact C-N 3.33Å; L100-K102 PolarHBondContact O-N 2.95Å; K102-G105 PolarHBondContact O-N 2.96Å; K102-E106 WeakPolarHBondContact CE-OE1 3.34Å; K102-E106 IonicContact NZ-OE1 2.95Å; K102-E106 WeakPolarHBondContact O-CG 3.39Å; K102-E106 PolarHBondContact O-N 3.04Å
103	L	88.3	Confident	88.2	Confident	15 Å²	15	56.4 Å²	56.4	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-42.4	177.3	-76.6	167	0	0	0	112.3	V99 L100 G105 E106 L107 W295	V99-L103 HydrophobicContact CG1-CD1 3.93Å; V99-L103 WeakPolarHBondContact O-CB 3.47Å; V99-L103 WeakPolarHBondContact O-CG 2.97Å; V99-L103 PolarHBondContact O-N 3.43Å; L100-L103 PolarHBondContact O-N 3.36Å; L103-G105 VanDerWaalsContact C-N 3.34Å; L103-G105 PolarHBondContact O-N 2.97Å; L103-E106 PolarHBondContact O-N 3.25Å; L103-L107 WeakPolarHBondContact O-CB 3.35Å; L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 3.38Å; L103-W295 HydrophobicContact CD1-CH2 3.65Å; L103-W295 HydrophobicContact CD1-CZ3 3.88Å
104	E	88.6	Confident	88.4	Confident	22 Å²	22	57 Å²	57	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	-58.7	-47.3	174.6	-172.9	-172.6	-164.5	0	0	110.4	R63 I64 F67 L100 L107 Q108	R63-E104 IonicContact CZ-OE1 3.27Å; R63-E104 IonicContact NH1-OE1 3.09Å; R63-E104 IonicContact NH2-OE1 2.55Å; R63-E104 PolarHBondContact NH2-OE1 2.88Å; R63-E104 IonicContact NH2-OE2 3.51Å; I64-E104 WeakPolarHBondContact CD1-OE2 3.26Å; I64-E104 VanDerWaalsContact CG1-OE2 3.26Å; I64-E104 WeakPolarHBondContact CG1-OE2 3.32Å; I64-E104 HydrophobicContact CG2-CB 3.92Å; I64-E104 HydrophobicContact CG2-CG 4.35Å; F67-E104 HydrophobicContact CD1-CG 4.28Å; F67-E104 HydrophobicContact CE1-CG 4.36Å; L100-E104 WeakPolarHBondContact O-CB 3.37Å; L100-E104 PolarHBondContact O-N 3.47Å; E104-L107 PolarHBondContact O-N 2.79Å; E104-Q108 HydrophobicContact CG-CG 4.44Å; E104-Q108 WeakPolarHBondContact O-CB 3.3Å; E104-Q108 VanDerWaalsContact O-CG 3.3Å; E104-Q108 WeakPolarHBondContact O-CG 3.33Å; E104-Q108 PolarHBondContact O-N 2.95Å; E104-Q108 PolarHBondContact OE1-NE2 3.37Å
105	G	91.1	Very high	88.5	Confident	34 Å²	34	57.1 Å²	57.1	35%	0.351	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-49.5	178.7	0	0	0	0	0	112.9	E101 K102 L103 L107 Q108 E109	E101-G105 PolarHBondContact O-N 3.18Å; K102-G105 PolarHBondContact O-N 2.96Å; L103-G105 VanDerWaalsContact C-N 3.34Å; L103-G105 PolarHBondContact O-N 2.97Å; G105-L107 PolarHBondContact O-N 3.38Å; G105-Q108 PolarHBondContact O-N 3.5Å; G105-E109 WeakPolarHBondContact O-CB 3.38Å; G105-E109 PolarHBondContact O-N 2.98Å
106	E	89.7	Confident	88.5	Confident	68 Å²	68	55.8 Å²	55.8	32%	0.318	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-41.1	179.2	-74	177.5	-179.6	0	0	111.9	K102 L103 A110 L284	K102-E106 WeakPolarHBondContact CE-OE1 3.34Å; K102-E106 IonicContact NZ-OE1 2.95Å; K102-E106 WeakPolarHBondContact O-CG 3.39Å; K102-E106 PolarHBondContact O-N 3.04Å; L103-E106 PolarHBondContact O-N 3.25Å; E106-A110 VanDerWaalsContact O-CB 3.27Å; E106-A110 WeakPolarHBondContact O-CB 3.3Å; E106-A110 PolarHBondContact O-N 2.95Å; E106-L284 HydrophobicContact CB-CD1 4.34Å
107	L	86.8	Confident	88.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-70.6	-40.7	177.5	-78.6	167.6	0	0	0	112.6	L68 L103 E104 G105 E109 A110 N111 R281 L284 L285	L68-L107 HydrophobicContact CD2-CD1 3.25Å; L103-L107 WeakPolarHBondContact O-CB 3.35Å; L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 3.38Å; E104-L107 PolarHBondContact O-N 2.79Å; G105-L107 PolarHBondContact O-N 3.38Å; L107-E109 VanDerWaalsContact C-N 3.35Å; L107-A110 PolarHBondContact O-N 3.41Å; L107-N111 WeakPolarHBondContact O-CB 3.24Å; L107-N111 PolarHBondContact O-N 3.43Å; L107-R281 HydrophobicContact CD2-CG 4.14Å; L107-L284 HydrophobicContact CD2-CB 4.22Å; L107-L285 HydrophobicContact CD1-CD2 4.27Å; L107-L285 HydrophobicContact CD2-CD2 4.05Å; L107-L285 HydrophobicContact CD2-CG 4.16Å
108	Q	89.1	Confident	88.6	Confident	76 Å²	76	58.8 Å²	58.8	36%	0.355	31%	0.307	S	S	.	.	H	α-helix	trans	-63.5	-42.3	175.7	-77.2	179.6	4	0	0	111.6	F67 E104 G105 N111 Q112	F67-Q108 HydrophobicContact CE1-CG 4.32Å; F67-Q108 HydrophobicContact CZ-CG 4.09Å; E104-Q108 HydrophobicContact CG-CG 4.44Å; E104-Q108 WeakPolarHBondContact O-CB 3.3Å; E104-Q108 VanDerWaalsContact O-CG 3.3Å; E104-Q108 WeakPolarHBondContact O-CG 3.33Å; E104-Q108 PolarHBondContact O-N 2.95Å; E104-Q108 PolarHBondContact OE1-NE2 3.37Å; G105-Q108 PolarHBondContact O-N 3.5Å; Q108-N111 PolarHBondContact O-N 3.46Å; Q108-Q112 VanDerWaalsContact O-CG 3.3Å; Q108-Q112 WeakPolarHBondContact O-CG 3.29Å; Q108-Q112 PolarHBondContact O-N 3.42Å
109	E	90.2	Very high	88.4	Confident	121 Å²	121	60.6 Å²	60.6	57%	0.565	31%	0.307	S	S	*	.	H	α-helix	trans	-63.8	-45.6	175.2	-175.1	177.2	178.9	0	0	111.1	G105 L107 N111 Q112 N113	G105-E109 WeakPolarHBondContact O-CB 3.38Å; G105-E109 PolarHBondContact O-N 2.98Å; L107-E109 VanDerWaalsContact C-N 3.35Å; E109-N111 VanDerWaalsContact C-N 3.34Å; E109-N111 PolarHBondContact O-N 3.36Å; E109-Q112 PolarHBondContact O-N 2.89Å; E109-N113 WeakPolarHBondContact O-CB 3.42Å; E109-N113 PolarHBondContact O-N 3.37Å; E109-N113 PolarHBondContact O-ND2 2.99Å
110	A	87	Confident	88.3	Confident	9 Å²	9	60.1 Å²	60.1	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-42.9	175.9	0	0	0	0	0	112.2	E106 L107 N113 Q114	E106-A110 VanDerWaalsContact O-CB 3.27Å; E106-A110 WeakPolarHBondContact O-CB 3.3Å; E106-A110 PolarHBondContact O-N 2.95Å; L107-A110 PolarHBondContact O-N 3.41Å; A110-N113 PolarHBondContact O-N 3.24Å; A110-Q114 VanDerWaalsContact O-CB 3.29Å; A110-Q114 WeakPolarHBondContact O-CB 3.38Å; A110-Q114 PolarHBondContact O-N 2.91Å
111	N	85.9	Confident	88.2	Confident	37 Å²	37	63 Å²	63	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-43.3	178.7	-78.8	-3.9	0	0	0	111.7	E71 L107 Q108 E109 Q114 Q115 R281	E71-N111 VanDerWaalsContact CD-ND2 3.33Å; E71-N111 PolarHBondContact OE1-ND2 2.94Å; E71-N111 PolarHBondContact OE2-ND2 2.96Å; L107-N111 WeakPolarHBondContact O-CB 3.24Å; L107-N111 PolarHBondContact O-N 3.43Å; Q108-N111 PolarHBondContact O-N 3.46Å; E109-N111 VanDerWaalsContact C-N 3.34Å; E109-N111 PolarHBondContact O-N 3.36Å; N111-Q114 PolarHBondContact O-N 3.38Å; N111-Q115 WeakPolarHBondContact O-CB 3.38Å; N111-Q115 PolarHBondContact O-N 3.43Å; N111-R281 WeakPolarHBondContact OD1-CD 3.4Å
112	Q	88.9	Confident	88	Confident	128 Å²	128	59.2 Å²	59.2	60%	0.598	30%	0.303	S	S	*	.	H	α-helix	trans	-62.8	-44.7	175.1	-72.5	176.3	22.1	0	0	111.8	Q108 E109 Q115 A116	Q108-Q112 VanDerWaalsContact O-CG 3.3Å; Q108-Q112 WeakPolarHBondContact O-CG 3.29Å; Q108-Q112 PolarHBondContact O-N 3.42Å; E109-Q112 PolarHBondContact O-N 2.89Å; Q112-Q115 PolarHBondContact O-N 3.3Å; Q112-A116 WeakPolarHBondContact O-CB 3.31Å; Q112-A116 PolarHBondContact O-N 3.35Å
113	N	88.4	Confident	87.8	Confident	78 Å²	78	56.8 Å²	56.8	42%	0.417	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-43.2	177.8	-72.5	-24.2	0	0	0	111.4	E109 A110 A116 L117	E109-N113 WeakPolarHBondContact O-CB 3.42Å; E109-N113 PolarHBondContact O-N 3.37Å; E109-N113 PolarHBondContact O-ND2 2.99Å; A110-N113 PolarHBondContact O-N 3.24Å; N113-A116 PolarHBondContact O-N 3.03Å; N113-L117 WeakPolarHBondContact O-CB 3.42Å; N113-L117 VanDerWaalsContact O-CG 3.24Å; N113-L117 WeakPolarHBondContact O-CG 3.38Å; N113-L117 PolarHBondContact O-N 3.12Å
114	Q	85.1	Confident	87.7	Confident	20 Å²	20	57.7 Å²	57.7	9%	0.093	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-42.3	177.2	-170.5	177.6	5.2	0	0	111.5	A110 N111 L117 K118 T277 R281	A110-Q114 VanDerWaalsContact O-CB 3.29Å; A110-Q114 WeakPolarHBondContact O-CB 3.38Å; A110-Q114 PolarHBondContact O-N 2.91Å; N111-Q114 PolarHBondContact O-N 3.38Å; Q114-L117 PolarHBondContact O-N 3.3Å; Q114-K118 WeakPolarHBondContact O-CB 3.5Å; Q114-K118 WeakPolarHBondContact O-CG 3.48Å; Q114-K118 PolarHBondContact O-N 3.28Å; Q114-T277 HydrophobicContact CB-CG2 4.46Å; Q114-R281 VanDerWaalsContact OE1-NE 3.12Å
115	Q	86.9	Confident	87.7	Confident	93 Å²	93	57.2 Å²	57.2	44%	0.435	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-43	176.7	-170.5	-178.1	4.8	0	0	111.7	N111 Q112 K119	N111-Q115 WeakPolarHBondContact O-CB 3.38Å; N111-Q115 PolarHBondContact O-N 3.43Å; Q112-Q115 PolarHBondContact O-N 3.3Å; Q115-K119 WeakPolarHBondContact O-CB 3.49Å; Q115-K119 PolarHBondContact O-N 2.86Å
116	A	89.1	Confident	87.4	Confident	54 Å²	54	55.7 Å²	55.7	45%	0.446	28%	0.28	S	S	.	.	H	α-helix	trans	-63.1	-45.8	175.8	0	0	0	0	0	111.8	Q112 N113 K119 S120	Q112-A116 WeakPolarHBondContact O-CB 3.31Å; Q112-A116 PolarHBondContact O-N 3.35Å; N113-A116 PolarHBondContact O-N 3.03Å; A116-K119 PolarHBondContact O-N 2.91Å; A116-S120 PolarHBondContact O-N 2.83Å; A116-S120 PolarHBondContact O-OG 2.89Å
117	L	88.3	Confident	87.3	Confident	37 Å²	37	53.1 Å²	53.1	19%	0.194	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-45.3	177.4	-73.6	168.9	0	0	0	112.1	N113 Q114 K119 S120 F121 L270 V273 I274	N113-L117 WeakPolarHBondContact O-CB 3.42Å; N113-L117 VanDerWaalsContact O-CG 3.24Å; N113-L117 WeakPolarHBondContact O-CG 3.38Å; N113-L117 PolarHBondContact O-N 3.12Å; Q114-L117 PolarHBondContact O-N 3.3Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 3.45Å; L117-S120 PolarHBondContact O-N 3.4Å; L117-F121 VanDerWaalsContact O-CB 3.29Å; L117-F121 WeakPolarHBondContact O-CB 3.49Å; L117-F121 PolarHBondContact O-N 2.98Å; L117-L270 HydrophobicContact CD2-CD2 3.68Å; L117-V273 HydrophobicContact CD1-CG1 3.89Å; L117-V273 HydrophobicContact CD2-CG1 4.23Å; L117-I274 HydrophobicContact CB-CG1 4Å
118	K	86.1	Confident	87.3	Confident	64 Å²	64	56.1 Å²	56.1	28%	0.278	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-39.7	175.7	-77.6	-170.8	175.2	-167.7	0	111.8	Q114 F121 L122 P211	Q114-K118 WeakPolarHBondContact O-CB 3.5Å; Q114-K118 WeakPolarHBondContact O-CG 3.48Å; Q114-K118 PolarHBondContact O-N 3.28Å; K118-F121 PolarHBondContact O-N 3.42Å; K118-L122 WeakPolarHBondContact O-CB 3.45Å; K118-L122 PolarHBondContact O-N 3.33Å; K118-P211 HydrophobicContact CB-CB 4Å
119	K	87.6	Confident	87.2	Confident	118 Å²	118	55.8 Å²	55.8	51%	0.513	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-48.2	175.1	-174.7	-178.1	175.9	-175.2	0	111.7	Q115 A116 L117 F121 L122 E123 P211	Q115-K119 WeakPolarHBondContact O-CB 3.49Å; Q115-K119 PolarHBondContact O-N 2.86Å; A116-K119 PolarHBondContact O-N 2.91Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 3.45Å; K119-F121 VanDerWaalsContact C-N 3.31Å; K119-F121 PolarHBondContact O-N 3.04Å; K119-L122 PolarHBondContact O-N 3.15Å; K119-E123 VanDerWaalsContact CE-OE1 3.3Å; K119-E123 WeakPolarHBondContact CE-OE1 3.14Å; K119-E123 WeakPolarHBondContact O-CG 3.41Å; K119-E123 PolarHBondContact O-N 3.39Å; K119-P211 HydrophobicContact CB-CG 4.37Å
120	S	87.3	Confident	87	Confident	55 Å²	55	50 Å²	50	39%	0.385	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-37.4	176.4	-65.7	0	0	0	0	112.5	A116 L117 E123 L124	A116-S120 PolarHBondContact O-N 2.83Å; A116-S120 PolarHBondContact O-OG 2.89Å; L117-S120 PolarHBondContact O-N 3.4Å; S120-E123 PolarHBondContact O-N 3.01Å; S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 2.76Å
121	F	87.2	Confident	86.9	Confident	59 Å²	59	49.7 Å²	49.7	26%	0.259	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-43.5	174.8	178.4	-97.6	0	0	0	112	L117 K118 K119 L124 T125 L267 L270 I271 I274	L117-F121 VanDerWaalsContact O-CB 3.29Å; L117-F121 WeakPolarHBondContact O-CB 3.49Å; L117-F121 PolarHBondContact O-N 2.98Å; K118-F121 PolarHBondContact O-N 3.42Å; K119-F121 VanDerWaalsContact C-N 3.31Å; K119-F121 PolarHBondContact O-N 3.04Å; F121-L124 PolarHBondContact O-N 3.45Å; F121-T125 VanDerWaalsContact O-CB 3.31Å; F121-T125 WeakPolarHBondContact O-CB 3.34Å; F121-T125 PolarHBondContact O-N 3.17Å; F121-T125 PolarHBondContact O-OG1 2.92Å; F121-L267 HydrophobicContact CD2-CD2 4.4Å; F121-L267 HydrophobicContact CD2-CG 4.2Å; F121-L267 HydrophobicContact CE2-CD1 4.5Å; F121-L267 HydrophobicContact CE2-CD2 3.49Å; F121-L267 VanDerWaalsContact CE2-CD2 3.49Å; F121-L267 HydrophobicContact CE2-CG 3.71Å; F121-L267 HydrophobicContact CZ-CD2 4.1Å; F121-L270 HydrophobicContact CD2-CB 4.36Å; F121-I271 HydrophobicContact CD2-CG1 4.31Å; F121-I271 HydrophobicContact CE2-CD1 3.96Å; F121-I271 HydrophobicContact CE2-CG1 3.5Å; F121-I271 HydrophobicContact CZ-CD1 4.37Å; F121-I271 HydrophobicContact CZ-CG1 4.15Å; F121-I274 HydrophobicContact CB-CD1 3.86Å; F121-I274 HydrophobicContact CD2-CD1 4.13Å; F121-I274 HydrophobicContact CG-CD1 4.01Å
122	L	85.9	Confident	86.8	Confident	22 Å²	22	53.3 Å²	53.3	12%	0.115	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-46.8	176.4	-173.1	152.1	0	0	0	111.1	K118 K119 L124 T125 E126 L208 E209	K118-L122 WeakPolarHBondContact O-CB 3.45Å; K118-L122 PolarHBondContact O-N 3.33Å; K119-L122 PolarHBondContact O-N 3.15Å; L122-L124 VanDerWaalsContact C-N 3.34Å; L122-L124 PolarHBondContact O-N 3.46Å; L122-T125 PolarHBondContact O-N 3.42Å; L122-E126 HydrophobicContact CD2-CG 4.2Å; L122-E126 WeakPolarHBondContact CD2-OE1 3.22Å; L122-E126 WeakPolarHBondContact O-CG 3.46Å; L122-E126 PolarHBondContact O-N 3.4Å; L122-L208 HydrophobicContact CD1-CB 4.41Å; L122-L208 HydrophobicContact CG-CD1 4.32Å; L122-E209 WeakPolarHBondContact CD1-O 3.41Å
123	E	86.1	Confident	86.5	Confident	83 Å²	83	49.8 Å²	49.8	39%	0.388	25%	0.245	S	C	.	.	H	α-helix	trans	-60.9	-39.8	178.2	-72.4	173.9	-174.2	0	0	112.6	K119 S120 L127 Y247	K119-E123 VanDerWaalsContact CE-OE1 3.3Å; K119-E123 WeakPolarHBondContact CE-OE1 3.14Å; K119-E123 WeakPolarHBondContact O-CG 3.41Å; K119-E123 PolarHBondContact O-N 3.39Å; S120-E123 PolarHBondContact O-N 3.01Å; E123-L127 WeakPolarHBondContact O-CB 3.18Å; E123-L127 PolarHBondContact O-N 2.62Å; E123-L127 VanDerWaalsContact O-N 3.12Å; E123-Y247 WeakPolarHBondContact CA-OH 3.25Å; E123-Y247 PolarHBondContact O-OH 2.85Å
124	L	87.6	Confident	86.1	Confident	33 Å²	33	46.1 Å²	46.1	17%	0.173	23%	0.225	C	C	.	.	H	α-helix	trans	-73.8	-33	176.9	-72.1	171.3	0	0	0	112.7	S120 F121 L122 L127 K128 V263 L270	S120-L124 WeakPolarHBondContact O-CG 3.45Å; S120-L124 PolarHBondContact O-N 2.76Å; F121-L124 PolarHBondContact O-N 3.45Å; L122-L124 VanDerWaalsContact C-N 3.34Å; L122-L124 PolarHBondContact O-N 3.46Å; L124-L127 HydrophobicContact CD2-CD2 4.34Å; L124-L127 PolarHBondContact O-N 2.9Å; L124-K128 WeakPolarHBondContact O-CB 3.42Å; L124-K128 PolarHBondContact O-N 3.22Å; L124-V263 HydrophobicContact CB-CG1 4.49Å; L124-V263 HydrophobicContact CD2-CG1 4.4Å; L124-L270 HydrophobicContact CD1-CD1 3.3Å
125	T	87.4	Confident	85.9	Confident	12 Å²	12	46.2 Å²	46.2	7%	0.074	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-45.3	174.8	-61	0	0	0	0	110.6	F121 L122 L127 K128 Y129 L208	F121-T125 VanDerWaalsContact O-CB 3.31Å; F121-T125 WeakPolarHBondContact O-CB 3.34Å; F121-T125 PolarHBondContact O-N 3.17Å; F121-T125 PolarHBondContact O-OG1 2.92Å; L122-T125 PolarHBondContact O-N 3.42Å; T125-L127 VanDerWaalsContact C-N 3.32Å; T125-L127 PolarHBondContact O-N 3.4Å; T125-K128 WeakPolarHBondContact O-CB 3.39Å; T125-K128 PolarHBondContact O-N 2.95Å; T125-Y129 HydrophobicContact CG2-CD2 3.75Å; T125-Y129 HydrophobicContact CG2-CE2 3.54Å; T125-Y129 VanDerWaalsContact O-CD2 3.22Å; T125-Y129 WeakPolarHBondContact O-CD2 3.5Å; T125-Y129 PolarHBondContact O-N 3.42Å; T125-L208 HydrophobicContact CG2-CD2 3.75Å
126	E	85.8	Confident	85.5	Confident	2 Å²	2	45 Å²	45	1%	0.009	22%	0.222	C	C	.	.	H	α-helix	trans	-54.5	-48.6	171.9	-76.7	-174.7	-171.9	0	0	111.3	L122 K128 Y129 L130 V176 L208 K219 T245 Y247	L122-E126 HydrophobicContact CD2-CG 4.2Å; L122-E126 WeakPolarHBondContact CD2-OE1 3.22Å; L122-E126 WeakPolarHBondContact O-CG 3.46Å; L122-E126 PolarHBondContact O-N 3.4Å; E126-K128 PolarHBondContact O-N 3.5Å; E126-Y129 PolarHBondContact O-N 3.17Å; E126-L130 VanDerWaalsContact O-CB 3.31Å; E126-L130 WeakPolarHBondContact O-CB 3.44Å; E126-L130 PolarHBondContact O-N 2.93Å; E126-V176 HydrophobicContact CB-CG2 4.2Å; E126-V176 HydrophobicContact CG-CG1 4.45Å; E126-V176 HydrophobicContact CG-CG2 4.48Å; E126-L208 HydrophobicContact CG-CD1 3.85Å; E126-K219 WeakPolarHBondContact OE1-CD 3.48Å; E126-K219 WeakPolarHBondContact OE1-CE 3.47Å; E126-K219 IonicContact OE1-NZ 3.42Å; E126-K219 PolarHBondContact OE1-NZ 2.91Å; E126-T245 PolarHBondContact OE2-OG1 2.88Å; E126-Y247 HydrophobicContact CB-CE2 3.9Å; E126-Y247 PolarHBondContact OE2-OH 2.84Å; E126-Y247 VanDerWaalsContact OE2-OH 3.13Å
127	L	87.2	Confident	84.9	Confident	14 Å²	14	43.4 Å²	43.4	7%	0.073	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-42.2	178	179.8	63.8	0	0	0	112.5	E123 L124 T125 L130 L131 Y247 M259 V263	E123-L127 WeakPolarHBondContact O-CB 3.18Å; E123-L127 PolarHBondContact O-N 2.62Å; E123-L127 VanDerWaalsContact O-N 3.12Å; L124-L127 HydrophobicContact CD2-CD2 4.34Å; L124-L127 PolarHBondContact O-N 2.9Å; T125-L127 VanDerWaalsContact C-N 3.32Å; T125-L127 PolarHBondContact O-N 3.4Å; L127-L130 HydrophobicContact CD1-CD2 4.47Å; L127-L130 WeakPolarHBondContact O-CB 3.33Å; L127-L130 PolarHBondContact O-N 3.4Å; L127-L131 HydrophobicContact CD1-CD1 4.15Å; L127-L131 HydrophobicContact CD1-CG 4.19Å; L127-L131 HydrophobicContact CG-CD1 4.01Å; L127-L131 HydrophobicContact CG-CG 4.45Å; L127-L131 WeakPolarHBondContact O-CB 3.43Å; L127-L131 VanDerWaalsContact O-CG 3.26Å; L127-L131 WeakPolarHBondContact O-CG 3.31Å; L127-L131 PolarHBondContact O-N 3.2Å; L127-Y247 HydrophobicContact CB-CD1 4.22Å; L127-Y247 HydrophobicContact CB-CE1 4.23Å; L127-Y247 HydrophobicContact CD1-CD1 3.85Å; L127-Y247 HydrophobicContact CD1-CG 3.83Å; L127-Y247 HydrophobicContact CG-CD1 4.48Å; L127-M259 HydrophobicContact CD1-CE 4.21Å; L127-M259 HydrophobicContact CD2-CE 3.99Å; L127-V263 HydrophobicContact CD2-CG2 3.83Å; L127-V263 HydrophobicContact CG-CG2 4.44Å
128	K	87.3	Confident	84.3	Confident	63 Å²	63	44.7 Å²	44.7	27%	0.274	21%	0.209	S	C	.	.	H	α-helix	trans	-59.8	-49.5	177	171.2	179.3	173.1	160.9	0	111.7	L124 T125 E126 L130 L131 K132 L260 V263 N264 L267	L124-K128 WeakPolarHBondContact O-CB 3.42Å; L124-K128 PolarHBondContact O-N 3.22Å; T125-K128 WeakPolarHBondContact O-CB 3.39Å; T125-K128 PolarHBondContact O-N 2.95Å; E126-K128 PolarHBondContact O-N 3.5Å; K128-L130 VanDerWaalsContact C-N 3.34Å; K128-L131 PolarHBondContact O-N 3.08Å; K128-K132 WeakPolarHBondContact O-CB 3.37Å; K128-K132 PolarHBondContact O-N 3.44Å; K128-L260 HydrophobicContact CG-CD1 4.3Å; K128-V263 HydrophobicContact CB-CG1 4.07Å; K128-N264 VanDerWaalsContact CD-OD1 3.23Å; K128-N264 WeakPolarHBondContact CD-OD1 3.21Å; K128-N264 WeakPolarHBondContact CE-OD1 3.41Å; K128-N264 PolarHBondContact NZ-OD1 3.26Å; K128-L267 HydrophobicContact CD-CD1 3.85Å
129	Y	85.1	Confident	83.6	Confident	70 Å²	70	45.4 Å²	45.4	28%	0.275	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-40.1	179	-79	-72.3	0	0	0	111.7	T125 E126 K132 K133 M204	T125-Y129 HydrophobicContact CG2-CD2 3.75Å; T125-Y129 HydrophobicContact CG2-CE2 3.54Å; T125-Y129 VanDerWaalsContact O-CD2 3.22Å; T125-Y129 WeakPolarHBondContact O-CD2 3.5Å; T125-Y129 PolarHBondContact O-N 3.42Å; E126-Y129 PolarHBondContact O-N 3.17Å; Y129-K132 PolarHBondContact O-N 3.39Å; Y129-K133 WeakPolarHBondContact O-CG 3.3Å; Y129-K133 PolarHBondContact O-N 3.41Å; Y129-M204 HydrophobicContact CD1-CG 4.29Å; Y129-M204 HydrophobicContact CD2-CG 4.25Å; Y129-M204 HydrophobicContact CD2-SD 3.71Å; Y129-M204 HydrophobicContact CE2-SD 4.41Å; Y129-M204 HydrophobicContact CG-CG 4.07Å; Y129-M204 HydrophobicContact CG-SD 3.86Å
130	L	86.6	Confident	82.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-55.6	-54.3	173.2	-168.8	97.2	0	0	0	110.8	E126 L127 K128 K132 K133 T134 A174 V176 I221 Y247	E126-L130 VanDerWaalsContact O-CB 3.31Å; E126-L130 WeakPolarHBondContact O-CB 3.44Å; E126-L130 PolarHBondContact O-N 2.93Å; L127-L130 HydrophobicContact CD1-CD2 4.47Å; L127-L130 WeakPolarHBondContact O-CB 3.33Å; L127-L130 PolarHBondContact O-N 3.4Å; K128-L130 VanDerWaalsContact C-N 3.34Å; L130-K132 VanDerWaalsContact C-N 3.35Å; L130-K132 PolarHBondContact O-N 3.05Å; L130-K133 PolarHBondContact O-N 2.97Å; L130-T134 VanDerWaalsContact O-CB 3.24Å; L130-T134 WeakPolarHBondContact O-CB 3.42Å; L130-T134 PolarHBondContact O-N 3.39Å; L130-T134 PolarHBondContact O-OG1 3.23Å; L130-A174 HydrophobicContact CD1-CB 3.98Å; L130-A174 HydrophobicContact CD2-CB 3.89Å; L130-A174 HydrophobicContact CG-CB 4.11Å; L130-V176 HydrophobicContact CD1-CG2 4.08Å; L130-I221 HydrophobicContact CD1-CB 4.43Å; L130-I221 HydrophobicContact CD1-CG1 4.24Å; L130-I221 HydrophobicContact CD1-CG2 3.56Å; L130-I221 HydrophobicContact CG-CG2 4.43Å; L130-Y247 HydrophobicContact CD2-CD2 4.24Å; L130-Y247 HydrophobicContact CD2-CG 4.37Å
131	L	84.6	Confident	81.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-42.1	-178.3	-70.4	170.5	0	0	0	111.8	L127 K128 Q135 R256 M259 L260	L127-L131 HydrophobicContact CD1-CD1 4.15Å; L127-L131 HydrophobicContact CD1-CG 4.19Å; L127-L131 HydrophobicContact CG-CD1 4.01Å; L127-L131 HydrophobicContact CG-CG 4.45Å; L127-L131 WeakPolarHBondContact O-CB 3.43Å; L127-L131 VanDerWaalsContact O-CG 3.26Å; L127-L131 WeakPolarHBondContact O-CG 3.31Å; L127-L131 PolarHBondContact O-N 3.2Å; K128-L131 PolarHBondContact O-N 3.08Å; L131-Q135 WeakPolarHBondContact O-CB 3.48Å; L131-Q135 PolarHBondContact O-N 3Å; L131-R256 HydrophobicContact CD2-CG 3.65Å; L131-M259 HydrophobicContact CD1-CB 4.48Å; L131-M259 HydrophobicContact CD1-CG 4.02Å; L131-M259 HydrophobicContact CD1-SD 4.36Å; L131-M259 HydrophobicContact CD2-SD 4.43Å; L131-L260 HydrophobicContact CB-CD1 3.77Å; L131-L260 HydrophobicContact CD1-CD1 4.48Å
132	K	85.1	Confident	79.6	Confident	113 Å²	113	46.9 Å²	46.9	49%	0.491	23%	0.228	S	C	.	.	H	α-helix	trans	-62.9	-52.8	178	-173.9	175.5	-178.2	-179.7	0	112.1	K128 Y129 L130 T134 Q135 D136	K128-K132 WeakPolarHBondContact O-CB 3.37Å; K128-K132 PolarHBondContact O-N 3.44Å; Y129-K132 PolarHBondContact O-N 3.39Å; L130-K132 VanDerWaalsContact C-N 3.35Å; L130-K132 PolarHBondContact O-N 3.05Å; K132-T134 VanDerWaalsContact C-N 3.32Å; K132-T134 PolarHBondContact O-N 3.46Å; K132-Q135 WeakPolarHBondContact O-CB 3.29Å; K132-Q135 PolarHBondContact O-N 3.22Å; K132-D136 VanDerWaalsContact O-CG 3.3Å; K132-D136 PolarHBondContact O-N 2.9Å
133	K	82.5	Confident	77.9	Confident	55 Å²	55	51.9 Å²	51.9	24%	0.239	26%	0.255	C	S	.	.	H	α-helix	trans	-67.9	-32.6	-179.6	-65.6	-68.1	-170.2	174.7	0	112.4	Y129 L130 F137 D205 I221	Y129-K133 WeakPolarHBondContact O-CG 3.3Å; Y129-K133 PolarHBondContact O-N 3.41Å; L130-K133 PolarHBondContact O-N 2.97Å; K133-F137 WeakPolarHBondContact O-CB 3.47Å; K133-F137 PolarHBondContact O-N 3.27Å; K133-D205 IonicContact NZ-OD2 3.37Å; K133-I221 HydrophobicContact CB-CD1 4.29Å; K133-I221 HydrophobicContact CG-CD1 4.04Å
134	T	80.3	Confident	76.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-40.1	173.8	-49.3	0	0	0	0	110.5	L130 K132 F137 F138 F172 I223	L130-T134 VanDerWaalsContact O-CB 3.24Å; L130-T134 WeakPolarHBondContact O-CB 3.42Å; L130-T134 PolarHBondContact O-N 3.39Å; L130-T134 PolarHBondContact O-OG1 3.23Å; K132-T134 VanDerWaalsContact C-N 3.32Å; K132-T134 PolarHBondContact O-N 3.46Å; T134-F137 PolarHBondContact O-N 3.16Å; T134-F138 HydrophobicContact CG2-CD2 3.82Å; T134-F138 HydrophobicContact CG2-CE2 3.64Å; T134-F138 VanDerWaalsContact O-CD2 3.24Å; T134-F138 WeakPolarHBondContact O-CD2 3.26Å; T134-F138 PolarHBondContact O-N 3.28Å; T134-F138 VanDerWaalsContact O-N 3.1Å; T134-F172 HydrophobicContact CG2-CE2 4.44Å; T134-I223 HydrophobicContact CG2-CD1 4.03Å
135	Q	80.1	Confident	74.1	Confident	23 Å²	23	53.1 Å²	53.1	11%	0.107	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-50.3	173.7	-172.7	66.2	11.4	0	0	111.6	L131 K132 F137 F138 E139	L131-Q135 WeakPolarHBondContact O-CB 3.48Å; L131-Q135 PolarHBondContact O-N 3Å; K132-Q135 WeakPolarHBondContact O-CB 3.29Å; K132-Q135 PolarHBondContact O-N 3.22Å; Q135-F137 PolarHBondContact O-N 2.96Å; Q135-F138 PolarHBondContact O-N 2.79Å; Q135-E139 PolarHBondContact NE2-OE1 2.83Å; Q135-E139 PolarHBondContact O-N 2.85Å
136	D	79.1	Confident	71.8	Confident	68 Å²	68	59.7 Å²	59.7	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-56.4	-40.5	177.6	-62.4	-20.1	0	0	0	111.1	K132 T140	K132-D136 VanDerWaalsContact O-CG 3.3Å; K132-D136 PolarHBondContact O-N 2.9Å; D136-T140 WeakPolarHBondContact O-CB 3.38Å; D136-T140 PolarHBondContact O-N 3.01Å; D136-T140 PolarHBondContact O-OG1 3.46Å
137	F	76.8	Confident	69.6	Low	20 Å²	20	66.3 Å²	66.3	9%	0.088	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-51.1	177.5	172.6	-97.5	0	0	0	112.4	K133 T134 Q135 E139 T140 E141 K200 F225	K133-F137 WeakPolarHBondContact O-CB 3.47Å; K133-F137 PolarHBondContact O-N 3.27Å; T134-F137 PolarHBondContact O-N 3.16Å; Q135-F137 PolarHBondContact O-N 2.96Å; F137-E139 VanDerWaalsContact C-N 3.35Å; F137-E139 PolarHBondContact O-N 2.98Å; F137-T140 PolarHBondContact O-N 3.27Å; F137-E141 HydrophobicContact CE2-CG 4.04Å; F137-E141 VanDerWaalsContact CE2-OE1 3.32Å; F137-E141 WeakPolarHBondContact CE2-OE1 3.28Å; F137-E141 HydrophobicContact CZ-CG 4.04Å; F137-E141 WeakPolarHBondContact CZ-OE1 3.43Å; F137-E141 PolarHBondContact O-N 2.89Å; F137-E141 VanDerWaalsContact O-N 3.11Å; F137-K200 HydrophobicContact CD2-CD 3.66Å; F137-K200 HydrophobicContact CE2-CD 3.38Å; F137-K200 HydrophobicContact CZ-CD 4.35Å; F137-F225 HydrophobicContact CD1-CZ 4.35Å; F137-F225 AromaticContact CE1-CE2 3.95Å; F137-F225 HydrophobicContact CE1-CE2 3.95Å; F137-F225 AromaticContact CE1-CZ 3.53Å; F137-F225 HydrophobicContact CE1-CZ 3.53Å; F137-F225 HydrophobicContact CZ-CE2 4.1Å; F137-F225 HydrophobicContact CZ-CZ 4.11Å
138	F	73.9	Confident	67.3	Low	64 Å²	64	73.6 Å²	73.6	28%	0.281	37%	0.373	S	S	.	.	H	α-helix	trans	-67.6	-35.1	-179.1	-80.5	-73.1	0	0	0	112.2	T134 Q135 T142 F172 F225 R256	T134-F138 HydrophobicContact CG2-CD2 3.82Å; T134-F138 HydrophobicContact CG2-CE2 3.64Å; T134-F138 VanDerWaalsContact O-CD2 3.24Å; T134-F138 WeakPolarHBondContact O-CD2 3.26Å; T134-F138 PolarHBondContact O-N 3.28Å; T134-F138 VanDerWaalsContact O-N 3.1Å; Q135-F138 PolarHBondContact O-N 2.79Å; F138-T142 WeakPolarHBondContact O-CG2 3.34Å; F138-T142 PolarHBondContact O-N 3.41Å; F138-T142 PolarHBondContact O-OG1 3.41Å; F138-T142 VanDerWaalsContact O-OG1 3.04Å; F138-F172 HydrophobicContact CE2-CE1 4.48Å; F138-F172 HydrophobicContact CE2-CZ 4.34Å; F138-F172 HydrophobicContact CZ-CD1 4.33Å; F138-F172 HydrophobicContact CZ-CE1 4.22Å; F138-F225 HydrophobicContact CE1-CE1 4.38Å; F138-F225 AromaticContact CZ-CE1 3.98Å; F138-F225 HydrophobicContact CZ-CE1 3.98Å; F138-F225 HydrophobicContact CZ-CZ 4.15Å; F138-R256 VanDerWaalsContact CD2-NH1 3.28Å
139	E	71.6	Confident	64.8	Low	79 Å²	79	79.6 Å²	79.6	37%	0.369	40%	0.399	S	S	.	.	H	α-helix	trans	-68.7	-38.2	175.5	-73.9	-178.2	-177.7	0	0	112.4	Q135 F137 T142 N143	Q135-E139 PolarHBondContact NE2-OE1 2.83Å; Q135-E139 PolarHBondContact O-N 2.85Å; F137-E139 VanDerWaalsContact C-N 3.35Å; F137-E139 PolarHBondContact O-N 2.98Å; E139-T142 VanDerWaalsContact CA-OG1 3.31Å; E139-T142 WeakPolarHBondContact CA-OG1 3.39Å; E139-T142 PolarHBondContact O-N 3.19Å; E139-T142 PolarHBondContact O-OG1 3.49Å; E139-N143 WeakPolarHBondContact O-CB 3.37Å; E139-N143 VanDerWaalsContact O-CG 3.29Å; E139-N143 PolarHBondContact O-N 3.42Å; E139-N143 PolarHBondContact O-ND2 2.93Å
140	T	66.3	Low	62.6	Low	81 Å²	81	82 Å²	82	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-65.6	-40.5	176.8	-53.9	0	0	0	0	111.5	D136 F137 N143 L144	D136-T140 WeakPolarHBondContact O-CB 3.38Å; D136-T140 PolarHBondContact O-N 3.01Å; D136-T140 PolarHBondContact O-OG1 3.46Å; F137-T140 PolarHBondContact O-N 3.27Å; T140-N143 PolarHBondContact O-N 2.94Å; T140-L144 HydrophobicContact CG2-CD1 4.21Å; T140-L144 PolarHBondContact O-N 3.21Å; T140-L144 VanDerWaalsContact O-N 3.16Å
141	E	57.7	Low	60.3	Low	94 Å²	94	90.5 Å²	90.5	44%	0.439	46%	0.461	S	S	.	.	H	α-helix	trans	-75.2	-31.1	177.7	-65.9	-142.6	171.9	0	0	113.2	F137 N143 L144 A145	F137-E141 HydrophobicContact CE2-CG 4.04Å; F137-E141 VanDerWaalsContact CE2-OE1 3.32Å; F137-E141 WeakPolarHBondContact CE2-OE1 3.28Å; F137-E141 HydrophobicContact CZ-CG 4.04Å; F137-E141 WeakPolarHBondContact CZ-OE1 3.43Å; F137-E141 PolarHBondContact O-N 2.89Å; F137-E141 VanDerWaalsContact O-N 3.11Å; E141-N143 VanDerWaalsContact C-N 3.34Å; E141-L144 PolarHBondContact O-N 2.74Å; E141-A145 WeakPolarHBondContact O-CB 3.15Å; E141-A145 PolarHBondContact O-N 3.38Å
142	T	55.3	Low	57.9	Low	87 Å²	87	97.2 Å²	97.2	53%	0.534	50%	0.497	S	S	.	.	H	α-helix	trans	-67.4	-34.6	171.2	48.2	0	0	0	0	112.6	F138 E139 L144 A145	F138-T142 WeakPolarHBondContact O-CG2 3.34Å; F138-T142 PolarHBondContact O-N 3.41Å; F138-T142 PolarHBondContact O-OG1 3.41Å; F138-T142 VanDerWaalsContact O-OG1 3.04Å; E139-T142 VanDerWaalsContact CA-OG1 3.31Å; E139-T142 WeakPolarHBondContact CA-OG1 3.39Å; E139-T142 PolarHBondContact O-N 3.19Å; E139-T142 PolarHBondContact O-OG1 3.49Å; T142-L144 VanDerWaalsContact C-N 3.34Å; T142-A145 PolarHBondContact O-N 2.95Å
143	N	49.1	Very low	55.5	Low	128 Å²	128	98.6 Å²	98.6	68%	0.684	52%	0.515	S	S	*	.	H	α-helix	trans	-75.1	-22.5	176.3	-71.3	-23.4	0	0	0	113	E139 T140 E141	E139-N143 WeakPolarHBondContact O-CB 3.37Å; E139-N143 VanDerWaalsContact O-CG 3.29Å; E139-N143 PolarHBondContact O-N 3.42Å; E139-N143 PolarHBondContact O-ND2 2.93Å; T140-N143 PolarHBondContact O-N 2.94Å; E141-N143 VanDerWaalsContact C-N 3.34Å
144	L	48	Very low	53.5	Low	92 Å²	92	102.4 Å²	102.4	48%	0.482	55%	0.549	S	S	.	.	H	α-helix	trans	-82.9	-23.9	172.3	-85.6	156.6	0	0	0	113	T140 E141 T142 D146 D147	T140-L144 HydrophobicContact CG2-CD1 4.21Å; T140-L144 PolarHBondContact O-N 3.21Å; T140-L144 VanDerWaalsContact O-N 3.16Å; E141-L144 PolarHBondContact O-N 2.74Å; T142-L144 VanDerWaalsContact C-N 3.34Å; L144-D146 VanDerWaalsContact C-N 3.34Å; L144-D146 PolarHBondContact O-N 3.11Å; L144-D147 PolarHBondContact O-N 2.66Å
145	A	45.8	Very low	51.4	Low	50 Å²	50	105.3 Å²	105.3	41%	0.413	58%	0.579	S	S	.	*	H	α-helix	trans	-73.9	-19.7	-176.2	0	0	0	0	0	114.4	E141 T142	E141-A145 WeakPolarHBondContact O-CB 3.15Å; E141-A145 PolarHBondContact O-N 3.38Å; T142-A145 PolarHBondContact O-N 2.95Å
146	D	39.8	Very low	49.4	Very low	150 Å²	150	112.3 Å²	112.3	80%	0.802	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-16.2	175.6	-89.3	-12.6	0	0	0	113.6	L144	L144-D146 VanDerWaalsContact C-N 3.34Å; L144-D146 PolarHBondContact O-N 3.11Å
147	D	39	Very low	47.3	Very low	140 Å²	140	117.3 Å²	117.3	75%	0.749	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-5.6	-179.8	-93	-11.8	0	0	0	114.3	L144	L144-D147 PolarHBondContact O-N 2.66Å
148	F	38.5	Very low	45.4	Very low	167 Å²	167	125.3 Å²	125.3	73%	0.732	68%	0.68	S	S	*	*	S	Bend	trans	-103.7	-3.9	-171.4	-114.1	-92	0	0	0	116.3
149	F	36.4	Very low	43.5	Very low	189 Å²	189	129.8 Å²	129.8	83%	0.829	71%	0.705	S	S	*	*	S	Bend	trans	-108	5	-172.7	-92.6	-74.8	0	0	0	116.5
150	T	38.7	Very low	41.6	Very low	121 Å²	121	135 Å²	135	74%	0.742	73%	0.727	S	S	*	*	S	Bend	trans	-109.1	-17.2	-172.9	39.7	0	0	0	0	118.3
151	E	38.3	Very low	40	Very low	178 Å²	178	135.5 Å²	135.5	83%	0.832	74%	0.739	S	S	*	*	S	Bend	trans	-142.1	127.3	176.6	-72.9	-172.4	149.7	0	0	113.8
152	D	33.3	Very low	38.8	Very low	142 Å²	142	137.4 Å²	137.4	76%	0.759	76%	0.757	S	S	*	*			trans	75.7	89.6	159.6	-59.4	-18.8	0	0	0	119.9
153	T	35.9	Very low	38.1	Very low	142 Å²	142	138.7 Å²	138.7	87%	0.871	77%	0.767	S	S	*	*				-171.5	77.9	109.6	27	0	0	0	0	111.7	G155	T153-G155 PolarHBondContact O-N 2.91Å
154	S	38.6	Very low	38	Very low	136 Å²	136	136.8 Å²	136.8	95%	0.951	77%	0.769	S	S	*	*			trans	-65.3	71.3	159.5	-53.9	0	0	0	0	111
155	G	37.6	Very low	37.3	Very low	61 Å²	61	141.6 Å²	141.6	63%	0.629	79%	0.788	S	S	*	*			trans	-153.1	0.8	-170.8	0	0	0	0	0	120.1	T153	T153-G155 PolarHBondContact O-N 2.91Å
156	L	38.5	Very low	36.7	Very low	170 Å²	170	147.1 Å²	147.1	89%	0.89	81%	0.808	S	S	*	*	S	Bend	trans	-154.9	35.9	-179.3	-129.5	148.8	0	0	0	116.2
157	L	35.2	Very low	36.8	Very low	173 Å²	173	147 Å²	147	91%	0.906	81%	0.813	S	S	*	*			trans	-139.8	82	169.6	-94.9	166.4	0	0	0	111.3
158	E	35.2	Very low	37.1	Very low	188 Å²	188	141.7 Å²	141.7	88%	0.879	79%	0.791	S	S	*	*			trans	-132.5	101.5	146.4	-91.3	-162.2	156.3	0	0	109.4
159	L	34.4	Very low	38.1	Very low	157 Å²	157	141.1 Å²	141.1	82%	0.822	79%	0.788	S	S	*	*	S	Bend		-170.7	92.4	129.4	-101.3	153.6	0	0	0	111.1
160	K	32.2	Very low	39.6	Very low	189 Å²	189	137.4 Å²	137.4	82%	0.822	78%	0.776	S	S	*	*			trans	49.6	101.9	138.8	-70.3	-179.4	176.4	175.3	0	119.9
161	A	33.4	Very low	41.3	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	75%	0.749	S	S	*	*				83.1	139.1	106.2	0	0	0	0	0	121.3
162	V	32.6	Very low	43.5	Very low	135 Å²	135	125.4 Å²	125.4	82%	0.818	72%	0.715	S	S	*	*			trans	95.9	139.9	160.1	-158.9	0	0	0	0	114
163	P	39.8	Very low	46	Very low	114 Å²	114	119.5 Å²	119.5	74%	0.74	68%	0.684	S	S	*	*				-122.1	-171.4	-82.4	38.9	-17.8	0	0	0	110.7	H165	P163-H165 PolarHBondContact O-N 3.27Å
164	A	45.9	Very low	48.4	Very low	88 Å²	88	112.8 Å²	112.8	73%	0.727	64%	0.643	S	S	*	*			trans	-30.1	123.9	176.4	0	0	0	0	0	116.2
165	H	34.9	Very low	50.8	Low	192 Å²	192	106.3 Å²	106.3	89%	0.889	60%	0.598	S	S	*	*			trans	-162.8	130.1	140.2	-93.9	6.6	0	0	0	110.7	P163	P163-H165 PolarHBondContact O-N 3.27Å
166	M	31.7	Very low	53.2	Low	167 Å²	167	103.5 Å²	103.5	82%	0.823	57%	0.568	S	S	*	*			trans	69.3	85.7	177.2	-78.4	163.2	50.6	0	0	117	G168	M166-G168 PolarHBondContact O-N 3.05Å
167	T	42.5	Very low	55.6	Low	148 Å²	148	95.6 Å²	95.6	91%	0.908	53%	0.527	S	S	*	.			trans	-55.1	83.2	138.4	40.2	0	0	0	0	108.2	K169	T167-K169 PolarHBondContact O-N 3.16Å
168	G	45.3	Very low	58	Low	28 Å²	28	90 Å²	90	29%	0.289	50%	0.498	S	S	.	.			trans	-65.6	103.1	175.8	0	0	0	0	0	108.4	M166 L170	M166-G168 PolarHBondContact O-N 3.05Å; G168-L170 PolarHBondContact O-N 3.47Å
169	K	59.3	Low	60.3	Low	155 Å²	155	86.4 Å²	86.4	67%	0.674	48%	0.476	S	S	*	.			trans	-55.2	114.4	171.3	-161.6	177.4	-176.9	-166.1	0	107.8	T167 G171 E251	T167-K169 PolarHBondContact O-N 3.16Å; K169-G171 PolarHBondContact O-N 3.45Å; K169-E251 WeakPolarHBondContact CE-OE1 3.43Å; K169-E251 WeakPolarHBondContact CE-OE2 3.08Å; K169-E251 IonicContact NZ-OE1 3.37Å; K169-E251 PolarHBondContact NZ-OE1 3.48Å; K169-E251 IonicContact NZ-OE2 2.64Å; K169-E251 PolarHBondContact NZ-OE2 3.43Å
170	L	68.2	Low	62.8	Low	110 Å²	110	87.5 Å²	87.5	58%	0.576	48%	0.477	S	S	*	.			trans	-66.7	119.5	176.8	-77.6	159.6	0	0	0	107.9	G168 Q227	G168-L170 PolarHBondContact O-N 3.47Å; L170-Q227 HydrophobicContact CD2-CB 4.42Å
171	G	74.9	Confident	65.3	Low	16 Å²	16	83.4 Å²	83.4	17%	0.165	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	141.5	171.8	0	0	0	0	0	109.1	K169 Y226	K169-G171 PolarHBondContact O-N 3.45Å; G171-Y226 PolarHBondContact N-O 3.21Å; G171-Y226 WeakPolarHBondContact O-CD1 3.38Å; G171-Y226 PolarHBondContact O-N 2.86Å; G171-Y226 VanDerWaalsContact O-O 3.05Å
172	F	84.8	Confident	67.6	Low	31 Å²	31	81.3 Å²	81.3	14%	0.136	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	151.9	169.2	74.2	-86.8	0	0	0	111.4	T134 F138 I223 I224 F225 C249 E251	T134-F172 HydrophobicContact CG2-CE2 4.44Å; F138-F172 HydrophobicContact CE2-CE1 4.48Å; F138-F172 HydrophobicContact CE2-CZ 4.34Å; F138-F172 HydrophobicContact CZ-CD1 4.33Å; F138-F172 HydrophobicContact CZ-CE1 4.22Å; F172-I223 HydrophobicContact CB-CG2 4.47Å; F172-I223 HydrophobicContact CD2-CG2 4.25Å; F172-I224 CarbonylContact C-O 3.51Å; F172-I224 WeakPolarHBondContact CA-O 3.43Å; F172-F225 HydrophobicContact CB-CD1 3.64Å; F172-F225 HydrophobicContact CB-CE1 3.72Å; F172-F225 HydrophobicContact CB-CG 4.33Å; F172-F225 HydrophobicContact CB-CZ 4.48Å; F172-F225 HydrophobicContact CG-CE1 4.27Å; F172-C249 HydrophobicContact CE2-CB 3.76Å; F172-C249 HydrophobicContact CZ-CB 4.08Å; F172-E251 HydrophobicContact CE1-CG 3.94Å
173	I	86.4	Confident	70.1	Confident	18 Å²	18	77.3 Å²	77.3	9%	0.092	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.5	170.3	-81.5	162.2	0	0	0	106.5	F222 I223 I224 Y226 R232 I235 V246	I173-F222 HydrophobicContact CG2-CE2 4.41Å; I173-I223 WeakPolarHBondContact O-CA 2.82Å; I173-I224 PolarHBondContact N-O 2.89Å; I173-I224 PolarHBondContact O-N 3.42Å; I173-Y226 HydrophobicContact CB-CE1 4.07Å; I173-Y226 HydrophobicContact CD1-CD1 4.41Å; I173-Y226 HydrophobicContact CD1-CE1 3.54Å; I173-Y226 HydrophobicContact CG1-CE1 3.6Å; I173-R232 HydrophobicContact CD1-CG 3.96Å; I173-I235 HydrophobicContact CD1-CB 4.46Å; I173-I235 HydrophobicContact CD1-CG2 4.09Å; I173-V246 HydrophobicContact CG2-CG1 3.73Å; I173-V246 HydrophobicContact CG2-CG2 4.26Å
174	A	86	Confident	72.4	Confident	2 Å²	2	74.4 Å²	74.4	2%	0.017	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139	173.7	0	0	0	0	0	109.3	L130 F222 I223 Y247	L130-A174 HydrophobicContact CD1-CB 3.98Å; L130-A174 HydrophobicContact CD2-CB 3.89Å; L130-A174 HydrophobicContact CG-CB 4.11Å; A174-F222 WeakPolarHBondContact CA-O 3.17Å; A174-I223 HydrophobicContact CB-CG1 4.31Å; A174-Y247 PolarHBondContact O-N 3.05Å
175	G	88.6	Confident	74.5	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	178	-179.9	0	0	0	0	0	112.7	I221 F222 T245	G175-I221 WeakPolarHBondContact O-CA 3.22Å; G175-F222 PolarHBondContact N-O 3.14Å; G175-F222 VanDerWaalsContact O-CD1 3.29Å; G175-F222 WeakPolarHBondContact O-CD1 3.33Å; G175-F222 PolarHBondContact O-N 3.41Å; G175-T245 CarbonylContact C-O 3.48Å; G175-T245 WeakPolarHBondContact CA-O 3.42Å
176	V	87.8	Confident	76.9	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.012	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.2	-177.6	-174.7	0	0	0	0	109.7	E126 L130 K219 N220 I221 A244 T245 Y247	E126-V176 HydrophobicContact CB-CG2 4.2Å; E126-V176 HydrophobicContact CG-CG1 4.45Å; E126-V176 HydrophobicContact CG-CG2 4.48Å; L130-V176 HydrophobicContact CD1-CG2 4.08Å; V176-K219 HydrophobicContact CG1-CB 3.53Å; V176-K219 HydrophobicContact CG1-CD 3.8Å; V176-K219 HydrophobicContact CG1-CG 4.28Å; V176-N220 WeakPolarHBondContact CA-O 3.5Å; V176-I221 HydrophobicContact CG2-CG1 4.16Å; V176-A244 WeakPolarHBondContact O-CA 3.46Å; V176-T245 PolarHBondContact N-O 3.3Å; V176-T245 PolarHBondContact O-N 3.48Å; V176-T245 VanDerWaalsContact O-N 3.16Å; V176-Y247 HydrophobicContact CG2-CE2 4.27Å
177	I	89.3	Confident	79.5	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.9	180	-166.6	168.9	0	0	0	111.2	R181 F185 F201 K219 N220 F222 F242 A244	I177-R181 HydrophobicContact CD1-CB 4.42Å; I177-F185 HydrophobicContact CD1-CB 3.71Å; I177-F185 HydrophobicContact CD1-CD1 4.27Å; I177-F185 HydrophobicContact CD1-CD2 3.78Å; I177-F185 HydrophobicContact CD1-CE2 4.47Å; I177-F185 HydrophobicContact CD1-CG 3.67Å; I177-F201 HydrophobicContact CG2-CE1 4.41Å; I177-K219 CarbonylContact O-C 3.5Å; I177-K219 WeakPolarHBondContact O-CA 3.42Å; I177-N220 PolarHBondContact N-O 2.82Å; I177-N220 PolarHBondContact O-N 3.43Å; I177-F222 HydrophobicContact CB-CD1 4.06Å; I177-F222 HydrophobicContact CB-CE1 4.04Å; I177-F222 HydrophobicContact CG2-CD1 3.82Å; I177-F222 HydrophobicContact CG2-CE1 4.32Å; I177-F242 HydrophobicContact CD1-CB 4.33Å; I177-A244 HydrophobicContact CB-CB 4.39Å; I177-A244 HydrophobicContact CG1-CB 4.46Å
178	N	86.1	Confident	81.7	Confident	56 Å²	56	62.2 Å²	62.2	30%	0.299	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	140.1	174.6	-65.8	5.2	0	0	0	111.2	E180 R181 K219	N178-E180 VanDerWaalsContact C-N 3.29Å; N178-E180 PolarHBondContact O-N 2.83Å; N178-R181 PolarHBondContact O-N 2.89Å; N178-R181 VanDerWaalsContact O-N 3.16Å; N178-K219 WeakPolarHBondContact OD1-CE 3.37Å
179	R	83.4	Confident	83.7	Confident	112 Å²	112	61.2 Å²	61.2	42%	0.423	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-55.9	-39.5	-175.7	-169	175.2	-167.2	172	9.4	113.5	R181 M182 E203 Q218	R179-R181 VanDerWaalsContact C-N 3.27Å; R179-R181 PolarHBondContact O-N 3.16Å; R179-M182 WeakPolarHBondContact O-CB 3.41Å; R179-M182 PolarHBondContact O-N 3.35Å; R179-E203 IonicContact CZ-OE1 3.04Å; R179-E203 IonicContact NE-OE1 3.68Å; R179-E203 IonicContact NH2-OE1 3.6Å; R179-E203 PolarHBondContact NH2-OE1 3.18Å; R179-E203 IonicContact NH2-OE2 3.4Å; R179-Q218 PolarHBondContact N-O 3.23Å
180	E	85.1	Confident	84.9	Confident	179 Å²	179	61.8 Å²	61.8	84%	0.836	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-61.7	-32.7	-178	-59.6	-177.9	162.4	0	0	113.7	N178	N178-E180 VanDerWaalsContact C-N 3.29Å; N178-E180 PolarHBondContact O-N 2.83Å
181	R	84.9	Confident	85.7	Confident	104 Å²	104	66 Å²	66	39%	0.392	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-92.2	0.2	-174.6	-62.7	-175.9	-179.3	-169.4	-1.7	113.2	I177 N178 R179 S184 F185 F242	I177-R181 HydrophobicContact CD1-CB 4.42Å; N178-R181 PolarHBondContact O-N 2.89Å; N178-R181 VanDerWaalsContact O-N 3.16Å; R179-R181 VanDerWaalsContact C-N 3.27Å; R179-R181 PolarHBondContact O-N 3.16Å; R181-S184 PolarHBondContact O-N 2.99Å; R181-S184 PolarHBondContact O-OG 2.98Å; R181-F185 WeakPolarHBondContact O-CB 3.32Å; R181-F185 PolarHBondContact O-N 2.85Å; R181-F242 PolarHBondContact NH1-O 3.37Å
182	M	82.8	Confident	86.2	Confident	47 Å²	47	69 Å²	69	23%	0.232	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-54.7	-175.7	-177.4	-170.6	-159	0	0	112.6	R179 S184 F185 E186 F201	R179-M182 WeakPolarHBondContact O-CB 3.41Å; R179-M182 PolarHBondContact O-N 3.35Å; M182-S184 VanDerWaalsContact C-N 3.3Å; M182-S184 PolarHBondContact O-N 3.33Å; M182-F185 WeakPolarHBondContact O-CB 3.45Å; M182-F185 PolarHBondContact O-N 3.23Å; M182-F185 VanDerWaalsContact O-N 3.11Å; M182-E186 PolarHBondContact O-N 3.34Å; M182-F201 HydrophobicContact CE-CB 3.39Å; M182-F201 HydrophobicContact CE-CD1 3.78Å; M182-F201 HydrophobicContact CE-CD2 3.43Å; M182-F201 VanDerWaalsContact CE-CD2 3.43Å; M182-F201 HydrophobicContact CE-CE1 4.34Å; M182-F201 HydrophobicContact CE-CE2 4.02Å; M182-F201 HydrophobicContact CE-CG 3.26Å; M182-F201 HydrophobicContact CE-CZ 4.42Å; M182-F201 HydrophobicContact CG-CD1 4.37Å; M182-F201 HydrophobicContact CG-CD2 4.5Å; M182-F201 HydrophobicContact CG-CE1 4.05Å; M182-F201 HydrophobicContact CG-CE2 4.16Å; M182-F201 HydrophobicContact CG-CZ 3.91Å
183	A	85.3	Confident	85.9	Confident	50 Å²	50	67.8 Å²	67.8	41%	0.413	31%	0.306	S	S	.	.	H	α-helix	trans	-64.3	-34.7	-175.9	0	0	0	0	0	112.5	R187	A183-R187 VanDerWaalsContact O-CG 3.25Å; A183-R187 WeakPolarHBondContact O-CG 3.46Å; A183-R187 PolarHBondContact O-N 2.83Å
184	S	88.6	Confident	85.7	Confident	54 Å²	54	77.4 Å²	77.4	38%	0.378	34%	0.341	S	S	.	.	H	α-helix	trans	-70.1	-37.8	174.5	45.9	0	0	0	0	112.7	R181 M182 L188	R181-S184 PolarHBondContact O-N 2.99Å; R181-S184 PolarHBondContact O-OG 2.98Å; M182-S184 VanDerWaalsContact C-N 3.3Å; M182-S184 PolarHBondContact O-N 3.33Å; S184-L188 PolarHBondContact O-N 3.25Å; S184-L188 VanDerWaalsContact O-N 3.12Å
185	F	88.8	Confident	85.2	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-65.1	-48.6	179.7	179.7	-100.3	0	0	0	111.3	I177 R181 M182 R187 L188 L189 L199 F201 F222 I224 I238 F242	I177-F185 HydrophobicContact CD1-CB 3.71Å; I177-F185 HydrophobicContact CD1-CD1 4.27Å; I177-F185 HydrophobicContact CD1-CD2 3.78Å; I177-F185 HydrophobicContact CD1-CE2 4.47Å; I177-F185 HydrophobicContact CD1-CG 3.67Å; R181-F185 WeakPolarHBondContact O-CB 3.32Å; R181-F185 PolarHBondContact O-N 2.85Å; M182-F185 WeakPolarHBondContact O-CB 3.45Å; M182-F185 PolarHBondContact O-N 3.23Å; M182-F185 VanDerWaalsContact O-N 3.11Å; F185-R187 PolarHBondContact O-N 2.98Å; F185-L188 PolarHBondContact O-N 3.34Å; F185-L189 WeakPolarHBondContact O-CB 3.47Å; F185-L189 PolarHBondContact O-N 3.17Å; F185-L199 HydrophobicContact CE1-CD1 4.29Å; F185-F201 HydrophobicContact CD1-CE1 4.4Å; F185-F201 HydrophobicContact CD1-CZ 4.15Å; F185-F222 HydrophobicContact CE1-CD2 4.35Å; F185-F222 HydrophobicContact CE1-CE2 4.47Å; F185-F222 HydrophobicContact CE1-CG 4.4Å; F185-F222 HydrophobicContact CZ-CE2 4.21Å; F185-F222 HydrophobicContact CZ-CZ 4.25Å; F185-I224 HydrophobicContact CE1-CD1 4.05Å; F185-I224 HydrophobicContact CZ-CD1 3.93Å; F185-I238 HydrophobicContact CD2-CG2 4.16Å; F185-I238 HydrophobicContact CE2-CG2 3.8Å; F185-F242 HydrophobicContact CD2-CB 4.1Å; F185-F242 AromaticContact CD2-CD2 3.54Å; F185-F242 HydrophobicContact CD2-CD2 3.54Å; F185-F242 HydrophobicContact CD2-CE2 4.04Å; F185-F242 AromaticContact CD2-CG 3.89Å; F185-F242 HydrophobicContact CD2-CG 3.89Å; F185-F242 HydrophobicContact CE2-CD2 4.25Å
186	E	86.4	Confident	84.8	Confident	101 Å²	101	84.3 Å²	84.3	47%	0.472	38%	0.384	S	S	.	.	H	α-helix	trans	-59.3	-48	177.8	179.3	177.9	-172.7	0	0	112.1	M182 L188 L189 W190 L199 F201	M182-E186 PolarHBondContact O-N 3.34Å; E186-L188 VanDerWaalsContact C-N 3.32Å; E186-L188 PolarHBondContact O-N 2.95Å; E186-L189 PolarHBondContact O-N 3.01Å; E186-W190 WeakPolarHBondContact O-CB 3.37Å; E186-W190 PolarHBondContact O-N 3.21Å; E186-L199 HydrophobicContact CB-CD2 3.98Å; E186-L199 HydrophobicContact CG-CD2 3.9Å; E186-F201 HydrophobicContact CB-CE2 4.25Å; E186-F201 HydrophobicContact CB-CZ 4.41Å
187	R	86.4	Confident	84.5	Confident	178 Å²	178	85 Å²	85	67%	0.672	39%	0.388	S	S	*	.	H	α-helix	trans	-61.2	-39.4	179	-70.7	175.7	-163.8	173.8	5.9	112.3	A183 F185 R191	A183-R187 VanDerWaalsContact O-CG 3.25Å; A183-R187 WeakPolarHBondContact O-CG 3.46Å; A183-R187 PolarHBondContact O-N 2.83Å; F185-R187 PolarHBondContact O-N 2.98Å; R187-R191 WeakPolarHBondContact O-CB 3.22Å; R187-R191 WeakPolarHBondContact O-CG 3.36Å; R187-R191 PolarHBondContact O-N 3.37Å; R187-R191 VanDerWaalsContact O-N 3.09Å
188	L	87.8	Confident	84.3	Confident	60 Å²	60	91.2 Å²	91.2	31%	0.314	41%	0.412	S	S	.	.	H	α-helix	trans	-70.4	-43.1	178.6	-166	75.4	0	0	0	111.2	S184 F185 E186 W190 R191 I192 I238 F242	S184-L188 PolarHBondContact O-N 3.25Å; S184-L188 VanDerWaalsContact O-N 3.12Å; F185-L188 PolarHBondContact O-N 3.34Å; E186-L188 VanDerWaalsContact C-N 3.32Å; E186-L188 PolarHBondContact O-N 2.95Å; L188-W190 VanDerWaalsContact C-N 3.32Å; L188-W190 PolarHBondContact O-N 2.79Å; L188-R191 PolarHBondContact O-N 2.83Å; L188-I192 HydrophobicContact CD1-CD1 4.15Å; L188-I192 HydrophobicContact CD2-CD1 4.1Å; L188-I192 HydrophobicContact CG-CD1 3.78Å; L188-I192 HydrophobicContact CG-CG1 4.47Å; L188-I192 WeakPolarHBondContact O-CG1 3.49Å; L188-I192 PolarHBondContact O-N 2.76Å; L188-I238 HydrophobicContact CD2-CG2 4.14Å; L188-F242 HydrophobicContact CB-CE2 4.06Å; L188-F242 HydrophobicContact CB-CZ 4.2Å; L188-F242 HydrophobicContact CD2-CE2 3.46Å; L188-F242 VanDerWaalsContact CD2-CE2 3.46Å; L188-F242 HydrophobicContact CD2-CZ 4.01Å; L188-F242 HydrophobicContact CG-CE2 4.38Å
189	L	86.4	Confident	84.2	Confident	6 Å²	6	90.2 Å²	90.2	3%	0.031	41%	0.407	C	S	.	.	H	α-helix	trans	-59.2	-45.6	177.4	-165.3	73.4	0	0	0	110.7	F185 E186 C193 V197 L199 I224 I235 I238	F185-L189 WeakPolarHBondContact O-CB 3.47Å; F185-L189 PolarHBondContact O-N 3.17Å; E186-L189 PolarHBondContact O-N 3.01Å; L189-C193 VanDerWaalsContact O-CB 3.24Å; L189-C193 WeakPolarHBondContact O-CB 3.34Å; L189-C193 PolarHBondContact O-N 3.45Å; L189-C193 PolarHBondContact O-SG 2.88Å; L189-V197 HydrophobicContact CD2-CG1 3.95Å; L189-V197 HydrophobicContact CG-CG1 4.4Å; L189-L199 HydrophobicContact CD2-CB 4.19Å; L189-L199 HydrophobicContact CD2-CD1 4.13Å; L189-L199 HydrophobicContact CD2-CD2 3.98Å; L189-L199 HydrophobicContact CD2-CG 4.35Å; L189-I224 HydrophobicContact CD1-CD1 4.46Å; L189-I224 HydrophobicContact CD2-CD1 3.92Å; L189-I224 HydrophobicContact CD2-CG1 4.12Å; L189-I224 HydrophobicContact CD2-CG2 4.43Å; L189-I235 HydrophobicContact CD1-CG1 4.08Å; L189-I235 HydrophobicContact CD1-CG2 4.44Å; L189-I238 HydrophobicContact CD1-CD1 4.12Å
190	W	84.6	Confident	84.2	Confident	168 Å²	168	88.9 Å²	88.9	64%	0.636	40%	0.404	S	S	*	.	H	α-helix	trans	-60.3	-46.9	176.6	-172.7	-100.6	0	0	0	112.4	E186 L188 I192 R194 G195	E186-W190 WeakPolarHBondContact O-CB 3.37Å; E186-W190 PolarHBondContact O-N 3.21Å; L188-W190 VanDerWaalsContact C-N 3.32Å; L188-W190 PolarHBondContact O-N 2.79Å; W190-I192 PolarHBondContact O-N 2.93Å; W190-R194 WeakPolarHBondContact O-CA 3.34Å; W190-R194 PolarHBondContact O-N 3.16Å; W190-G195 PolarHBondContact O-N 3.37Å
191	R	85.4	Confident	84.1	Confident	199 Å²	199	82.5 Å²	82.5	75%	0.751	37%	0.374	S	S	*	.	H	α-helix	trans	-63.9	-41.7	-178.8	-75.7	175.5	71.7	-175.3	3.2	113	R187 L188	R187-R191 WeakPolarHBondContact O-CB 3.22Å; R187-R191 WeakPolarHBondContact O-CG 3.36Å; R187-R191 PolarHBondContact O-N 3.37Å; R187-R191 VanDerWaalsContact O-N 3.09Å; L188-R191 PolarHBondContact O-N 2.83Å
192	I	85	Confident	84	Confident	77 Å²	77	79.5 Å²	79.5	40%	0.395	37%	0.368	S	S	.	.	H	α-helix	trans	-78.9	-39.4	-176.6	-66.2	173.6	0	0	0	111.1	L188 W190 R194 I238	L188-I192 HydrophobicContact CD1-CD1 4.15Å; L188-I192 HydrophobicContact CD2-CD1 4.1Å; L188-I192 HydrophobicContact CG-CD1 3.78Å; L188-I192 HydrophobicContact CG-CG1 4.47Å; L188-I192 WeakPolarHBondContact O-CG1 3.49Å; L188-I192 PolarHBondContact O-N 2.76Å; W190-I192 PolarHBondContact O-N 2.93Å; I192-R194 VanDerWaalsContact C-N 3.32Å; I192-I238 HydrophobicContact CB-CD1 4.29Å; I192-I238 HydrophobicContact CD1-CD1 3.7Å; I192-I238 HydrophobicContact CD1-CG1 4.07Å; I192-I238 HydrophobicContact CG2-CD1 4.27Å
193	C	79.5	Confident	83.8	Confident	6 Å²	6	81.9 Å²	81.9	4%	0.041	38%	0.379	C	S	.	.	H	α-helix	trans	-88.6	0.4	-176.4	-54.8	0	0	0	0	113.4	L189 G195 N196 V197 L231	L189-C193 VanDerWaalsContact O-CB 3.24Å; L189-C193 WeakPolarHBondContact O-CB 3.34Å; L189-C193 PolarHBondContact O-N 3.45Å; L189-C193 PolarHBondContact O-SG 2.88Å; C193-G195 PolarHBondContact O-N 3.21Å; C193-G195 VanDerWaalsContact O-N 3.12Å; C193-N196 WeakPolarHBondContact O-CB 2.86Å; C193-N196 PolarHBondContact O-N 3.25Å; C193-V197 HydrophobicContact CB-CB 4.12Å; C193-V197 HydrophobicContact CB-CG2 3.56Å; C193-L231 HydrophobicContact CB-CD2 4.13Å
194	R	81.1	Confident	83.3	Confident	220 Å²	220	80.1 Å²	80.1	83%	0.83	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	33.7	179.2	-60.9	-173.3	176.2	-172.3	-1.2	113.5	W190 I192	W190-R194 WeakPolarHBondContact O-CA 3.34Å; W190-R194 PolarHBondContact O-N 3.16Å; I192-R194 VanDerWaalsContact C-N 3.32Å
195	G	75.6	Confident	82.3	Confident	25 Å²	25	84 Å²	84	26%	0.258	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	4	-179.2	0	0	0	0	0	116.3	W190 C193 V197	W190-G195 PolarHBondContact O-N 3.37Å; C193-G195 PolarHBondContact O-N 3.21Å; C193-G195 VanDerWaalsContact O-N 3.12Å; G195-V197 PolarHBondContact O-N 3.08Å; G195-V197 VanDerWaalsContact O-N 3.17Å
196	N	80.6	Confident	81.4	Confident	122 Å²	122	85.3 Å²	85.3	65%	0.652	39%	0.389	S	S	*	.			trans	-83.7	20	-177.8	-64.8	-4	0	0	0	114.1	C193	C193-N196 WeakPolarHBondContact O-CB 2.86Å; C193-N196 PolarHBondContact O-N 3.25Å
197	V	81.6	Confident	80.6	Confident	16 Å²	16	83.4 Å²	83.4	10%	0.097	39%	0.386	C	S	.	.			trans	-135.4	129.5	-173.6	169.8	0	0	0	0	108.8	L189 C193 G195 I224 L231 I235	L189-V197 HydrophobicContact CD2-CG1 3.95Å; L189-V197 HydrophobicContact CG-CG1 4.4Å; C193-V197 HydrophobicContact CB-CB 4.12Å; C193-V197 HydrophobicContact CB-CG2 3.56Å; G195-V197 PolarHBondContact O-N 3.08Å; G195-V197 VanDerWaalsContact O-N 3.17Å; V197-I224 HydrophobicContact CG1-CG2 3.27Å; V197-L231 HydrophobicContact CG2-CD2 4.19Å; V197-I235 HydrophobicContact CG2-CD1 4.24Å
198	Y	84.3	Confident	79.8	Confident	135 Å²	135	75.8 Å²	75.8	53%	0.529	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.1	175.4	-171.3	-105.8	0	0	0	109.2	K200 I224 F225	Y198-K200 HydrophobicContact CE1-CB 4.49Å; Y198-I224 WeakPolarHBondContact O-CA 3.39Å; Y198-F225 AromaticContact CD1-CD2 3.81Å; Y198-F225 HydrophobicContact CD1-CD2 3.81Å; Y198-F225 HydrophobicContact CD1-CE2 4.33Å; Y198-F225 PolarHBondContact N-O 3.07Å; Y198-F225 PolarHBondContact O-N 3.25Å
199	L	84.2	Confident	79	Confident	36 Å²	36	77.6 Å²	77.6	19%	0.188	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.5	-178.2	174.2	71	0	0	0	108.7	F185 E186 L189 F201 F222 I223 I224	F185-L199 HydrophobicContact CE1-CD1 4.29Å; E186-L199 HydrophobicContact CB-CD2 3.98Å; E186-L199 HydrophobicContact CG-CD2 3.9Å; L189-L199 HydrophobicContact CD2-CB 4.19Å; L189-L199 HydrophobicContact CD2-CD1 4.13Å; L189-L199 HydrophobicContact CD2-CD2 3.98Å; L189-L199 HydrophobicContact CD2-CG 4.35Å; L199-F201 HydrophobicContact CD1-CE1 4.3Å; L199-F201 HydrophobicContact CD1-CE2 4.32Å; L199-F201 HydrophobicContact CD1-CZ 4.06Å; L199-F201 HydrophobicContact CD2-CD2 4.29Å; L199-F201 HydrophobicContact CD2-CE1 4.46Å; L199-F201 HydrophobicContact CD2-CE2 3.35Å; L199-F201 HydrophobicContact CD2-CZ 3.47Å; L199-F201 VanDerWaalsContact CD2-CZ 3.47Å; L199-F201 HydrophobicContact CG-CD2 4.25Å; L199-F201 HydrophobicContact CG-CE2 3.75Å; L199-F201 HydrophobicContact CG-CZ 3.96Å; L199-F222 HydrophobicContact CD1-CB 4.02Å; L199-F222 HydrophobicContact CD1-CD2 4.48Å; L199-I223 WeakPolarHBondContact CA-O 3.29Å; L199-I224 HydrophobicContact CD1-CD1 4.08Å; L199-I224 HydrophobicContact CD1-CG1 3.4Å
200	K	83.1	Confident	78.1	Confident	84 Å²	84	79.6 Å²	79.6	37%	0.365	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.2	172.8	-165.2	170.1	-176.1	169.2	0	109.7	F137 Y198 F222 I223	F137-K200 HydrophobicContact CD2-CD 3.66Å; F137-K200 HydrophobicContact CE2-CD 3.38Å; F137-K200 HydrophobicContact CZ-CD 4.35Å; Y198-K200 HydrophobicContact CE1-CB 4.49Å; K200-F222 CarbonylContact O-C 3.45Å; K200-F222 WeakPolarHBondContact O-CA 3.33Å; K200-I223 PolarHBondContact N-O 3.28Å; K200-I223 PolarHBondContact O-N 2.77Å
201	F	84.2	Confident	77.2	Confident	45 Å²	45	73.2 Å²	73.2	20%	0.197	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	146.4	174.5	-65.7	-78.3	0	0	0	110.7	I177 M182 F185 E186 L199 I221 F222	I177-F201 HydrophobicContact CG2-CE1 4.41Å; M182-F201 HydrophobicContact CE-CB 3.39Å; M182-F201 HydrophobicContact CE-CD1 3.78Å; M182-F201 HydrophobicContact CE-CD2 3.43Å; M182-F201 VanDerWaalsContact CE-CD2 3.43Å; M182-F201 HydrophobicContact CE-CE1 4.34Å; M182-F201 HydrophobicContact CE-CE2 4.02Å; M182-F201 HydrophobicContact CE-CG 3.26Å; M182-F201 HydrophobicContact CE-CZ 4.42Å; M182-F201 HydrophobicContact CG-CD1 4.37Å; M182-F201 HydrophobicContact CG-CD2 4.5Å; M182-F201 HydrophobicContact CG-CE1 4.05Å; M182-F201 HydrophobicContact CG-CE2 4.16Å; M182-F201 HydrophobicContact CG-CZ 3.91Å; F185-F201 HydrophobicContact CD1-CE1 4.4Å; F185-F201 HydrophobicContact CD1-CZ 4.15Å; E186-F201 HydrophobicContact CB-CE2 4.25Å; E186-F201 HydrophobicContact CB-CZ 4.41Å; L199-F201 HydrophobicContact CD1-CE1 4.3Å; L199-F201 HydrophobicContact CD1-CE2 4.32Å; L199-F201 HydrophobicContact CD1-CZ 4.06Å; L199-F201 HydrophobicContact CD2-CD2 4.29Å; L199-F201 HydrophobicContact CD2-CE1 4.46Å; L199-F201 HydrophobicContact CD2-CE2 3.35Å; L199-F201 HydrophobicContact CD2-CZ 3.47Å; L199-F201 VanDerWaalsContact CD2-CZ 3.47Å; L199-F201 HydrophobicContact CG-CD2 4.25Å; L199-F201 HydrophobicContact CG-CE2 3.75Å; L199-F201 HydrophobicContact CG-CZ 3.96Å; F201-I221 CarbonylContact C-O 3.57Å; F201-I221 VanDerWaalsContact CA-O 3.3Å; F201-I221 WeakPolarHBondContact CA-O 3.27Å; F201-F222 HydrophobicContact CD1-CB 3.55Å; F201-F222 HydrophobicContact CE1-CB 3.6Å; F201-F222 HydrophobicContact CE1-CG 4.46Å
202	S	81.9	Confident	76.1	Confident	40 Å²	40	68.6 Å²	68.6	28%	0.28	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	131.1	169.3	-171.2	0	0	0	0	108.4	I221	S202-I221 PolarHBondContact N-O 3.06Å; S202-I221 PolarHBondContact O-N 3.43Å
203	E	79.5	Confident	75.1	Confident	98 Å²	98	68.4 Å²	68.4	46%	0.458	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	143.9	177.1	-59.9	-167.8	145.4	0	0	110.1	R179	R179-E203 IonicContact CZ-OE1 3.04Å; R179-E203 IonicContact NE-OE1 3.68Å; R179-E203 IonicContact NH2-OE1 3.6Å; R179-E203 PolarHBondContact NH2-OE1 3.18Å; R179-E203 IonicContact NH2-OE2 3.4Å
204	M	75.4	Confident	74.5	Confident	13 Å²	13	74.3 Å²	74.3	6%	0.064	38%	0.377	C	S	.	.			trans	-98	119.3	171.7	-167.8	167.5	62.9	0	0	108.4	Y129 A206 L208 K219	Y129-M204 HydrophobicContact CD1-CG 4.29Å; Y129-M204 HydrophobicContact CD2-CG 4.25Å; Y129-M204 HydrophobicContact CD2-SD 3.71Å; Y129-M204 HydrophobicContact CE2-SD 4.41Å; Y129-M204 HydrophobicContact CG-CG 4.07Å; Y129-M204 HydrophobicContact CG-SD 3.86Å; M204-A206 VanDerWaalsContact C-N 3.27Å; M204-A206 PolarHBondContact O-N 3.48Å; M204-L208 HydrophobicContact CE-CD1 3.45Å; M204-L208 VanDerWaalsContact CE-CD1 3.45Å; M204-L208 HydrophobicContact CE-CG 3.76Å; M204-L208 HydrophobicContact SD-CD1 4.34Å; M204-K219 WeakPolarHBondContact CB-O 3.47Å; M204-K219 HydrophobicContact CE-CB 3.93Å
205	D	66.2	Low	74.1	Confident	134 Å²	134	69.9 Å²	69.9	72%	0.717	37%	0.366	S	S	*	.	S	Bend	trans	-74.3	-15.4	-172.2	-55.6	-54.5	0	0	0	113.4	K133	K133-D205 IonicContact NZ-OD2 3.37Å
206	A	69.5	Low	74.1	Confident	28 Å²	28	76.1 Å²	76.1	23%	0.231	39%	0.389	C	S	.	.	S	Bend	trans	-103.3	122	179.8	0	0	0	0	0	111.3	M204	M204-A206 VanDerWaalsContact C-N 3.27Å; M204-A206 PolarHBondContact O-N 3.48Å
207	P	70.9	Confident	73.8	Confident	61 Å²	61	72 Å²	72	40%	0.396	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-66.2	137.2	169.6	27.8	-31.6	0	0	0	109.8	E216	P207-E216 HydrophobicContact CB-CB 4.14Å
208	L	69.3	Low	73.8	Confident	19 Å²	19	75.9 Å²	75.9	10%	0.099	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	134.6	174.9	-66.3	174.4	0	0	0	109.1	L122 T125 E126 M204 I217	L122-L208 HydrophobicContact CD1-CB 4.41Å; L122-L208 HydrophobicContact CG-CD1 4.32Å; T125-L208 HydrophobicContact CG2-CD2 3.75Å; E126-L208 HydrophobicContact CG-CD1 3.85Å; M204-L208 HydrophobicContact CE-CD1 3.45Å; M204-L208 VanDerWaalsContact CE-CD1 3.45Å; M204-L208 HydrophobicContact CE-CG 3.76Å; M204-L208 HydrophobicContact SD-CD1 4.34Å; L208-I217 PolarHBondContact N-O 3.28Å; L208-I217 VanDerWaalsContact N-O 3.14Å; L208-I217 PolarHBondContact O-N 2.97Å
209	E	70.1	Confident	73.8	Confident	98 Å²	98	70.8 Å²	70.8	46%	0.458	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.4	173.6	-169.5	-172	169.2	0	0	109.8	L122 K214 E215	L122-E209 WeakPolarHBondContact CD1-O 3.41Å; E209-K214 HydrophobicContact CG-CB 4.49Å; E209-K214 WeakPolarHBondContact OE1-CA 3.23Å; E209-K214 WeakPolarHBondContact OE1-CB 3.32Å; E209-K214 WeakPolarHBondContact OE1-CG 3.47Å; E209-E215 WeakPolarHBondContact CA-O 3.38Å
210	D	68.6	Low	73.9	Confident	48 Å²	48	69.2 Å²	69.2	26%	0.257	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-70.8	130.3	173.4	-164.9	-45	0	0	0	110.3	V212 T213 K214 E215 I217	D210-V212 PolarHBondContact O-N 3.47Å; D210-V212 PolarHBondContact OD1-N 3.45Å; D210-V212 VanDerWaalsContact OD1-N 3.12Å; D210-T213 WeakPolarHBondContact CB-OG1 3.32Å; D210-K214 PolarHBondContact O-N 3.44Å; D210-E215 PolarHBondContact N-O 3.48Å; D210-E215 VanDerWaalsContact N-O 3.1Å; D210-I217 HydrophobicContact CB-CD1 3.77Å; D210-I217 HydrophobicContact CB-CG1 4.47Å
211	P	64.3	Low	74.1	Confident	34 Å²	34	65.3 Å²	65.3	22%	0.221	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.1	-179.4	23.5	-36.5	0	0	0	115	K118 K119	K118-P211 HydrophobicContact CB-CB 4Å; K119-P211 HydrophobicContact CB-CG 4.37Å
212	V	64.1	Low	74.3	Confident	101 Å²	101	63.2 Å²	63.2	61%	0.612	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-41.9	-176.5	-170.1	0	0	0	0	112.8	D210	D210-V212 PolarHBondContact O-N 3.47Å; D210-V212 PolarHBondContact OD1-N 3.45Å; D210-V212 VanDerWaalsContact OD1-N 3.12Å
213	T	63.7	Low	74.5	Confident	73 Å²	73	61.8 Å²	61.8	45%	0.448	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-12.4	-174.6	60.1	0	0	0	0	113.5	D210 E215	D210-T213 WeakPolarHBondContact CB-OG1 3.32Å; T213-E215 PolarHBondContact O-N 3.38Å; T213-E215 VanDerWaalsContact O-N 3.1Å
214	K	65.7	Low	74.8	Confident	130 Å²	130	57.1 Å²	57.1	57%	0.565	30%	0.297	S	S	*	.			trans	55.1	18.7	-171.6	-58.3	-176.2	-179.9	176.3	0	113.5	E209 D210	E209-K214 HydrophobicContact CG-CB 4.49Å; E209-K214 WeakPolarHBondContact OE1-CA 3.23Å; E209-K214 WeakPolarHBondContact OE1-CB 3.32Å; E209-K214 WeakPolarHBondContact OE1-CG 3.47Å; D210-K214 PolarHBondContact O-N 3.44Å
215	E	72.8	Confident	75.3	Confident	128 Å²	128	58.1 Å²	58.1	60%	0.598	30%	0.301	S	S	*	.			trans	-88.1	141.4	178	-70.3	-178.9	163.2	0	0	110.3	E209 D210 T213 I217	E209-E215 WeakPolarHBondContact CA-O 3.38Å; D210-E215 PolarHBondContact N-O 3.48Å; D210-E215 VanDerWaalsContact N-O 3.1Å; T213-E215 PolarHBondContact O-N 3.38Å; T213-E215 VanDerWaalsContact O-N 3.1Å; E215-I217 PolarHBondContact O-N 3.15Å
216	E	75.4	Confident	76.3	Confident	156 Å²	156	52.5 Å²	52.5	73%	0.729	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	107.1	173.9	-69.5	-174.4	178.1	0	0	110.1	P207	P207-E216 HydrophobicContact CB-CB 4.14Å
217	I	75.9	Confident	76.9	Confident	35 Å²	35	56.7 Å²	56.7	18%	0.179	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.1	178.6	-54.5	179.7	0	0	0	109.4	L208 D210 E215 K219	L208-I217 PolarHBondContact N-O 3.28Å; L208-I217 VanDerWaalsContact N-O 3.14Å; L208-I217 PolarHBondContact O-N 2.97Å; D210-I217 HydrophobicContact CB-CD1 3.77Å; D210-I217 HydrophobicContact CB-CG1 4.47Å; E215-I217 PolarHBondContact O-N 3.15Å; I217-K219 HydrophobicContact CG2-CG 3.96Å
218	Q	80.8	Confident	77.5	Confident	98 Å²	98	56 Å²	56	46%	0.458	29%	0.289	S	S	.	.			trans	-84	121.6	167.9	-66.4	-175.9	-3.9	0	0	110.3	R179	R179-Q218 PolarHBondContact N-O 3.23Å
219	K	84.7	Confident	78	Confident	27 Å²	27	61.8 Å²	61.8	12%	0.117	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	149	176.6	-57.6	-171.7	-178.4	179.7	0	110.8	E126 V176 I177 N178 M204 I217	E126-K219 WeakPolarHBondContact OE1-CD 3.48Å; E126-K219 WeakPolarHBondContact OE1-CE 3.47Å; E126-K219 IonicContact OE1-NZ 3.42Å; E126-K219 PolarHBondContact OE1-NZ 2.91Å; V176-K219 HydrophobicContact CG1-CB 3.53Å; V176-K219 HydrophobicContact CG1-CD 3.8Å; V176-K219 HydrophobicContact CG1-CG 4.28Å; I177-K219 CarbonylContact O-C 3.5Å; I177-K219 WeakPolarHBondContact O-CA 3.42Å; N178-K219 WeakPolarHBondContact OD1-CE 3.37Å; M204-K219 WeakPolarHBondContact CB-O 3.47Å; M204-K219 HydrophobicContact CE-CB 3.93Å; I217-K219 HydrophobicContact CG2-CG 3.96Å
220	N	85.7	Confident	78.7	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.7	175.9	-71.7	-4.9	0	0	0	109.9	V176 I177	V176-N220 WeakPolarHBondContact CA-O 3.5Å; I177-N220 PolarHBondContact N-O 2.82Å; I177-N220 PolarHBondContact O-N 3.43Å
221	I	86.9	Confident	79.3	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	138.9	172.9	-68.4	157.5	0	0	0	108.3	L130 K133 G175 V176 F201 S202	L130-I221 HydrophobicContact CD1-CB 4.43Å; L130-I221 HydrophobicContact CD1-CG1 4.24Å; L130-I221 HydrophobicContact CD1-CG2 3.56Å; L130-I221 HydrophobicContact CG-CG2 4.43Å; K133-I221 HydrophobicContact CB-CD1 4.29Å; K133-I221 HydrophobicContact CG-CD1 4.04Å; G175-I221 WeakPolarHBondContact O-CA 3.22Å; V176-I221 HydrophobicContact CG2-CG1 4.16Å; F201-I221 CarbonylContact C-O 3.57Å; F201-I221 VanDerWaalsContact CA-O 3.3Å; F201-I221 WeakPolarHBondContact CA-O 3.27Å; S202-I221 PolarHBondContact N-O 3.06Å; S202-I221 PolarHBondContact O-N 3.43Å
222	F	88.7	Confident	80.3	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.6	170.7	66.3	-93.5	0	0	0	111.1	I173 A174 G175 I177 F185 L199 K200 F201 I224 A244	I173-F222 HydrophobicContact CG2-CE2 4.41Å; A174-F222 WeakPolarHBondContact CA-O 3.17Å; G175-F222 PolarHBondContact N-O 3.14Å; G175-F222 VanDerWaalsContact O-CD1 3.29Å; G175-F222 WeakPolarHBondContact O-CD1 3.33Å; G175-F222 PolarHBondContact O-N 3.41Å; I177-F222 HydrophobicContact CB-CD1 4.06Å; I177-F222 HydrophobicContact CB-CE1 4.04Å; I177-F222 HydrophobicContact CG2-CD1 3.82Å; I177-F222 HydrophobicContact CG2-CE1 4.32Å; F185-F222 HydrophobicContact CE1-CD2 4.35Å; F185-F222 HydrophobicContact CE1-CE2 4.47Å; F185-F222 HydrophobicContact CE1-CG 4.4Å; F185-F222 HydrophobicContact CZ-CE2 4.21Å; F185-F222 HydrophobicContact CZ-CZ 4.25Å; L199-F222 HydrophobicContact CD1-CB 4.02Å; L199-F222 HydrophobicContact CD1-CD2 4.48Å; K200-F222 CarbonylContact O-C 3.45Å; K200-F222 WeakPolarHBondContact O-CA 3.33Å; F201-F222 HydrophobicContact CD1-CB 3.55Å; F201-F222 HydrophobicContact CE1-CB 3.6Å; F201-F222 HydrophobicContact CE1-CG 4.46Å; F222-I224 HydrophobicContact CD2-CD1 3.58Å; F222-I224 HydrophobicContact CD2-CG1 3.78Å; F222-I224 HydrophobicContact CE2-CD1 3.57Å; F222-I224 HydrophobicContact CE2-CG1 4.22Å; F222-A244 HydrophobicContact CE1-CB 3.85Å; F222-A244 HydrophobicContact CZ-CB 4Å
223	I	86.3	Confident	81.3	Confident	11 Å²	11	70 Å²	70	6%	0.056	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.1	172.2	-54.3	171.4	0	0	0	107.2	T134 F172 I173 A174 L199 K200 F225	T134-I223 HydrophobicContact CG2-CD1 4.03Å; F172-I223 HydrophobicContact CB-CG2 4.47Å; F172-I223 HydrophobicContact CD2-CG2 4.25Å; I173-I223 WeakPolarHBondContact O-CA 2.82Å; A174-I223 HydrophobicContact CB-CG1 4.31Å; L199-I223 WeakPolarHBondContact CA-O 3.29Å; K200-I223 PolarHBondContact N-O 3.28Å; K200-I223 PolarHBondContact O-N 2.77Å; I223-F225 HydrophobicContact CB-CE2 4.35Å; I223-F225 HydrophobicContact CG2-CD2 4.19Å; I223-F225 HydrophobicContact CG2-CE1 4.4Å; I223-F225 HydrophobicContact CG2-CE2 3.51Å; I223-F225 HydrophobicContact CG2-CZ 3.62Å
224	I	86.9	Confident	82.4	Confident	0 Å²	0	72 Å²	72	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.3	-178.3	-65.3	167.4	0	0	0	108.8	F172 I173 F185 L189 V197 Y198 L199 F222 Y226 I235	F172-I224 CarbonylContact C-O 3.51Å; F172-I224 WeakPolarHBondContact CA-O 3.43Å; I173-I224 PolarHBondContact N-O 2.89Å; I173-I224 PolarHBondContact O-N 3.42Å; F185-I224 HydrophobicContact CE1-CD1 4.05Å; F185-I224 HydrophobicContact CZ-CD1 3.93Å; L189-I224 HydrophobicContact CD1-CD1 4.46Å; L189-I224 HydrophobicContact CD2-CD1 3.92Å; L189-I224 HydrophobicContact CD2-CG1 4.12Å; L189-I224 HydrophobicContact CD2-CG2 4.43Å; V197-I224 HydrophobicContact CG1-CG2 3.27Å; Y198-I224 WeakPolarHBondContact O-CA 3.39Å; L199-I224 HydrophobicContact CD1-CD1 4.08Å; L199-I224 HydrophobicContact CD1-CG1 3.4Å; F222-I224 HydrophobicContact CD2-CD1 3.58Å; F222-I224 HydrophobicContact CD2-CG1 3.78Å; F222-I224 HydrophobicContact CE2-CD1 3.57Å; F222-I224 HydrophobicContact CE2-CG1 4.22Å; I224-Y226 HydrophobicContact CG2-CD1 4.33Å; I224-I235 HydrophobicContact CD1-CG2 3.78Å; I224-I235 HydrophobicContact CG2-CD1 3.87Å; I224-I235 HydrophobicContact CG2-CG2 4.32Å
225	F	85.5	Confident	83.5	Confident	34 Å²	34	65.8 Å²	65.8	15%	0.149	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.6	171.9	-60.3	-90.1	0	0	0	110	F137 F138 F172 Y198 I223	F137-F225 HydrophobicContact CD1-CZ 4.35Å; F137-F225 AromaticContact CE1-CE2 3.95Å; F137-F225 HydrophobicContact CE1-CE2 3.95Å; F137-F225 AromaticContact CE1-CZ 3.53Å; F137-F225 HydrophobicContact CE1-CZ 3.53Å; F137-F225 HydrophobicContact CZ-CE2 4.1Å; F137-F225 HydrophobicContact CZ-CZ 4.11Å; F138-F225 HydrophobicContact CE1-CE1 4.38Å; F138-F225 AromaticContact CZ-CE1 3.98Å; F138-F225 HydrophobicContact CZ-CE1 3.98Å; F138-F225 HydrophobicContact CZ-CZ 4.15Å; F172-F225 HydrophobicContact CB-CD1 3.64Å; F172-F225 HydrophobicContact CB-CE1 3.72Å; F172-F225 HydrophobicContact CB-CG 4.33Å; F172-F225 HydrophobicContact CB-CZ 4.48Å; F172-F225 HydrophobicContact CG-CE1 4.27Å; Y198-F225 AromaticContact CD1-CD2 3.81Å; Y198-F225 HydrophobicContact CD1-CD2 3.81Å; Y198-F225 HydrophobicContact CD1-CE2 4.33Å; Y198-F225 PolarHBondContact N-O 3.07Å; Y198-F225 PolarHBondContact O-N 3.25Å; I223-F225 HydrophobicContact CB-CE2 4.35Å; I223-F225 HydrophobicContact CG2-CD2 4.19Å; I223-F225 HydrophobicContact CG2-CE1 4.4Å; I223-F225 HydrophobicContact CG2-CE2 3.51Å; I223-F225 HydrophobicContact CG2-CZ 3.62Å
226	Y	85.8	Confident	84.2	Confident	15 Å²	15	65.6 Å²	65.6	6%	0.059	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.3	-179.4	59.9	-88.2	0	0	0	111	G171 I173 I224 G228 R232 I235	G171-Y226 PolarHBondContact N-O 3.21Å; G171-Y226 WeakPolarHBondContact O-CD1 3.38Å; G171-Y226 PolarHBondContact O-N 2.86Å; G171-Y226 VanDerWaalsContact O-O 3.05Å; I173-Y226 HydrophobicContact CB-CE1 4.07Å; I173-Y226 HydrophobicContact CD1-CD1 4.41Å; I173-Y226 HydrophobicContact CD1-CE1 3.54Å; I173-Y226 HydrophobicContact CG1-CE1 3.6Å; I224-Y226 HydrophobicContact CG2-CD1 4.33Å; Y226-G228 WeakPolarHBondContact CD2-O 3.38Å; Y226-R232 HydrophobicContact CD2-CB 4.14Å; Y226-R232 HydrophobicContact CE2-CB 3.44Å; Y226-R232 VanDerWaalsContact CE2-CB 3.44Å; Y226-R232 HydrophobicContact CE2-CG 3.88Å; Y226-R232 WeakPolarHBondContact OH-CD 3.3Å; Y226-R232 WeakPolarHBondContact OH-CG 3.35Å; Y226-I235 HydrophobicContact CD1-CD1 3.71Å; Y226-I235 HydrophobicContact CG-CD1 3.76Å
227	Q	82.9	Confident	84.8	Confident	117 Å²	117	65.5 Å²	65.5	55%	0.547	31%	0.307	S	S	.	.	S	Bend	trans	-114.1	120.3	175.8	-166	177.1	11.4	0	0	109.4	L170 L231	L170-Q227 HydrophobicContact CD2-CB 4.42Å; Q227-L231 VanDerWaalsContact O-CD1 3.3Å; Q227-L231 WeakPolarHBondContact O-CD1 3.38Å
228	G	82.8	Confident	85.3	Confident	46 Å²	46	64.5 Å²	64.5	47%	0.474	30%	0.302	S	S	.	.	S	Bend	trans	96	151.5	176.3	0	0	0	0	0	115.8	Y226 R232	Y226-G228 WeakPolarHBondContact CD2-O 3.38Å; G228-R232 PolarHBondContact O-N 2.87Å
229	E	81.3	Confident	85.6	Confident	141 Å²	141	59.9 Å²	59.9	66%	0.659	28%	0.281	S	S	*	.	H	α-helix	trans	-77.1	-28.7	-169.8	-165.9	171.6	-173.5	0	0	114.1	L231 R232 Q233	E229-L231 VanDerWaalsContact C-N 3.31Å; E229-L231 PolarHBondContact O-N 3.33Å; E229-R232 VanDerWaalsContact O-CB 3.31Å; E229-R232 WeakPolarHBondContact O-CB 3.48Å; E229-R232 PolarHBondContact O-N 2.88Å; E229-Q233 PolarHBondContact O-N 3.27Å
230	Q	83	Confident	85.8	Confident	159 Å²	159	63.1 Å²	63.1	74%	0.743	30%	0.299	S	S	*	.	H	α-helix	trans	-66	-34.7	176.5	-66	-175	-2.9	0	0	112.4	K234	Q230-K234 WeakPolarHBondContact O-CG 3.5Å; Q230-K234 PolarHBondContact O-N 3.28Å
231	L	83.2	Confident	85.8	Confident	41 Å²	41	65.9 Å²	65.9	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-69.6	-41.9	174.4	-87	149.6	0	0	0	110.8	C193 V197 Q227 E229 Q233 K234 I235	C193-L231 HydrophobicContact CB-CD2 4.13Å; V197-L231 HydrophobicContact CG2-CD2 4.19Å; Q227-L231 VanDerWaalsContact O-CD1 3.3Å; Q227-L231 WeakPolarHBondContact O-CD1 3.38Å; E229-L231 VanDerWaalsContact C-N 3.31Å; E229-L231 PolarHBondContact O-N 3.33Å; L231-Q233 VanDerWaalsContact C-N 3.32Å; L231-Q233 PolarHBondContact O-N 3.27Å; L231-K234 PolarHBondContact O-N 3.5Å; L231-K234 VanDerWaalsContact O-N 3.13Å; L231-I235 VanDerWaalsContact O-CG1 3.24Å; L231-I235 WeakPolarHBondContact O-CG1 3.21Å; L231-I235 PolarHBondContact O-N 3.46Å
232	R	84.1	Confident	85.7	Confident	136 Å²	136	67.7 Å²	67.7	51%	0.513	34%	0.337	S	S	.	.	H	α-helix	trans	-50.8	-49.3	173.8	-172.7	179.1	166.7	162.4	-4.7	112.5	I173 Y226 G228 E229 I235 K236	I173-R232 HydrophobicContact CD1-CG 3.96Å; Y226-R232 HydrophobicContact CD2-CB 4.14Å; Y226-R232 HydrophobicContact CE2-CB 3.44Å; Y226-R232 VanDerWaalsContact CE2-CB 3.44Å; Y226-R232 HydrophobicContact CE2-CG 3.88Å; Y226-R232 WeakPolarHBondContact OH-CD 3.3Å; Y226-R232 WeakPolarHBondContact OH-CG 3.35Å; G228-R232 PolarHBondContact O-N 2.87Å; E229-R232 VanDerWaalsContact O-CB 3.31Å; E229-R232 WeakPolarHBondContact O-CB 3.48Å; E229-R232 PolarHBondContact O-N 2.88Å; R232-I235 PolarHBondContact O-N 3.28Å; R232-K236 WeakPolarHBondContact O-CB 3.42Å; R232-K236 PolarHBondContact O-N 2.87Å
233	Q	86.2	Confident	85.5	Confident	118 Å²	118	77.7 Å²	77.7	55%	0.551	37%	0.374	S	S	*	.	H	α-helix	trans	-66.7	-37.1	-178.7	-67.5	-177.5	0.7	0	0	112.3	E229 L231 K237	E229-Q233 PolarHBondContact O-N 3.27Å; L231-Q233 VanDerWaalsContact C-N 3.32Å; L231-Q233 PolarHBondContact O-N 3.27Å; Q233-K237 WeakPolarHBondContact O-CG 3.03Å; Q233-K237 PolarHBondContact O-N 3.46Å; Q233-K237 VanDerWaalsContact O-N 3.15Å
234	K	86.4	Confident	85.4	Confident	114 Å²	114	77.5 Å²	77.5	50%	0.496	38%	0.375	S	S	.	.	H	α-helix	trans	-66.6	-44.2	174.6	-72.1	179	-178.2	177.9	0	111.6	Q230 L231 K237 I238	Q230-K234 WeakPolarHBondContact O-CG 3.5Å; Q230-K234 PolarHBondContact O-N 3.28Å; L231-K234 PolarHBondContact O-N 3.5Å; L231-K234 VanDerWaalsContact O-N 3.13Å; K234-K237 PolarHBondContact O-N 3Å; K234-I238 VanDerWaalsContact O-CG1 3.32Å; K234-I238 WeakPolarHBondContact O-CG1 3.24Å; K234-I238 PolarHBondContact O-N 3.33Å; K234-I238 VanDerWaalsContact O-N 3.07Å
235	I	87.2	Confident	85.3	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-61.8	-46.1	177.4	-65.4	162.5	0	0	0	110	I173 L189 V197 I224 Y226 L231 R232 K237 I238 C239	I173-I235 HydrophobicContact CD1-CB 4.46Å; I173-I235 HydrophobicContact CD1-CG2 4.09Å; L189-I235 HydrophobicContact CD1-CG1 4.08Å; L189-I235 HydrophobicContact CD1-CG2 4.44Å; V197-I235 HydrophobicContact CG2-CD1 4.24Å; I224-I235 HydrophobicContact CD1-CG2 3.78Å; I224-I235 HydrophobicContact CG2-CD1 3.87Å; I224-I235 HydrophobicContact CG2-CG2 4.32Å; Y226-I235 HydrophobicContact CD1-CD1 3.71Å; Y226-I235 HydrophobicContact CG-CD1 3.76Å; L231-I235 VanDerWaalsContact O-CG1 3.24Å; L231-I235 WeakPolarHBondContact O-CG1 3.21Å; L231-I235 PolarHBondContact O-N 3.46Å; R232-I235 PolarHBondContact O-N 3.28Å; I235-K237 VanDerWaalsContact C-N 3.33Å; I235-K237 PolarHBondContact O-N 3.31Å; I235-I238 WeakPolarHBondContact O-CA 3.17Å; I235-I238 WeakPolarHBondContact O-CB 3.43Å; I235-I238 PolarHBondContact O-N 3.02Å; I235-C239 PolarHBondContact O-N 2.86Å; I235-C239 PolarHBondContact O-SG 2.92Å
236	K	87.9	Confident	85.3	Confident	123 Å²	123	81.5 Å²	81.5	54%	0.535	40%	0.402	S	S	.	.	H	α-helix	trans	-57.1	-45	177.1	-169.2	175.4	-179.7	-179.6	0	112.2	R232 I238 C239 D240	R232-K236 WeakPolarHBondContact O-CB 3.42Å; R232-K236 PolarHBondContact O-N 2.87Å; K236-I238 VanDerWaalsContact C-N 3.29Å; K236-I238 PolarHBondContact O-N 3.42Å; K236-C239 WeakPolarHBondContact O-CB 3.23Å; K236-C239 PolarHBondContact O-N 3.27Å; K236-D240 VanDerWaalsContact O-CG 3.24Å; K236-D240 PolarHBondContact O-N 2.88Å
237	K	87.6	Confident	85.3	Confident	155 Å²	155	82.4 Å²	82.4	67%	0.674	41%	0.405	S	S	*	.	H	α-helix	trans	-61.5	-35.1	175	-72.3	178.6	-179.4	-175.9	0	113.1	Q233 K234 I235 G241	Q233-K237 WeakPolarHBondContact O-CG 3.03Å; Q233-K237 PolarHBondContact O-N 3.46Å; Q233-K237 VanDerWaalsContact O-N 3.15Å; K234-K237 PolarHBondContact O-N 3Å; I235-K237 VanDerWaalsContact C-N 3.33Å; I235-K237 PolarHBondContact O-N 3.31Å; K237-G241 PolarHBondContact O-N 2.95Å
238	I	88.4	Confident	85.2	Confident	14 Å²	14	81.8 Å²	81.8	7%	0.072	41%	0.411	C	S	.	.	H	α-helix	trans	-69.6	-44.5	175.6	-65.7	163.5	0	0	0	110.1	F185 L188 L189 I192 K234 I235 K236 D240 G241 F242	F185-I238 HydrophobicContact CD2-CG2 4.16Å; F185-I238 HydrophobicContact CE2-CG2 3.8Å; L188-I238 HydrophobicContact CD2-CG2 4.14Å; L189-I238 HydrophobicContact CD1-CD1 4.12Å; I192-I238 HydrophobicContact CB-CD1 4.29Å; I192-I238 HydrophobicContact CD1-CD1 3.7Å; I192-I238 HydrophobicContact CD1-CG1 4.07Å; I192-I238 HydrophobicContact CG2-CD1 4.27Å; K234-I238 VanDerWaalsContact O-CG1 3.32Å; K234-I238 WeakPolarHBondContact O-CG1 3.24Å; K234-I238 PolarHBondContact O-N 3.33Å; K234-I238 VanDerWaalsContact O-N 3.07Å; I235-I238 WeakPolarHBondContact O-CA 3.17Å; I235-I238 WeakPolarHBondContact O-CB 3.43Å; I235-I238 PolarHBondContact O-N 3.02Å; K236-I238 VanDerWaalsContact C-N 3.29Å; K236-I238 PolarHBondContact O-N 3.42Å; I238-D240 VanDerWaalsContact C-N 3.34Å; I238-D240 PolarHBondContact O-N 3.36Å; I238-G241 PolarHBondContact O-N 3.11Å; I238-F242 HydrophobicContact CG2-CD2 3.88Å; I238-F242 HydrophobicContact CG2-CE2 3.99Å; I238-F242 WeakPolarHBondContact O-CD2 3.28Å; I238-F242 PolarHBondContact O-N 3.07Å
239	C	87.1	Confident	84.9	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-57.4	-47	174.8	-64.4	0	0	0	0	111.3	I235 K236 G241 F242 R243 A244 V246	I235-C239 PolarHBondContact O-N 2.86Å; I235-C239 PolarHBondContact O-SG 2.92Å; K236-C239 WeakPolarHBondContact O-CB 3.23Å; K236-C239 PolarHBondContact O-N 3.27Å; C239-G241 VanDerWaalsContact C-N 3.33Å; C239-G241 PolarHBondContact O-N 3.32Å; C239-F242 PolarHBondContact O-N 3.33Å; C239-R243 PolarHBondContact O-N 3.46Å; C239-R243 VanDerWaalsContact O-N 3.14Å; C239-A244 HydrophobicContact CB-CB 4.18Å; C239-A244 PolarHBondContact O-N 2.92Å; C239-V246 HydrophobicContact CB-CG2 3.77Å
240	D	87.1	Confident	84.8	Confident	96 Å²	96	75.4 Å²	75.4	51%	0.513	37%	0.374	S	S	.	.	H	α-helix	trans	-61.5	-41.1	176.6	-63.8	-24.4	0	0	0	111.4	K236 I238 F242 R243	K236-D240 VanDerWaalsContact O-CG 3.24Å; K236-D240 PolarHBondContact O-N 2.88Å; I238-D240 VanDerWaalsContact C-N 3.34Å; I238-D240 PolarHBondContact O-N 3.36Å; D240-F242 VanDerWaalsContact C-N 3.35Å; D240-F242 PolarHBondContact O-N 2.89Å; D240-R243 PolarHBondContact O-N 2.98Å; D240-R243 VanDerWaalsContact O-N 3.15Å
241	G	86.9	Confident	84.2	Confident	62 Å²	62	72.5 Å²	72.5	64%	0.639	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-33.8	178.6	0	0	0	0	0	114.5	K237 I238 C239	K237-G241 PolarHBondContact O-N 2.95Å; I238-G241 PolarHBondContact O-N 3.11Å; C239-G241 VanDerWaalsContact C-N 3.33Å; C239-G241 PolarHBondContact O-N 3.32Å
242	F	85.3	Confident	84	Confident	40 Å²	40	73.2 Å²	73.2	18%	0.175	37%	0.368	C	S	.	.	H	α-helix	trans	-89.5	-1.7	175.5	-78.4	-81.5	0	0	0	114	I177 R181 F185 L188 I238 C239 D240 A244	I177-F242 HydrophobicContact CD1-CB 4.33Å; R181-F242 PolarHBondContact NH1-O 3.37Å; F185-F242 HydrophobicContact CD2-CB 4.1Å; F185-F242 AromaticContact CD2-CD2 3.54Å; F185-F242 HydrophobicContact CD2-CD2 3.54Å; F185-F242 HydrophobicContact CD2-CE2 4.04Å; F185-F242 AromaticContact CD2-CG 3.89Å; F185-F242 HydrophobicContact CD2-CG 3.89Å; F185-F242 HydrophobicContact CE2-CD2 4.25Å; L188-F242 HydrophobicContact CB-CE2 4.06Å; L188-F242 HydrophobicContact CB-CZ 4.2Å; L188-F242 HydrophobicContact CD2-CE2 3.46Å; L188-F242 VanDerWaalsContact CD2-CE2 3.46Å; L188-F242 HydrophobicContact CD2-CZ 4.01Å; L188-F242 HydrophobicContact CG-CE2 4.38Å; I238-F242 HydrophobicContact CG2-CD2 3.88Å; I238-F242 HydrophobicContact CG2-CE2 3.99Å; I238-F242 WeakPolarHBondContact O-CD2 3.28Å; I238-F242 PolarHBondContact O-N 3.07Å; C239-F242 PolarHBondContact O-N 3.33Å; D240-F242 VanDerWaalsContact C-N 3.35Å; D240-F242 PolarHBondContact O-N 2.89Å; F242-A244 VanDerWaalsContact C-N 3.34Å
243	R	83.8	Confident	83.7	Confident	209 Å²	209	69 Å²	69	79%	0.789	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	39.1	-171.7	-53.2	-177.8	-178.8	-176.7	-2.1	113.1	C239 D240	C239-R243 PolarHBondContact O-N 3.46Å; C239-R243 VanDerWaalsContact O-N 3.14Å; D240-R243 PolarHBondContact O-N 2.98Å; D240-R243 VanDerWaalsContact O-N 3.15Å
244	A	84.1	Confident	83.4	Confident	8 Å²	8	68.6 Å²	68.6	7%	0.066	37%	0.367	C	S	.	.			trans	-80.7	133.8	172	0	0	0	0	0	110.5	V176 I177 F222 C239 F242	V176-A244 WeakPolarHBondContact O-CA 3.46Å; I177-A244 HydrophobicContact CB-CB 4.39Å; I177-A244 HydrophobicContact CG1-CB 4.46Å; F222-A244 HydrophobicContact CE1-CB 3.85Å; F222-A244 HydrophobicContact CZ-CB 4Å; C239-A244 HydrophobicContact CB-CB 4.18Å; C239-A244 PolarHBondContact O-N 2.92Å; F242-A244 VanDerWaalsContact C-N 3.34Å
245	T	84.3	Confident	83.3	Confident	58 Å²	58	68.2 Å²	68.2	36%	0.356	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.7	175.9	45.7	0	0	0	0	109.2	E126 G175 V176	E126-T245 PolarHBondContact OE2-OG1 2.88Å; G175-T245 CarbonylContact C-O 3.48Å; G175-T245 WeakPolarHBondContact CA-O 3.42Å; V176-T245 PolarHBondContact N-O 3.3Å; V176-T245 PolarHBondContact O-N 3.48Å; V176-T245 VanDerWaalsContact O-N 3.16Å
246	V	86.2	Confident	82.9	Confident	59 Å²	59	68.5 Å²	68.5	36%	0.358	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.8	179.5	176.5	0	0	0	0	109.3	I173 C239	I173-V246 HydrophobicContact CG2-CG1 3.73Å; I173-V246 HydrophobicContact CG2-CG2 4.26Å; C239-V246 HydrophobicContact CB-CG2 3.77Å
247	Y	85.5	Confident	82.7	Confident	34 Å²	34	69.4 Å²	69.4	13%	0.133	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143	-179.4	-68.7	-77.2	0	0	0	111.6	E123 E126 L127 L130 A174 V176 C249	E123-Y247 WeakPolarHBondContact CA-OH 3.25Å; E123-Y247 PolarHBondContact O-OH 2.85Å; E126-Y247 HydrophobicContact CB-CE2 3.9Å; E126-Y247 PolarHBondContact OE2-OH 2.84Å; E126-Y247 VanDerWaalsContact OE2-OH 3.13Å; L127-Y247 HydrophobicContact CB-CD1 4.22Å; L127-Y247 HydrophobicContact CB-CE1 4.23Å; L127-Y247 HydrophobicContact CD1-CD1 3.85Å; L127-Y247 HydrophobicContact CD1-CG 3.83Å; L127-Y247 HydrophobicContact CG-CD1 4.48Å; L130-Y247 HydrophobicContact CD2-CD2 4.24Å; L130-Y247 HydrophobicContact CD2-CG 4.37Å; A174-Y247 PolarHBondContact O-N 3.05Å; V176-Y247 HydrophobicContact CG2-CE2 4.27Å; Y247-C249 PolarHBondContact O-N 3.41Å
248	P	81.1	Confident	82.6	Confident	104 Å²	104	68.5 Å²	68.5	68%	0.675	37%	0.366	S	S	*	.			trans	-71.9	115.9	172.2	29.7	-31.6	0	0	0	109.5
249	C	77.1	Confident	82.5	Confident	23 Å²	23	70.4 Å²	70.4	16%	0.155	38%	0.376	C	S	.	.			trans	-110.8	122.3	176.8	-173.5	0	0	0	0	109.7	F172 Y247	F172-C249 HydrophobicContact CE2-CB 3.76Å; F172-C249 HydrophobicContact CZ-CB 4.08Å; Y247-C249 PolarHBondContact O-N 3.41Å
250	P	78.8	Confident	82.5	Confident	31 Å²	31	72.3 Å²	72.3	20%	0.201	39%	0.386	C	S	.	.			trans	-61.1	141.9	173.2	-23.7	34.3	0	0	0	112.5	E255 R256 M259	P250-E255 HydrophobicContact CB-CB 4.07Å; P250-R256 PolarHBondContact O-NH2 2.71Å; P250-M259 HydrophobicContact CG-SD 3.91Å
251	E	69.8	Low	82.6	Confident	97 Å²	97	74.1 Å²	74.1	45%	0.453	39%	0.391	S	S	.	.	S	Bend	trans	-69.1	-46.3	174.8	-64.4	176.9	-178.3	0	0	113.1	K169 F172 R256	K169-E251 WeakPolarHBondContact CE-OE1 3.43Å; K169-E251 WeakPolarHBondContact CE-OE2 3.08Å; K169-E251 IonicContact NZ-OE1 3.37Å; K169-E251 PolarHBondContact NZ-OE1 3.48Å; K169-E251 IonicContact NZ-OE2 2.64Å; K169-E251 PolarHBondContact NZ-OE2 3.43Å; F172-E251 HydrophobicContact CE1-CG 3.94Å; E251-R256 PolarHBondContact O-NH2 3.41Å
252	P	78.9	Confident	82.7	Confident	57 Å²	57	74 Å²	74	37%	0.37	38%	0.38	S	S	.	.	S	Bend	trans	-73.7	136.3	-178.1	28	-32.1	0	0	0	112.1	V254 E255 R256	P252-V254 PolarHBondContact O-N 2.82Å; P252-E255 HydrophobicContact CG-CB 3.94Å; P252-E255 HydrophobicContact CG-CG 3.67Å; P252-E255 WeakPolarHBondContact CG-OE2 3.25Å; P252-E255 PolarHBondContact O-N 2.85Å; P252-R256 PolarHBondContact O-N 3.31Å; P252-R256 VanDerWaalsContact O-N 3.14Å
253	A	77.2	Confident	83	Confident	46 Å²	46	72.4 Å²	72.4	38%	0.38	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-29.8	-178.7	0	0	0	0	0	113.4	R257	A253-R257 PolarHBondContact O-N 3.04Å; A253-R257 VanDerWaalsContact O-N 3.12Å
254	V	81	Confident	83.3	Confident	111 Å²	111	64.5 Å²	64.5	67%	0.673	35%	0.347	S	S	*	.	H	α-helix	trans	-68.9	-49.5	179.7	-176.9	0	0	0	0	111	P252 R256 R257 E258	P252-V254 PolarHBondContact O-N 2.82Å; V254-R256 VanDerWaalsContact C-N 3.3Å; V254-R256 PolarHBondContact O-N 3.49Å; V254-R257 PolarHBondContact O-N 3.49Å; V254-E258 PolarHBondContact O-N 3.29Å; V254-E258 VanDerWaalsContact O-N 3.07Å
255	E	83.5	Confident	83.7	Confident	106 Å²	106	67.7 Å²	67.7	50%	0.495	37%	0.366	S	S	.	.	H	α-helix	trans	-66.6	-32.5	177.4	-61.2	177.5	179.2	0	0	111.7	P250 P252 R257 E258 M259	P250-E255 HydrophobicContact CB-CB 4.07Å; P252-E255 HydrophobicContact CG-CB 3.94Å; P252-E255 HydrophobicContact CG-CG 3.67Å; P252-E255 WeakPolarHBondContact CG-OE2 3.25Å; P252-E255 PolarHBondContact O-N 2.85Å; E255-R257 VanDerWaalsContact C-N 3.33Å; E255-E258 PolarHBondContact O-N 3.44Å; E255-M259 VanDerWaalsContact O-CB 3.32Å; E255-M259 WeakPolarHBondContact O-CB 3.45Å; E255-M259 PolarHBondContact O-N 3.43Å
256	R	80.3	Confident	84	Confident	5 Å²	5	72.3 Å²	72.3	2%	0.019	38%	0.377	C	S	.	.	H	α-helix	trans	-63.7	-40	174.5	-163.5	-175.2	-59.1	144.4	-0.7	111.8	L131 F138 P250 E251 P252 V254 M259 L260	L131-R256 HydrophobicContact CD2-CG 3.65Å; F138-R256 VanDerWaalsContact CD2-NH1 3.28Å; P250-R256 PolarHBondContact O-NH2 2.71Å; E251-R256 PolarHBondContact O-NH2 3.41Å; P252-R256 PolarHBondContact O-N 3.31Å; P252-R256 VanDerWaalsContact O-N 3.14Å; V254-R256 VanDerWaalsContact C-N 3.3Å; V254-R256 PolarHBondContact O-N 3.49Å; R256-M259 PolarHBondContact O-N 3.17Å; R256-L260 WeakPolarHBondContact O-CB 3.38Å; R256-L260 PolarHBondContact O-N 3.36Å
257	R	82.3	Confident	84.2	Confident	142 Å²	142	70.1 Å²	70.1	54%	0.536	36%	0.363	S	S	.	.	H	α-helix	trans	-67.5	-42.7	177.3	-167.9	-179.8	-64.2	154.1	-1	111.4	A253 V254 E255 L260 E261	A253-R257 PolarHBondContact O-N 3.04Å; A253-R257 VanDerWaalsContact O-N 3.12Å; V254-R257 PolarHBondContact O-N 3.49Å; E255-R257 VanDerWaalsContact C-N 3.33Å; R257-L260 WeakPolarHBondContact O-CB 3.41Å; R257-L260 PolarHBondContact O-N 2.96Å; R257-E261 PolarHBondContact O-N 3.1Å
258	E	86.8	Confident	84.5	Confident	136 Å²	136	74.6 Å²	74.6	64%	0.636	39%	0.385	S	S	*	.	H	α-helix	trans	-62.1	-43.7	174.5	-173.2	179.1	-178.4	0	0	111.7	V254 E255 L260 E261 S262	V254-E258 PolarHBondContact O-N 3.29Å; V254-E258 VanDerWaalsContact O-N 3.07Å; E255-E258 PolarHBondContact O-N 3.44Å; E258-L260 PolarHBondContact O-N 2.69Å; E258-E261 PolarHBondContact O-N 3.16Å; E258-S262 WeakPolarHBondContact O-CB 3.45Å; E258-S262 PolarHBondContact O-N 3.08Å
259	M	86.6	Confident	85.1	Confident	54 Å²	54	74.1 Å²	74.1	27%	0.266	38%	0.377	S	S	.	.	H	α-helix	trans	-64.6	-38.7	175.5	-171.7	174.7	178.1	0	0	112.1	L127 L131 P250 E255 R256 S262 V263	L127-M259 HydrophobicContact CD1-CE 4.21Å; L127-M259 HydrophobicContact CD2-CE 3.99Å; L131-M259 HydrophobicContact CD1-CB 4.48Å; L131-M259 HydrophobicContact CD1-CG 4.02Å; L131-M259 HydrophobicContact CD1-SD 4.36Å; L131-M259 HydrophobicContact CD2-SD 4.43Å; P250-M259 HydrophobicContact CG-SD 3.91Å; E255-M259 VanDerWaalsContact O-CB 3.32Å; E255-M259 WeakPolarHBondContact O-CB 3.45Å; E255-M259 PolarHBondContact O-N 3.43Å; R256-M259 PolarHBondContact O-N 3.17Å; M259-S262 PolarHBondContact O-N 2.94Å; M259-V263 HydrophobicContact CG-CG2 4.48Å; M259-V263 WeakPolarHBondContact O-CB 3.38Å; M259-V263 WeakPolarHBondContact O-CG2 3.4Å; M259-V263 PolarHBondContact O-N 3.39Å
260	L	86.3	Confident	85.7	Confident	40 Å²	40	74.4 Å²	74.4	21%	0.209	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-44.3	175.1	-175.1	78.4	0	0	0	111.5	K128 L131 R256 R257 E258 V263 N264	K128-L260 HydrophobicContact CG-CD1 4.3Å; L131-L260 HydrophobicContact CB-CD1 3.77Å; L131-L260 HydrophobicContact CD1-CD1 4.48Å; R256-L260 WeakPolarHBondContact O-CB 3.38Å; R256-L260 PolarHBondContact O-N 3.36Å; R257-L260 WeakPolarHBondContact O-CB 3.41Å; R257-L260 PolarHBondContact O-N 2.96Å; E258-L260 PolarHBondContact O-N 2.69Å; L260-V263 PolarHBondContact O-N 3.05Å; L260-N264 PolarHBondContact O-N 2.94Å; L260-N264 PolarHBondContact O-ND2 2.96Å
261	E	88.4	Confident	86.2	Confident	134 Å²	134	76.5 Å²	76.5	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-64.1	-44.7	177	-168.3	170.5	-175.2	0	0	111.1	R257 E258 V263 N264 V265	R257-E261 PolarHBondContact O-N 3.1Å; E258-E261 PolarHBondContact O-N 3.16Å; E261-V263 PolarHBondContact O-N 3.1Å; E261-N264 PolarHBondContact O-N 3.25Å; E261-V265 WeakPolarHBondContact O-CG2 3.39Å; E261-V265 PolarHBondContact O-N 2.81Å; E261-V265 VanDerWaalsContact O-N 3.08Å
262	S	89.9	Confident	87.3	Confident	59 Å²	59	75.4 Å²	75.4	41%	0.413	39%	0.386	S	S	.	.	H	α-helix	trans	-60.4	-42.6	174.8	-176.7	0	0	0	0	113	E258 M259 V265 R266	E258-S262 WeakPolarHBondContact O-CB 3.45Å; E258-S262 PolarHBondContact O-N 3.08Å; M259-S262 PolarHBondContact O-N 2.94Å; S262-V265 PolarHBondContact O-N 3.14Å; S262-R266 WeakPolarHBondContact O-CG 3.33Å; S262-R266 PolarHBondContact O-N 2.84Å; S262-R266 VanDerWaalsContact O-N 3.15Å
263	V	90.8	Very high	87.9	Confident	7 Å²	7	75.5 Å²	75.5	4%	0.042	39%	0.385	C	S	.	.	H	α-helix	trans	-66.3	-38.4	176.5	169.9	0	0	0	0	110.9	L124 L127 K128 M259 L260 E261 R266 L267	L124-V263 HydrophobicContact CB-CG1 4.49Å; L124-V263 HydrophobicContact CD2-CG1 4.4Å; L127-V263 HydrophobicContact CD2-CG2 3.83Å; L127-V263 HydrophobicContact CG-CG2 4.44Å; K128-V263 HydrophobicContact CB-CG1 4.07Å; M259-V263 HydrophobicContact CG-CG2 4.48Å; M259-V263 WeakPolarHBondContact O-CB 3.38Å; M259-V263 WeakPolarHBondContact O-CG2 3.4Å; M259-V263 PolarHBondContact O-N 3.39Å; L260-V263 PolarHBondContact O-N 3.05Å; E261-V263 PolarHBondContact O-N 3.1Å; V263-R266 PolarHBondContact O-N 3.18Å; V263-L267 VanDerWaalsContact O-CB 3.24Å; V263-L267 WeakPolarHBondContact O-CB 3.41Å; V263-L267 PolarHBondContact O-N 3.48Å
264	N	90.4	Very high	88.4	Confident	43 Å²	43	74.3 Å²	74.3	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-46.2	176.6	-78.7	-38.9	0	0	0	112.1	K128 L260 E261 R266 L267 E268	K128-N264 VanDerWaalsContact CD-OD1 3.23Å; K128-N264 WeakPolarHBondContact CD-OD1 3.21Å; K128-N264 WeakPolarHBondContact CE-OD1 3.41Å; K128-N264 PolarHBondContact NZ-OD1 3.26Å; L260-N264 PolarHBondContact O-N 2.94Å; L260-N264 PolarHBondContact O-ND2 2.96Å; E261-N264 PolarHBondContact O-N 3.25Å; N264-R266 PolarHBondContact O-N 2.89Å; N264-L267 PolarHBondContact O-N 3.38Å; N264-E268 PolarHBondContact O-N 3.33Å
265	V	93	Very high	88.9	Confident	76 Å²	76	72.9 Å²	72.9	46%	0.461	36%	0.364	S	S	.	.	H	α-helix	trans	-59.9	-46.6	177.2	175.5	0	0	0	0	110.8	E261 S262 L267 E268 D269	E261-V265 WeakPolarHBondContact O-CG2 3.39Å; E261-V265 PolarHBondContact O-N 2.81Å; E261-V265 VanDerWaalsContact O-N 3.08Å; S262-V265 PolarHBondContact O-N 3.14Å; V265-L267 VanDerWaalsContact C-N 3.28Å; V265-L267 PolarHBondContact O-N 2.91Å; V265-E268 PolarHBondContact O-N 3.18Å; V265-D269 PolarHBondContact O-N 2.88Å
266	R	90.9	Very high	89.1	Confident	154 Å²	154	74 Å²	74	58%	0.581	37%	0.369	S	S	*	.	H	α-helix	trans	-61.8	-35.5	176.6	-75.7	179.8	168.2	-175.9	-1.6	113.3	S262 V263 N264 L270	S262-R266 WeakPolarHBondContact O-CG 3.33Å; S262-R266 PolarHBondContact O-N 2.84Å; S262-R266 VanDerWaalsContact O-N 3.15Å; V263-R266 PolarHBondContact O-N 3.18Å; N264-R266 PolarHBondContact O-N 2.89Å; R266-L270 WeakPolarHBondContact O-CB 3.38Å; R266-L270 WeakPolarHBondContact O-CG 3.43Å; R266-L270 PolarHBondContact O-N 2.82Å
267	L	90.2	Very high	89.6	Confident	13 Å²	13	75.1 Å²	75.1	7%	0.068	38%	0.376	C	S	.	.	H	α-helix	trans	-70.3	-41.1	179.2	-165	158.7	0	0	0	110.1	F121 K128 V263 N264 V265 L270 I271	F121-L267 HydrophobicContact CD2-CD2 4.4Å; F121-L267 HydrophobicContact CD2-CG 4.2Å; F121-L267 HydrophobicContact CE2-CD1 4.5Å; F121-L267 HydrophobicContact CE2-CD2 3.49Å; F121-L267 VanDerWaalsContact CE2-CD2 3.49Å; F121-L267 HydrophobicContact CE2-CG 3.71Å; F121-L267 HydrophobicContact CZ-CD2 4.1Å; K128-L267 HydrophobicContact CD-CD1 3.85Å; V263-L267 VanDerWaalsContact O-CB 3.24Å; V263-L267 WeakPolarHBondContact O-CB 3.41Å; V263-L267 PolarHBondContact O-N 3.48Å; N264-L267 PolarHBondContact O-N 3.38Å; V265-L267 VanDerWaalsContact C-N 3.28Å; V265-L267 PolarHBondContact O-N 2.91Å; L267-L270 PolarHBondContact O-N 3.4Å; L267-I271 HydrophobicContact CD2-CD1 3.51Å; L267-I271 HydrophobicContact CD2-CG1 4.16Å; L267-I271 VanDerWaalsContact O-CG1 3.3Å; L267-I271 WeakPolarHBondContact O-CG1 3.43Å; L267-I271 PolarHBondContact O-N 2.7Å
268	E	91.3	Very high	89.7	Confident	129 Å²	129	71.9 Å²	71.9	60%	0.603	37%	0.367	S	S	*	.	H	α-helix	trans	-60.7	-47.2	172	-72.4	177.3	-171.9	0	0	111.5	N264 V265 L270 I271 T272	N264-E268 PolarHBondContact O-N 3.33Å; V265-E268 PolarHBondContact O-N 3.18Å; E268-L270 VanDerWaalsContact C-N 3.33Å; E268-L270 PolarHBondContact O-N 3.07Å; E268-I271 PolarHBondContact O-N 3.39Å; E268-T272 WeakPolarHBondContact O-CG2 3.45Å; E268-T272 PolarHBondContact O-N 3.46Å; E268-T272 VanDerWaalsContact O-N 3.08Å
269	D	92.9	Very high	89.8	Confident	94 Å²	94	67.3 Å²	67.3	50%	0.503	35%	0.35	S	S	.	.	H	α-helix	trans	-57	-46.9	175.5	-69.8	-23.4	0	0	0	111.2	V265 I271 T272 V273	V265-D269 PolarHBondContact O-N 2.88Å; D269-I271 PolarHBondContact O-N 2.96Å; D269-T272 PolarHBondContact O-N 2.85Å; D269-T272 VanDerWaalsContact O-N 3.16Å; D269-T272 PolarHBondContact O-OG1 2.93Å; D269-V273 WeakPolarHBondContact O-CG2 3.36Å; D269-V273 PolarHBondContact O-N 2.74Å
270	L	90.1	Very high	89.8	Confident	28 Å²	28	69.4 Å²	69.4	15%	0.147	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-39.1	177.4	-83.2	164.5	0	0	0	112.9	L117 F121 L124 R266 L267 E268 T272 V273 I274	L117-L270 HydrophobicContact CD2-CD2 3.68Å; F121-L270 HydrophobicContact CD2-CB 4.36Å; L124-L270 HydrophobicContact CD1-CD1 3.3Å; R266-L270 WeakPolarHBondContact O-CB 3.38Å; R266-L270 WeakPolarHBondContact O-CG 3.43Å; R266-L270 PolarHBondContact O-N 2.82Å; L267-L270 PolarHBondContact O-N 3.4Å; E268-L270 VanDerWaalsContact C-N 3.33Å; E268-L270 PolarHBondContact O-N 3.07Å; L270-T272 VanDerWaalsContact C-N 3.29Å; L270-T272 PolarHBondContact O-N 3.28Å; L270-V273 PolarHBondContact O-N 2.9Å; L270-I274 WeakPolarHBondContact O-CB 3.38Å; L270-I274 WeakPolarHBondContact O-CG1 3.46Å; L270-I274 PolarHBondContact O-N 3.09Å
271	I	90.3	Very high	89.8	Confident	75 Å²	75	67.9 Å²	67.9	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-59.9	-43.8	175	-70.9	168.3	0	0	0	109.9	F121 L267 E268 D269 V273 I274 T275	F121-I271 HydrophobicContact CD2-CG1 4.31Å; F121-I271 HydrophobicContact CE2-CD1 3.96Å; F121-I271 HydrophobicContact CE2-CG1 3.5Å; F121-I271 HydrophobicContact CZ-CD1 4.37Å; F121-I271 HydrophobicContact CZ-CG1 4.15Å; L267-I271 HydrophobicContact CD2-CD1 3.51Å; L267-I271 HydrophobicContact CD2-CG1 4.16Å; L267-I271 VanDerWaalsContact O-CG1 3.3Å; L267-I271 WeakPolarHBondContact O-CG1 3.43Å; L267-I271 PolarHBondContact O-N 2.7Å; E268-I271 PolarHBondContact O-N 3.39Å; D269-I271 PolarHBondContact O-N 2.96Å; I271-V273 PolarHBondContact O-N 3.24Å; I271-I274 PolarHBondContact O-N 2.89Å; I271-T275 WeakPolarHBondContact O-CB 3.3Å; I271-T275 PolarHBondContact O-N 2.79Å; I271-T275 PolarHBondContact O-OG1 2.85Å
272	T	91.8	Very high	89.6	Confident	75 Å²	75	65 Å²	65	46%	0.46	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-42.5	178.5	69.2	0	0	0	0	111.8	E268 D269 L270 T275 Q276	E268-T272 WeakPolarHBondContact O-CG2 3.45Å; E268-T272 PolarHBondContact O-N 3.46Å; E268-T272 VanDerWaalsContact O-N 3.08Å; D269-T272 PolarHBondContact O-N 2.85Å; D269-T272 VanDerWaalsContact O-N 3.16Å; D269-T272 PolarHBondContact O-OG1 2.93Å; L270-T272 VanDerWaalsContact C-N 3.29Å; L270-T272 PolarHBondContact O-N 3.28Å; T272-T275 PolarHBondContact O-N 2.97Å; T272-Q276 WeakPolarHBondContact O-CB 3.38Å; T272-Q276 VanDerWaalsContact O-CG 3.3Å; T272-Q276 WeakPolarHBondContact O-CG 3.48Å; T272-Q276 PolarHBondContact O-N 3.34Å
273	V	91.7	Very high	89.4	Confident	58 Å²	58	70.1 Å²	70.1	35%	0.352	35%	0.348	S	S	.	.	H	α-helix	trans	-66.5	-42.4	177.6	176.4	0	0	0	0	111.6	L117 D269 L270 I271 T275 Q276 T277	L117-V273 HydrophobicContact CD1-CG1 3.89Å; L117-V273 HydrophobicContact CD2-CG1 4.23Å; D269-V273 WeakPolarHBondContact O-CG2 3.36Å; D269-V273 PolarHBondContact O-N 2.74Å; L270-V273 PolarHBondContact O-N 2.9Å; I271-V273 PolarHBondContact O-N 3.24Å; V273-T275 VanDerWaalsContact C-N 3.34Å; V273-T275 PolarHBondContact O-N 2.71Å; V273-Q276 PolarHBondContact O-N 3.41Å; V273-T277 WeakPolarHBondContact O-CB 3.25Å; V273-T277 PolarHBondContact O-N 3.38Å; V273-T277 PolarHBondContact O-OG1 3.07Å
274	I	88.7	Confident	89.2	Confident	21 Å²	21	70.4 Å²	70.4	11%	0.108	35%	0.349	C	S	.	.	H	α-helix	trans	-60.9	-46	176.1	-71.4	165.8	0	0	0	109.8	L117 F121 L270 I271 Q276 T277 E278	L117-I274 HydrophobicContact CB-CG1 4Å; F121-I274 HydrophobicContact CB-CD1 3.86Å; F121-I274 HydrophobicContact CD2-CD1 4.13Å; F121-I274 HydrophobicContact CG-CD1 4.01Å; L270-I274 WeakPolarHBondContact O-CB 3.38Å; L270-I274 WeakPolarHBondContact O-CG1 3.46Å; L270-I274 PolarHBondContact O-N 3.09Å; I271-I274 PolarHBondContact O-N 2.89Å; I274-Q276 VanDerWaalsContact C-N 3.34Å; I274-Q276 PolarHBondContact O-N 2.89Å; I274-T277 PolarHBondContact O-N 3.22Å; I274-E278 WeakPolarHBondContact O-CB 3.35Å; I274-E278 PolarHBondContact O-N 3.38Å
275	T	89.8	Confident	88.9	Confident	82 Å²	82	68.3 Å²	68.3	50%	0.503	34%	0.338	S	S	.	.	H	α-helix	trans	-62.4	-41.5	178.3	-50.7	0	0	0	0	111.4	I271 T272 V273 S279	I271-T275 WeakPolarHBondContact O-CB 3.3Å; I271-T275 PolarHBondContact O-N 2.79Å; I271-T275 PolarHBondContact O-OG1 2.85Å; T272-T275 PolarHBondContact O-N 2.97Å; V273-T275 VanDerWaalsContact C-N 3.34Å; V273-T275 PolarHBondContact O-N 2.71Å; T275-S279 WeakPolarHBondContact O-CB 3.42Å; T275-S279 PolarHBondContact O-N 3.19Å; T275-S279 PolarHBondContact O-OG 3.42Å
276	Q	89.4	Confident	88.5	Confident	130 Å²	130	70.1 Å²	70.1	61%	0.607	34%	0.341	S	S	*	.	H	α-helix	trans	-64.9	-44.6	175.7	-74.3	177	6	0	0	112	T272 V273 I274 S279 H280	T272-Q276 WeakPolarHBondContact O-CB 3.38Å; T272-Q276 VanDerWaalsContact O-CG 3.3Å; T272-Q276 WeakPolarHBondContact O-CG 3.48Å; T272-Q276 PolarHBondContact O-N 3.34Å; V273-Q276 PolarHBondContact O-N 3.41Å; I274-Q276 VanDerWaalsContact C-N 3.34Å; I274-Q276 PolarHBondContact O-N 2.89Å; Q276-S279 PolarHBondContact O-N 2.79Å; Q276-S279 PolarHBondContact O-OG 2.98Å; Q276-H280 WeakPolarHBondContact O-CB 3.38Å; Q276-H280 PolarHBondContact O-N 3.05Å
277	T	88.8	Confident	88.1	Confident	28 Å²	28	68.7 Å²	68.7	17%	0.172	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-43.9	178.3	-51.8	0	0	0	0	110.8	Q114 V273 I274 H280 R281	Q114-T277 HydrophobicContact CB-CG2 4.46Å; V273-T277 WeakPolarHBondContact O-CB 3.25Å; V273-T277 PolarHBondContact O-N 3.38Å; V273-T277 PolarHBondContact O-OG1 3.07Å; I274-T277 PolarHBondContact O-N 3.22Å; T277-H280 PolarHBondContact O-N 3.17Å; T277-R281 WeakPolarHBondContact O-CB 3.4Å; T277-R281 PolarHBondContact O-N 3.2Å
278	E	85.1	Confident	87.8	Confident	73 Å²	73	68.1 Å²	68.1	34%	0.341	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-43.5	176.2	-170.8	178.2	170	0	0	111.3	I274 H280 R281 Q282	I274-E278 WeakPolarHBondContact O-CB 3.35Å; I274-E278 PolarHBondContact O-N 3.38Å; E278-H280 VanDerWaalsContact C-N 3.28Å; E278-H280 PolarHBondContact O-N 3.12Å; E278-R281 PolarHBondContact O-N 3.21Å; E278-Q282 WeakPolarHBondContact O-CB 3.42Å; E278-Q282 VanDerWaalsContact O-CG 3.31Å; E278-Q282 WeakPolarHBondContact O-CG 2.85Å; E278-Q282 PolarHBondContact O-N 3.37Å; E278-Q282 PolarHBondContact OE1-NE2 3.02Å
279	S	88.3	Confident	87.5	Confident	40 Å²	40	62.5 Å²	62.5	28%	0.28	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-35	175.6	79.1	0	0	0	0	112.6	T275 Q276 R283	T275-S279 WeakPolarHBondContact O-CB 3.42Å; T275-S279 PolarHBondContact O-N 3.19Å; T275-S279 PolarHBondContact O-OG 3.42Å; Q276-S279 PolarHBondContact O-N 2.79Å; Q276-S279 PolarHBondContact O-OG 2.98Å; S279-R283 VanDerWaalsContact O-CG 3.31Å; S279-R283 WeakPolarHBondContact O-CG 3.33Å; S279-R283 PolarHBondContact O-N 3.4Å; S279-R283 VanDerWaalsContact O-N 3.11Å
280	H	87.6	Confident	87	Confident	99 Å²	99	61.5 Å²	61.5	46%	0.458	32%	0.319	S	S	.	.	H	α-helix	trans	-69	-46.6	176.3	-176.7	50.1	0	0	0	111	Q276 T277 E278 Q282 R283 L284	Q276-H280 WeakPolarHBondContact O-CB 3.38Å; Q276-H280 PolarHBondContact O-N 3.05Å; T277-H280 PolarHBondContact O-N 3.17Å; E278-H280 VanDerWaalsContact C-N 3.28Å; E278-H280 PolarHBondContact O-N 3.12Å; H280-Q282 PolarHBondContact O-N 3.06Å; H280-R283 WeakPolarHBondContact O-CB 3.34Å; H280-R283 PolarHBondContact O-N 3.26Å; H280-L284 PolarHBondContact O-N 3.2Å
281	R	85.3	Confident	86.7	Confident	7 Å²	7	63.7 Å²	63.7	3%	0.026	33%	0.331	C	S	.	.	H	α-helix	trans	-59.4	-44.6	175.1	-168.8	-176.8	63.6	79	15.2	111.7	E75 L107 N111 Q114 T277 E278 R283 L284 L285	E75-R281 IonicContact OE1-CZ 3.64Å; E75-R281 IonicContact OE1-NH1 3.64Å; E75-R281 PolarHBondContact OE1-NH1 2.74Å; E75-R281 IonicContact OE1-NH2 3.56Å; E75-R281 PolarHBondContact OE1-NH2 3.01Å; E75-R281 IonicContact OE2-CZ 2.76Å; E75-R281 IonicContact OE2-NH1 2.62Å; E75-R281 PolarHBondContact OE2-NH1 2.92Å; E75-R281 IonicContact OE2-NH2 3.97Å; E75-R281 PolarHBondContact OE2-NH2 3.23Å; L107-R281 HydrophobicContact CD2-CG 4.14Å; N111-R281 WeakPolarHBondContact OD1-CD 3.4Å; Q114-R281 VanDerWaalsContact OE1-NE 3.12Å; T277-R281 WeakPolarHBondContact O-CB 3.4Å; T277-R281 PolarHBondContact O-N 3.2Å; E278-R281 PolarHBondContact O-N 3.21Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.06Å; R281-L284 PolarHBondContact O-N 2.92Å; R281-L285 HydrophobicContact CG-CD1 4.26Å; R281-L285 WeakPolarHBondContact O-CB 3.16Å; R281-L285 WeakPolarHBondContact O-CG 3.42Å; R281-L285 PolarHBondContact O-N 3.26Å
282	Q	84.4	Confident	86.4	Confident	74 Å²	74	60.5 Å²	60.5	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-38.2	175.9	-75.7	177.1	0.9	0	0	112.5	E278 H280 L285 Q286	E278-Q282 WeakPolarHBondContact O-CB 3.42Å; E278-Q282 VanDerWaalsContact O-CG 3.31Å; E278-Q282 WeakPolarHBondContact O-CG 2.85Å; E278-Q282 PolarHBondContact O-N 3.37Å; E278-Q282 PolarHBondContact OE1-NE2 3.02Å; H280-Q282 PolarHBondContact O-N 3.06Å; Q282-L285 PolarHBondContact O-N 3.29Å; Q282-Q286 WeakPolarHBondContact O-CB 3.49Å; Q282-Q286 VanDerWaalsContact O-CG 3.23Å; Q282-Q286 WeakPolarHBondContact O-CG 3.48Å; Q282-Q286 PolarHBondContact O-N 3.37Å
283	R	86.8	Confident	85.9	Confident	167 Å²	167	59.1 Å²	59.1	63%	0.63	30%	0.302	S	S	*	.	H	α-helix	trans	-65.4	-44.7	175	-73.8	172.6	-168.8	166.8	6.5	112	S279 H280 R281 L285 Q286 E287	S279-R283 VanDerWaalsContact O-CG 3.31Å; S279-R283 WeakPolarHBondContact O-CG 3.33Å; S279-R283 PolarHBondContact O-N 3.4Å; S279-R283 VanDerWaalsContact O-N 3.11Å; H280-R283 WeakPolarHBondContact O-CB 3.34Å; H280-R283 PolarHBondContact O-N 3.26Å; R281-R283 VanDerWaalsContact C-N 3.32Å; R281-R283 PolarHBondContact O-N 3.06Å; R283-L285 VanDerWaalsContact C-N 3.33Å; R283-L285 PolarHBondContact O-N 2.89Å; R283-Q286 PolarHBondContact O-N 3.35Å; R283-E287 PolarHBondContact O-N 3.03Å
284	L	85.4	Confident	85.6	Confident	12 Å²	12	58 Å²	58	6%	0.063	30%	0.296	C	S	.	.	H	α-helix	trans	-60.7	-44.1	176.2	-69.4	172.7	0	0	0	111.1	E106 L107 H280 R281 Q286 E287 A288	E106-L284 HydrophobicContact CB-CD1 4.34Å; L107-L284 HydrophobicContact CD2-CB 4.22Å; H280-L284 PolarHBondContact O-N 3.2Å; R281-L284 PolarHBondContact O-N 2.92Å; L284-Q286 PolarHBondContact O-N 2.7Å; L284-E287 PolarHBondContact O-N 2.83Å; L284-A288 WeakPolarHBondContact O-CB 3.31Å; L284-A288 PolarHBondContact O-N 3.45Å
285	L	84.3	Confident	85.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-37.1	176.4	-72.4	173.9	0	0	0	112.5	E71 M72 E75 I76 L107 R281 Q282 R283 A289	E71-L285 HydrophobicContact CB-CD2 4.26Å; M72-L285 HydrophobicContact CG-CD2 4.16Å; E75-L285 WeakPolarHBondContact OE2-CD1 3.38Å; I76-L285 HydrophobicContact CD1-CB 3.91Å; L107-L285 HydrophobicContact CD1-CD2 4.27Å; L107-L285 HydrophobicContact CD2-CD2 4.05Å; L107-L285 HydrophobicContact CD2-CG 4.16Å; R281-L285 HydrophobicContact CG-CD1 4.26Å; R281-L285 WeakPolarHBondContact O-CB 3.16Å; R281-L285 WeakPolarHBondContact O-CG 3.42Å; R281-L285 PolarHBondContact O-N 3.26Å; Q282-L285 PolarHBondContact O-N 3.29Å; R283-L285 VanDerWaalsContact C-N 3.33Å; R283-L285 PolarHBondContact O-N 2.89Å; L285-A289 WeakPolarHBondContact O-CB 3.5Å; L285-A289 PolarHBondContact O-N 2.96Å
286	Q	84.4	Confident	85.3	Confident	113 Å²	113	56 Å²	56	53%	0.528	28%	0.281	S	S	.	.	H	α-helix	trans	-66.1	-41.7	175	-76.6	172	9.3	0	0	112.3	I76 Q282 R283 L284 A289 A290	I76-Q286 HydrophobicContact CD1-CG 3.84Å; Q282-Q286 WeakPolarHBondContact O-CB 3.49Å; Q282-Q286 VanDerWaalsContact O-CG 3.23Å; Q282-Q286 WeakPolarHBondContact O-CG 3.48Å; Q282-Q286 PolarHBondContact O-N 3.37Å; R283-Q286 PolarHBondContact O-N 3.35Å; L284-Q286 PolarHBondContact O-N 2.7Å; Q286-A289 PolarHBondContact O-N 3.46Å; Q286-A290 PolarHBondContact O-N 2.9Å; Q286-A290 VanDerWaalsContact O-N 3.13Å
287	E	83.4	Confident	85.1	Confident	125 Å²	125	50.3 Å²	50.3	58%	0.584	25%	0.254	S	S	*	.	H	α-helix	trans	-66.1	-42.3	176.7	-171.8	173	-172	0	0	111.5	R283 L284	R283-E287 PolarHBondContact O-N 3.03Å; L284-E287 PolarHBondContact O-N 2.83Å
288	A	84.5	Confident	85	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.7	-44.5	172.8	0	0	0	0	0	111.3	L284 A290 N291 W292	L284-A288 WeakPolarHBondContact O-CB 3.31Å; L284-A288 PolarHBondContact O-N 3.45Å; A288-A290 VanDerWaalsContact C-N 3.3Å; A288-A290 PolarHBondContact O-N 2.91Å; A288-N291 PolarHBondContact O-N 3.24Å; A288-W292 WeakPolarHBondContact O-CA 3.48Å; A288-W292 VanDerWaalsContact O-CB 3.23Å; A288-W292 WeakPolarHBondContact O-CB 3.33Å; A288-W292 PolarHBondContact O-N 3.41Å
289	A	83.4	Confident	85.1	Confident	12 Å²	12	47.5 Å²	47.5	10%	0.099	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-34	-177.8	0	0	0	0	0	113.5	M72 L285 Q286 N291	M72-A289 VanDerWaalsContact CE-CA 3.48Å; M72-A289 HydrophobicContact CE-CB 3.43Å; M72-A289 VanDerWaalsContact CE-CB 3.43Å; M72-A289 HydrophobicContact SD-CB 4.1Å; L285-A289 WeakPolarHBondContact O-CB 3.5Å; L285-A289 PolarHBondContact O-N 2.96Å; Q286-A289 PolarHBondContact O-N 3.46Å; A289-N291 VanDerWaalsContact C-N 3.31Å; A289-N291 PolarHBondContact O-N 2.72Å
290	A	82.7	Confident	85.1	Confident	73 Å²	73	48 Å²	48	60%	0.603	24%	0.237	S	C	*	.	H	α-helix	trans	-64.6	-34.5	178.4	0	0	0	0	0	112.8	Q286 A288	Q286-A290 PolarHBondContact O-N 2.9Å; Q286-A290 VanDerWaalsContact O-N 3.13Å; A288-A290 VanDerWaalsContact C-N 3.3Å; A288-A290 PolarHBondContact O-N 2.91Å
291	N	83.9	Confident	85.1	Confident	74 Å²	74	43.5 Å²	43.5	40%	0.396	22%	0.216	S	C	.	.	H	α-helix	trans	-109.7	-15	-173.4	-65.5	-44	0	0	0	114.2	A288 A289 H293 S294 W295	A288-N291 PolarHBondContact O-N 3.24Å; A289-N291 VanDerWaalsContact C-N 3.31Å; A289-N291 PolarHBondContact O-N 2.72Å; N291-H293 PolarHBondContact O-N 2.86Å; N291-S294 WeakPolarHBondContact O-CB 3.41Å; N291-S294 PolarHBondContact O-N 3.33Å; N291-W295 HydrophobicContact CB-CD2 3.94Å; N291-W295 VanDerWaalsContact CB-CE2 3.49Å; N291-W295 HydrophobicContact CB-CE3 4.24Å; N291-W295 HydrophobicContact CB-CH2 3.78Å; N291-W295 HydrophobicContact CB-CZ2 3.41Å; N291-W295 VanDerWaalsContact CB-CZ2 3.41Å; N291-W295 HydrophobicContact CB-CZ3 4.17Å; N291-W295 PolarHBondContact O-N 3.16Å
292	W	84.5	Confident	85.2	Confident	8 Å²	8	43.2 Å²	43.2	3%	0.03	22%	0.215	C	C	.	.	H	α-helix	trans	-38.9	-58.2	179.9	163.1	-108.9	0	0	0	113.5	L65 L68 E69 M72 A288 S294 W295 L296	L65-W292 HydrophobicContact CB-CE3 4.45Å; L65-W292 HydrophobicContact CB-CH2 3.42Å; L65-W292 VanDerWaalsContact CB-CH2 3.42Å; L65-W292 HydrophobicContact CB-CZ3 3.31Å; L65-W292 HydrophobicContact CD2-CE3 3.58Å; L65-W292 HydrophobicContact CD2-CH2 4.12Å; L65-W292 HydrophobicContact CD2-CZ3 3.24Å; L65-W292 HydrophobicContact CG-CH2 4.31Å; L65-W292 HydrophobicContact CG-CZ3 3.83Å; L65-W292 WeakPolarHBondContact O-CH2 3.41Å; L65-W292 WeakPolarHBondContact O-CZ3 3.3Å; L68-W292 HydrophobicContact CB-CE3 4.09Å; L68-W292 HydrophobicContact CB-CZ3 3.86Å; L68-W292 HydrophobicContact CD1-CE3 4.43Å; L68-W292 HydrophobicContact CD1-CZ3 4.39Å; E69-W292 HydrophobicContact CB-CH2 3.82Å; E69-W292 HydrophobicContact CB-CZ2 3.63Å; E69-W292 HydrophobicContact CG-CZ2 4.05Å; M72-W292 HydrophobicContact CE-CB 4.25Å; M72-W292 HydrophobicContact CE-CG 4.17Å; M72-W292 HydrophobicContact SD-CB 4.35Å; M72-W292 HydrophobicContact SD-CG 4.34Å; A288-W292 WeakPolarHBondContact O-CA 3.48Å; A288-W292 VanDerWaalsContact O-CB 3.23Å; A288-W292 WeakPolarHBondContact O-CB 3.33Å; A288-W292 PolarHBondContact O-N 3.41Å; W292-S294 VanDerWaalsContact C-N 3.29Å; W292-S294 PolarHBondContact O-N 3.49Å; W292-W295 PolarHBondContact O-N 2.98Å; W292-W295 VanDerWaalsContact O-N 3.15Å; W292-L296 HydrophobicContact CH2-CD1 4.37Å; W292-L296 HydrophobicContact CZ2-CD1 4.27Å; W292-L296 HydrophobicContact CZ2-CD2 4.27Å; W292-L296 PolarHBondContact O-N 3.47Å
293	H	82.1	Confident	85.4	Confident	46 Å²	46	42.3 Å²	42.3	21%	0.213	21%	0.21	C	C	.	.	H	α-helix	trans	-65.3	-35.4	-174	-169.4	78.1	0	0	0	112.3	P81 N291 I297	P81-H293 VanDerWaalsContact CD-CD2 3.42Å; P81-H293 WeakPolarHBondContact CD-CD2 3.5Å; P81-H293 HydrophobicContact CG-CB 4.11Å; N291-H293 PolarHBondContact O-N 2.86Å; H293-I297 WeakPolarHBondContact NE2-CD1 3.37Å; H293-I297 WeakPolarHBondContact O-CG1 3.45Å; H293-I297 PolarHBondContact O-N 2.85Å; H293-I297 VanDerWaalsContact O-N 3.12Å
294	S	84.5	Confident	85.5	Confident	34 Å²	34	35 Å²	35	24%	0.238	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-43.6	175.5	-175.9	0	0	0	0	111	N291 W292 I297 K298	N291-S294 WeakPolarHBondContact O-CB 3.41Å; N291-S294 PolarHBondContact O-N 3.33Å; W292-S294 VanDerWaalsContact C-N 3.29Å; W292-S294 PolarHBondContact O-N 3.49Å; S294-I297 PolarHBondContact O-N 3.16Å; S294-K298 WeakPolarHBondContact O-CB 3.49Å; S294-K298 VanDerWaalsContact O-CG 3.26Å; S294-K298 WeakPolarHBondContact O-CG 3.39Å; S294-K298 PolarHBondContact O-N 3.12Å
295	W	86.9	Confident	85.8	Confident	28 Å²	28	34.4 Å²	34.4	11%	0.106	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-42.9	176.4	-62.5	-27.3	0	0	0	112.1	L65 L96 V99 L100 L103 N291 W292 K298 V299	L65-W295 HydrophobicContact CD2-CB 3.96Å; L65-W295 HydrophobicContact CD2-CE3 4.41Å; L96-W295 HydrophobicContact CD2-CG 4.18Å; V99-W295 HydrophobicContact CG1-CH2 4.35Å; V99-W295 HydrophobicContact CG1-CZ2 4.17Å; L100-W295 HydrophobicContact CD2-CD2 4.27Å; L100-W295 HydrophobicContact CD2-CE3 3.74Å; L100-W295 HydrophobicContact CD2-CZ3 4.09Å; L103-W295 HydrophobicContact CD1-CH2 3.65Å; L103-W295 HydrophobicContact CD1-CZ3 3.88Å; N291-W295 HydrophobicContact CB-CD2 3.94Å; N291-W295 VanDerWaalsContact CB-CE2 3.49Å; N291-W295 HydrophobicContact CB-CE3 4.24Å; N291-W295 HydrophobicContact CB-CH2 3.78Å; N291-W295 HydrophobicContact CB-CZ2 3.41Å; N291-W295 VanDerWaalsContact CB-CZ2 3.41Å; N291-W295 HydrophobicContact CB-CZ3 4.17Å; N291-W295 PolarHBondContact O-N 3.16Å; W292-W295 PolarHBondContact O-N 2.98Å; W292-W295 VanDerWaalsContact O-N 3.15Å; W295-K298 PolarHBondContact O-N 2.99Å; W295-V299 WeakPolarHBondContact O-CG2 3.39Å; W295-V299 PolarHBondContact O-N 3.43Å
296	L	85.5	Confident	86	Confident	33 Å²	33	34.8 Å²	34.8	17%	0.173	18%	0.183	C	C	.	.	H	α-helix	trans	-57.6	-52.3	176.5	-174	71.3	0	0	0	111.7	L65 W292 K298 V299 Q300	L65-L296 HydrophobicContact CD1-CD1 4.34Å; W292-L296 HydrophobicContact CH2-CD1 4.37Å; W292-L296 HydrophobicContact CZ2-CD1 4.27Å; W292-L296 HydrophobicContact CZ2-CD2 4.27Å; W292-L296 PolarHBondContact O-N 3.47Å; L296-K298 VanDerWaalsContact C-N 3.31Å; L296-K298 PolarHBondContact O-N 2.94Å; L296-V299 PolarHBondContact O-N 2.9Å; L296-Q300 WeakPolarHBondContact O-CB 3.43Å; L296-Q300 WeakPolarHBondContact O-CG 3.49Å; L296-Q300 PolarHBondContact O-N 3.47Å
297	I	84.8	Confident	86.2	Confident	11 Å²	11	34.1 Å²	34.1	6%	0.056	18%	0.18	C	C	.	.	H	α-helix	trans	-59.1	-45.2	178	-68.6	170.1	0	0	0	110.7	P85 H293 S294 Q300 K301 L832	P85-I297 HydrophobicContact CG-CB 4.08Å; P85-I297 HydrophobicContact CG-CG2 3.83Å; H293-I297 WeakPolarHBondContact NE2-CD1 3.37Å; H293-I297 WeakPolarHBondContact O-CG1 3.45Å; H293-I297 PolarHBondContact O-N 2.85Å; H293-I297 VanDerWaalsContact O-N 3.12Å; S294-I297 PolarHBondContact O-N 3.16Å; I297-Q300 PolarHBondContact O-N 3.43Å; I297-K301 HydrophobicContact CG2-CD 4.02Å; I297-K301 HydrophobicContact CG2-CG 4.27Å; I297-K301 WeakPolarHBondContact O-CB 3.46Å; I297-K301 VanDerWaalsContact O-CG 3.26Å; I297-K301 WeakPolarHBondContact O-CG 3.34Å; I297-K301 PolarHBondContact O-N 3.34Å; I297-L832 HydrophobicContact CB-CD2 4.12Å; I297-L832 HydrophobicContact CG1-CD1 4.36Å; I297-L832 HydrophobicContact CG1-CD2 3.87Å; I297-L832 HydrophobicContact CG2-CD1 3.81Å; I297-L832 HydrophobicContact CG2-CD2 3.92Å
298	K	86.8	Confident	86.5	Confident	41 Å²	41	28.7 Å²	28.7	18%	0.178	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-49.5	179.9	-79.2	-175.1	179.4	-159.9	0	111.8	P85 P88 E92 L96 S294 W295 L296 K301 M302	P85-K298 HydrophobicContact CB-CG 4.42Å; P85-K298 HydrophobicContact CG-CG 4.07Å; P88-K298 HydrophobicContact CB-CD 4.32Å; P88-K298 HydrophobicContact CG-CB 3.99Å; P88-K298 HydrophobicContact CG-CD 4.29Å; P88-K298 HydrophobicContact CG-CG 4.02Å; E92-K298 IonicContact OE2-NZ 3.55Å; L96-K298 HydrophobicContact CD1-CB 4.5Å; L96-K298 HydrophobicContact CD1-CD 4.19Å; S294-K298 WeakPolarHBondContact O-CB 3.49Å; S294-K298 VanDerWaalsContact O-CG 3.26Å; S294-K298 WeakPolarHBondContact O-CG 3.39Å; S294-K298 PolarHBondContact O-N 3.12Å; W295-K298 PolarHBondContact O-N 2.99Å; L296-K298 VanDerWaalsContact C-N 3.31Å; L296-K298 PolarHBondContact O-N 2.94Å; K298-K301 PolarHBondContact O-N 3.48Å; K298-M302 VanDerWaalsContact O-CG 3.3Å; K298-M302 WeakPolarHBondContact O-CG 3.23Å; K298-M302 PolarHBondContact O-N 3.25Å
299	V	88.4	Confident	86.7	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-65.3	-42.7	-178.5	175.3	0	0	0	0	111.2	C58 L61 E62 L65 W295 L296 K301 M302 K303	C58-V299 HydrophobicContact CB-CG1 4.37Å; C58-V299 WeakPolarHBondContact O-CG1 3.39Å; L61-V299 HydrophobicContact CB-CG1 4Å; L61-V299 HydrophobicContact CB-CG2 4.12Å; L61-V299 HydrophobicContact CD1-CG2 4.31Å; E62-V299 HydrophobicContact CG-CG1 3.58Å; L65-V299 HydrophobicContact CD1-CB 4.13Å; L65-V299 HydrophobicContact CD1-CG2 3.88Å; W295-V299 WeakPolarHBondContact O-CG2 3.39Å; W295-V299 PolarHBondContact O-N 3.43Å; L296-V299 PolarHBondContact O-N 2.9Å; V299-K301 PolarHBondContact O-N 3.49Å; V299-M302 PolarHBondContact O-N 3.18Å; V299-K303 WeakPolarHBondContact O-CB 3.48Å; V299-K303 PolarHBondContact O-N 3.47Å
300	Q	87.1	Confident	87	Confident	51 Å²	51	28.9 Å²	28.9	24%	0.238	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-43.2	176.6	-73.7	178.4	-17.2	0	0	112	L296 I297 K303 A304 L832	L296-Q300 WeakPolarHBondContact O-CB 3.43Å; L296-Q300 WeakPolarHBondContact O-CG 3.49Å; L296-Q300 PolarHBondContact O-N 3.47Å; I297-Q300 PolarHBondContact O-N 3.43Å; Q300-K303 PolarHBondContact O-N 3.4Å; Q300-A304 WeakPolarHBondContact O-CB 3.45Å; Q300-A304 PolarHBondContact O-N 2.78Å; Q300-L832 HydrophobicContact CB-CD2 4.33Å
301	K	87.7	Confident	87.1	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.017	13%	0.132	C	C	.	.	H	α-helix	trans	-61.5	-45.3	174.3	-71.8	-174.2	176.4	-169.6	0	111.7	E31 P85 T87 I297 K298 V299 A304 V305 F828	E31-K301 IonicContact OE1-NZ 3.73Å; E31-K301 PolarHBondContact OE1-NZ 3.45Å; E31-K301 IonicContact OE2-NZ 2.77Å; P85-K301 PolarHBondContact O-NZ 3.06Å; T87-K301 HydrophobicContact CG2-CB 4.27Å; T87-K301 HydrophobicContact CG2-CD 3.79Å; I297-K301 HydrophobicContact CG2-CD 4.02Å; I297-K301 HydrophobicContact CG2-CG 4.27Å; I297-K301 WeakPolarHBondContact O-CB 3.46Å; I297-K301 VanDerWaalsContact O-CG 3.26Å; I297-K301 WeakPolarHBondContact O-CG 3.34Å; I297-K301 PolarHBondContact O-N 3.34Å; K298-K301 PolarHBondContact O-N 3.48Å; V299-K301 PolarHBondContact O-N 3.49Å; K301-A304 PolarHBondContact O-N 3Å; K301-V305 WeakPolarHBondContact O-CG2 3.42Å; K301-V305 PolarHBondContact O-N 3.31Å; K301-F828 HydrophobicContact CB-CD1 3.98Å; K301-F828 HydrophobicContact CB-CE1 3.83Å; K301-F828 HydrophobicContact CB-CZ 4.3Å; K301-F828 HydrophobicContact CD-CB 4.46Å; K301-F828 HydrophobicContact CD-CD1 4.33Å; K301-F828 HydrophobicContact CD-CD2 4.2Å; K301-F828 HydrophobicContact CD-CG 4.09Å; K301-F828 HydrophobicContact CG-CB 4.23Å; K301-F828 HydrophobicContact CG-CD1 3.6Å; K301-F828 HydrophobicContact CG-CD2 4.36Å; K301-F828 HydrophobicContact CG-CE1 3.97Å; K301-F828 HydrophobicContact CG-CG 3.82Å; K301-F828 HydrophobicContact CG-CZ 4.49Å
302	M	87.4	Confident	87.3	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-59.7	-48.6	177.5	-69.7	-173.1	-178.7	0	0	111.6	Y23 P88 M93 L96 K298 V299 A304 V305 Y306	Y23-M302 WeakPolarHBondContact OH-CG 3.44Å; P88-M302 HydrophobicContact CB-CE 3.53Å; P88-M302 HydrophobicContact CG-CE 3.11Å; P88-M302 HydrophobicContact CG-CG 3.79Å; P88-M302 HydrophobicContact CG-SD 4.24Å; M93-M302 HydrophobicContact CB-CE 3.77Å; M93-M302 HydrophobicContact CB-SD 3.82Å; M93-M302 HydrophobicContact CG-CE 4.33Å; M93-M302 HydrophobicContact CG-SD 3.77Å; M93-M302 HydrophobicContact SD-SD 4.26Å; L96-M302 HydrophobicContact CD1-CE 3.9Å; K298-M302 VanDerWaalsContact O-CG 3.3Å; K298-M302 WeakPolarHBondContact O-CG 3.23Å; K298-M302 PolarHBondContact O-N 3.25Å; V299-M302 PolarHBondContact O-N 3.18Å; M302-A304 VanDerWaalsContact C-N 3.29Å; M302-A304 PolarHBondContact O-N 2.84Å; M302-V305 PolarHBondContact O-N 2.9Å; M302-Y306 HydrophobicContact CB-CE2 4.37Å; M302-Y306 WeakPolarHBondContact O-CD2 3.48Å; M302-Y306 PolarHBondContact O-N 3.23Å
303	K	89.1	Confident	87.4	Confident	55 Å²	55	26.7 Å²	26.7	24%	0.239	13%	0.132	C	C	.	.	H	α-helix	trans	-56.7	-45	178.5	-178.2	176.6	174.1	175.1	0	111.4	C58 E59 E62 V299 Q300 Y306 H307	C58-K303 HydrophobicContact CB-CB 3.88Å; C58-K303 HydrophobicContact CB-CG 4.34Å; E59-K303 HydrophobicContact CG-CD 4.49Å; E59-K303 IonicContact OE1-NZ 2.96Å; E62-K303 VanDerWaalsContact OE1-CD 3.25Å; E62-K303 WeakPolarHBondContact OE1-CD 3.45Å; E62-K303 IonicContact OE1-NZ 3.57Å; E62-K303 IonicContact OE2-NZ 3.62Å; E62-K303 PolarHBondContact OE2-NZ 3.04Å; V299-K303 WeakPolarHBondContact O-CB 3.48Å; V299-K303 PolarHBondContact O-N 3.47Å; Q300-K303 PolarHBondContact O-N 3.4Å; K303-Y306 PolarHBondContact O-N 2.92Å; K303-H307 WeakPolarHBondContact O-CB 3.42Å; K303-H307 PolarHBondContact O-N 3.48Å
304	A	89.1	Confident	87.3	Confident	13 Å²	13	26.9 Å²	26.9	11%	0.107	13%	0.134	C	C	.	.	H	α-helix	trans	-61.4	-44.3	178.1	0	0	0	0	0	112.3	Q300 K301 M302 H307 I308 F826 F828 I831	Q300-A304 WeakPolarHBondContact O-CB 3.45Å; Q300-A304 PolarHBondContact O-N 2.78Å; K301-A304 PolarHBondContact O-N 3Å; M302-A304 VanDerWaalsContact C-N 3.29Å; M302-A304 PolarHBondContact O-N 2.84Å; A304-H307 PolarHBondContact O-N 3.31Å; A304-I308 WeakPolarHBondContact O-CG1 3.47Å; A304-I308 PolarHBondContact O-N 2.93Å; A304-F826 HydrophobicContact CB-CE2 3.96Å; A304-F826 HydrophobicContact CB-CZ 4.23Å; A304-F828 HydrophobicContact CB-CE1 4.18Å; A304-I831 HydrophobicContact CB-CD1 3.66Å
305	V	90.5	Very high	87	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-46.8	176.2	173.3	0	0	0	0	111.4	Y23 V26 A27 K301 M302 H307 I308 L309 F826 F828	Y23-V305 HydrophobicContact CD2-CG1 3.56Å; Y23-V305 HydrophobicContact CE2-CB 4.08Å; Y23-V305 HydrophobicContact CE2-CG1 3.55Å; Y23-V305 HydrophobicContact CG-CG1 4.18Å; V26-V305 HydrophobicContact CB-CG1 4.15Å; V26-V305 HydrophobicContact CG1-CB 4.44Å; V26-V305 HydrophobicContact CG1-CG1 3.9Å; V26-V305 HydrophobicContact CG1-CG2 4.42Å; A27-V305 HydrophobicContact CB-CG2 4.33Å; K301-V305 WeakPolarHBondContact O-CG2 3.42Å; K301-V305 PolarHBondContact O-N 3.31Å; M302-V305 PolarHBondContact O-N 2.9Å; V305-H307 VanDerWaalsContact C-N 3.29Å; V305-H307 PolarHBondContact O-N 3.36Å; V305-I308 PolarHBondContact O-N 2.61Å; V305-L309 HydrophobicContact CG1-CD1 4.02Å; V305-L309 HydrophobicContact CG1-CG 4.48Å; V305-L309 WeakPolarHBondContact O-CG 3.39Å; V305-L309 PolarHBondContact O-N 2.7Å; V305-F826 HydrophobicContact CG2-CZ 4.48Å; V305-F828 HydrophobicContact CG2-CE1 4Å; V305-F828 HydrophobicContact CG2-CZ 3.66Å
306	Y	89.2	Confident	86.3	Confident	8 Å²	8	32.3 Å²	32.3	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-31.1	177.9	-68.6	-54.8	0	0	0	112.9	Y23 E54 M93 M302 K303 L309 N310	Y23-Y306 HydrophobicContact CD2-CD1 4.32Å; Y23-Y306 AromaticContact CD2-CE1 3.68Å; Y23-Y306 HydrophobicContact CD2-CE1 3.68Å; Y23-Y306 HydrophobicContact CE2-CD1 4.21Å; Y23-Y306 HydrophobicContact CE2-CD2 4.5Å; Y23-Y306 AromaticContact CE2-CE1 3.61Å; Y23-Y306 HydrophobicContact CE2-CE1 3.61Å; Y23-Y306 AromaticContact CE2-CE2 3.98Å; Y23-Y306 HydrophobicContact CE2-CE2 3.98Å; Y23-Y306 AromaticContact CE2-CZ 3.51Å; E54-Y306 HydrophobicContact CB-CD1 4.16Å; E54-Y306 HydrophobicContact CB-CD2 4.14Å; E54-Y306 HydrophobicContact CB-CE1 4.24Å; E54-Y306 HydrophobicContact CB-CE2 4.18Å; E54-Y306 HydrophobicContact CB-CG 4.12Å; E54-Y306 WeakPolarHBondContact OE2-CD1 3.4Å; E54-Y306 WeakPolarHBondContact OE2-CE1 3.44Å; M93-Y306 HydrophobicContact SD-CE2 4.01Å; M302-Y306 HydrophobicContact CB-CE2 4.37Å; M302-Y306 WeakPolarHBondContact O-CD2 3.48Å; M302-Y306 PolarHBondContact O-N 3.23Å; K303-Y306 PolarHBondContact O-N 2.92Å; Y306-L309 HydrophobicContact CD1-CD1 4.05Å; Y306-L309 PolarHBondContact O-N 2.73Å; Y306-N310 PolarHBondContact O-N 2.83Å; Y306-N310 VanDerWaalsContact O-N 3.08Å; Y306-N310 PolarHBondContact O-ND2 2.94Å
307	H	89.1	Confident	85.7	Confident	99 Å²	99	36.5 Å²	36.5	46%	0.458	19%	0.194	S	C	.	.	H	α-helix	trans	-65.5	-43.5	172.4	-172.2	79.4	0	0	0	111.9	K303 A304 V305 N310 M311	K303-H307 WeakPolarHBondContact O-CB 3.42Å; K303-H307 PolarHBondContact O-N 3.48Å; A304-H307 PolarHBondContact O-N 3.31Å; V305-H307 VanDerWaalsContact C-N 3.29Å; V305-H307 PolarHBondContact O-N 3.36Å; H307-N310 WeakPolarHBondContact O-CB 3.45Å; H307-N310 PolarHBondContact O-N 3.26Å; H307-M311 PolarHBondContact O-N 3.39Å
308	I	89.6	Confident	84.9	Confident	10 Å²	10	42 Å²	42	5%	0.051	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-45.3	173.4	-64.8	-51.3	0	0	0	111.4	V26 F37 A304 V305 N310 M311 C312 F826	V26-I308 HydrophobicContact CG1-CB 3.99Å; V26-I308 HydrophobicContact CG1-CG2 3.78Å; F37-I308 HydrophobicContact CD1-CG2 3.7Å; F37-I308 HydrophobicContact CD2-CD1 4Å; F37-I308 HydrophobicContact CD2-CG1 4.33Å; F37-I308 HydrophobicContact CD2-CG2 3.57Å; F37-I308 HydrophobicContact CE1-CG2 3.68Å; F37-I308 HydrophobicContact CE2-CG1 4.49Å; F37-I308 HydrophobicContact CE2-CG2 3.55Å; F37-I308 HydrophobicContact CG-CD1 4.48Å; F37-I308 HydrophobicContact CG-CG2 3.65Å; F37-I308 HydrophobicContact CZ-CG2 3.61Å; A304-I308 WeakPolarHBondContact O-CG1 3.47Å; A304-I308 PolarHBondContact O-N 2.93Å; V305-I308 PolarHBondContact O-N 2.61Å; I308-N310 PolarHBondContact O-N 3.43Å; I308-M311 HydrophobicContact CD1-CE 3.15Å; I308-M311 HydrophobicContact CG1-CE 4.32Å; I308-M311 WeakPolarHBondContact O-CB 3.44Å; I308-M311 PolarHBondContact O-N 2.71Å; I308-C312 PolarHBondContact O-N 3.34Å; I308-C312 PolarHBondContact O-SG 3.24Å; I308-C312 VanDerWaalsContact O-SG 3.42Å; I308-F826 HydrophobicContact CD1-CB 4.44Å; I308-F826 HydrophobicContact CD1-CD2 3.51Å; I308-F826 HydrophobicContact CD1-CE2 3.8Å; I308-F826 HydrophobicContact CD1-CG 3.95Å; I308-F826 HydrophobicContact CD1-CZ 4.48Å; I308-F826 HydrophobicContact CG1-CD1 4.07Å; I308-F826 HydrophobicContact CG1-CD2 3.46Å; I308-F826 VanDerWaalsContact CG1-CD2 3.46Å; I308-F826 HydrophobicContact CG1-CE1 3.91Å; I308-F826 HydrophobicContact CG1-CE2 3.27Å; I308-F826 HydrophobicContact CG1-CG 3.85Å; I308-F826 HydrophobicContact CG1-CZ 3.52Å
309	L	88.8	Confident	84.6	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-28.3	178.1	-73.4	169.7	0	0	0	112.6	A22 Y23 V26 F51 V305 Y306 M311 C312	A22-L309 HydrophobicContact CB-CD2 3.99Å; Y23-L309 HydrophobicContact CD2-CD1 4.18Å; V26-L309 HydrophobicContact CG2-CD2 4.03Å; F51-L309 HydrophobicContact CD2-CB 3.71Å; F51-L309 HydrophobicContact CE2-CB 3.77Å; F51-L309 HydrophobicContact CG-CB 4.45Å; V305-L309 HydrophobicContact CG1-CD1 4.02Å; V305-L309 HydrophobicContact CG1-CG 4.48Å; V305-L309 WeakPolarHBondContact O-CG 3.39Å; V305-L309 PolarHBondContact O-N 2.7Å; Y306-L309 HydrophobicContact CD1-CD1 4.05Å; Y306-L309 PolarHBondContact O-N 2.73Å; L309-M311 VanDerWaalsContact C-N 3.33Å; L309-C312 PolarHBondContact O-N 3.41Å
310	N	88.9	Confident	84.5	Confident	11 Å²	11	48 Å²	48	6%	0.059	25%	0.251	C	S	.	.	H	α-helix	trans	-71.3	-23.8	173.6	-84.9	-37.4	0	0	0	113.9	N41 R49 F51 Y306 H307 I308	N41-N310 PolarHBondContact ND2-O 2.89Å; R49-N310 HydrophobicContact CB-CB 4.36Å; F51-N310 WeakPolarHBondContact CA-OD1 3.32Å; F51-N310 VanDerWaalsContact CB-OD1 3.28Å; F51-N310 WeakPolarHBondContact CB-OD1 3.42Å; F51-N310 PolarHBondContact N-OD1 2.92Å; Y306-N310 PolarHBondContact O-N 2.83Å; Y306-N310 VanDerWaalsContact O-N 3.08Å; Y306-N310 PolarHBondContact O-ND2 2.94Å; H307-N310 WeakPolarHBondContact O-CB 3.45Å; H307-N310 PolarHBondContact O-N 3.26Å; I308-N310 PolarHBondContact O-N 3.43Å
311	M	85.9	Confident	84.5	Confident	30 Å²	30	45.6 Å²	45.6	15%	0.148	24%	0.24	C	C	.	.	H	α-helix	trans	-80.7	-19.7	173.7	-69.1	-168.9	-77.8	0	0	112.7	F37 D39 L40 H307 I308 L309	F37-M311 HydrophobicContact CB-CE 4.31Å; D39-M311 HydrophobicContact CB-CG 4.39Å; D39-M311 HydrophobicContact CB-SD 4.34Å; L40-M311 PolarHBondContact N-O 3.12Å; L40-M311 VanDerWaalsContact N-O 3.16Å; H307-M311 PolarHBondContact O-N 3.39Å; I308-M311 HydrophobicContact CD1-CE 3.15Å; I308-M311 HydrophobicContact CG1-CE 4.32Å; I308-M311 WeakPolarHBondContact O-CB 3.44Å; I308-M311 PolarHBondContact O-N 2.71Å; L309-M311 VanDerWaalsContact C-N 3.33Å
312	C	87.8	Confident	84.6	Confident	5 Å²	5	47 Å²	47	3%	0.034	25%	0.247	C	C	.	.	S	Bend	trans	-75.9	150	177.4	-58.2	0	0	0	0	111.6	N41 I308 L309 V321 A323	N41-C312 PolarHBondContact ND2-O 3.15Å; I308-C312 PolarHBondContact O-N 3.34Å; I308-C312 PolarHBondContact O-SG 3.24Å; I308-C312 VanDerWaalsContact O-SG 3.42Å; L309-C312 PolarHBondContact O-N 3.41Å; C312-V321 HydrophobicContact CB-CG1 3.36Å; C312-A323 HydrophobicContact CB-CB 4.45Å
313	N	86.8	Confident	84.7	Confident	74 Å²	74	47 Å²	47	40%	0.396	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.6	171.2	-170.2	10.3	0	0	0	109.5	L40 I322	L40-N313 HydrophobicContact CB-CB 4.15Å; L40-N313 HydrophobicContact CD1-CB 3.91Å; N313-I322 PolarHBondContact N-O 3.13Å; N313-I322 PolarHBondContact O-N 3.32Å
314	I	80.4	Confident	84.8	Confident	50 Å²	50	45.6 Å²	45.6	26%	0.256	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.8	179.1	-53.7	175.5	0	0	0	107.7	K50 F51 V316 V321	K50-I314 HydrophobicContact CB-CD1 3.83Å; K50-I314 HydrophobicContact CG-CD1 3.93Å; F51-I314 HydrophobicContact CD2-CD1 4.49Å; F51-I314 HydrophobicContact CE2-CD1 3.66Å; F51-I314 HydrophobicContact CZ-CD1 4.09Å; I314-V316 PolarHBondContact O-N 2.84Å; I314-V321 HydrophobicContact CG1-CG2 4.44Å
315	D	78.4	Confident	84.9	Confident	47 Å²	47	45 Å²	45	25%	0.251	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	113.2	171.7	-168.7	-10.7	0	0	0	109.5	T317 Q319 C320 I322	D315-T317 VanDerWaalsContact CG-OG1 3.26Å; D315-T317 PolarHBondContact O-N 2.91Å; D315-T317 PolarHBondContact OD1-N 3.16Å; D315-T317 PolarHBondContact OD1-OG1 2.84Å; D315-T317 PolarHBondContact OD2-OG1 2.91Å; D315-Q319 PolarHBondContact O-N 2.69Å; D315-Q319 VanDerWaalsContact O-N 3.14Å; D315-C320 PolarHBondContact N-O 2.92Å; D315-I322 HydrophobicContact CB-CD1 4.38Å
316	V	71.6	Confident	85	Confident	130 Å²	130	45.9 Å²	45.9	79%	0.788	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.6	179.4	-177.8	0	0	0	0	111.2	I314	I314-V316 PolarHBondContact O-N 2.84Å
317	T	72.6	Confident	85.1	Confident	120 Å²	120	45.7 Å²	45.7	74%	0.736	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-36.4	-174.4	65.5	0	0	0	0	112.9	D315	D315-T317 VanDerWaalsContact CG-OG1 3.26Å; D315-T317 PolarHBondContact O-N 2.91Å; D315-T317 PolarHBondContact OD1-N 3.16Å; D315-T317 PolarHBondContact OD1-OG1 2.84Å; D315-T317 PolarHBondContact OD2-OG1 2.91Å
318	Q	67.7	Low	85.2	Confident	126 Å²	126	41 Å²	41	59%	0.589	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-4.4	-176.3	-62.6	-166.6	-9.9	0	0	113.8	C320	Q318-C320 HydrophobicContact CB-CB 4.16Å; Q318-C320 PolarHBondContact O-N 3.25Å; Q318-C320 PolarHBondContact O-SG 3.05Å; Q318-C320 VanDerWaalsContact O-SG 3.34Å
319	Q	80.8	Confident	85.1	Confident	142 Å²	142	44 Å²	44	66%	0.664	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	41.6	-170.2	-60.3	-166	-16.6	0	0	112	V19 D315	V19-Q319 VanDerWaalsContact CG2-O 3.26Å; V19-Q319 WeakPolarHBondContact CG2-O 3.4Å; V19-Q319 PolarHBondContact N-O 3.01Å; D315-Q319 PolarHBondContact O-N 2.69Å; D315-Q319 VanDerWaalsContact O-N 3.14Å
320	C	85.3	Confident	85	Confident	27 Å²	27	47.1 Å²	47.1	18%	0.182	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.3	-179.9	-71	0	0	0	0	109.8	L17 D315 Q318	L17-C320 CarbonylContact O-C 3.58Å; L17-C320 WeakPolarHBondContact O-CA 3.23Å; D315-C320 PolarHBondContact N-O 2.92Å; Q318-C320 HydrophobicContact CB-CB 4.16Å; Q318-C320 PolarHBondContact O-N 3.25Å; Q318-C320 PolarHBondContact O-SG 3.05Å; Q318-C320 VanDerWaalsContact O-SG 3.34Å
321	V	87.8	Confident	84.9	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.3	169.9	-178	0	0	0	0	107.7	L17 V19 A22 C312 I314	L17-V321 HydrophobicContact CB-CB 4.33Å; L17-V321 PolarHBondContact N-O 2.86Å; L17-V321 PolarHBondContact O-N 3.43Å; V19-V321 HydrophobicContact CG2-CG2 4.04Å; A22-V321 HydrophobicContact CB-CB 4.42Å; A22-V321 HydrophobicContact CB-CG2 3.99Å; C312-V321 HydrophobicContact CB-CG1 3.36Å; I314-V321 HydrophobicContact CG1-CG2 4.44Å
322	I	90.3	Very high	85	Confident	33 Å²	33	46.6 Å²	46.6	17%	0.169	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126	176.3	-54.8	175.4	0	0	0	107.7	L15 F16 L40 N313 D315	L15-I322 WeakPolarHBondContact O-CA 3.47Å; F16-I322 HydrophobicContact CD1-CD1 4.4Å; F16-I322 HydrophobicContact CD1-CG1 3.89Å; F16-I322 HydrophobicContact CE1-CD1 3.91Å; F16-I322 HydrophobicContact CE1-CG1 3.83Å; F16-I322 HydrophobicContact CE1-CG2 4.35Å; L40-I322 WeakPolarHBondContact CD1-O 3.33Å; N313-I322 PolarHBondContact N-O 3.13Å; N313-I322 PolarHBondContact O-N 3.32Å; D315-I322 HydrophobicContact CB-CD1 4.38Å
323	A	90.2	Very high	85.1	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.5	176.4	0	0	0	0	0	110.7	Q14 L15 F37 C312	Q14-A323 CarbonylContact C-O 3.53Å; Q14-A323 WeakPolarHBondContact CA-O 3.22Å; L15-A323 HydrophobicContact CB-CB 4.32Å; L15-A323 PolarHBondContact N-O 3.41Å; L15-A323 PolarHBondContact O-N 3.24Å; F37-A323 HydrophobicContact CD1-CB 4.18Å; F37-A323 HydrophobicContact CE1-CB 4.12Å; C312-A323 HydrophobicContact CB-CB 4.45Å
324	E	90.8	Very high	85.3	Confident	25 Å²	25	52.8 Å²	52.8	12%	0.117	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.9	168.2	-81.3	-174.6	-179.7	0	0	109.4	L12 Q14 K38 L40	L12-E324 HydrophobicContact CD1-CB 4.27Å; Q14-E324 HydrophobicContact CG-CG 3.62Å; Q14-E324 PolarHBondContact NE2-OE1 3.22Å; K38-E324 HydrophobicContact CB-CB 4.08Å; K38-E324 HydrophobicContact CD-CB 4.45Å; K38-E324 WeakPolarHBondContact CD-OE2 3.39Å; K38-E324 PolarHBondContact N-O 3.36Å; K38-E324 IonicContact NZ-OE2 2.96Å; K38-E324 PolarHBondContact NZ-OE2 3.32Å; L40-E324 HydrophobicContact CD2-CB 4.09Å; L40-E324 HydrophobicContact CD2-CG 3.88Å
325	I	91.5	Very high	85.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138.7	-176	59.2	155.5	0	0	0	113	L12 S13 L15 V35 Q36 F37 F327	L12-I325 WeakPolarHBondContact CA-O 3.31Å; S13-I325 PolarHBondContact N-O 3.31Å; S13-I325 WeakPolarHBondContact O-CG1 3.48Å; S13-I325 PolarHBondContact O-N 3.21Å; L15-I325 HydrophobicContact CD1-CD1 3.37Å; L15-I325 HydrophobicContact CD1-CG1 3.82Å; L15-I325 HydrophobicContact CD1-CG2 3.97Å; L15-I325 HydrophobicContact CD2-CD1 4.39Å; L15-I325 HydrophobicContact CG-CD1 3.77Å; L15-I325 HydrophobicContact CG-CG1 3.97Å; V35-I325 HydrophobicContact CG1-CB 3.47Å; V35-I325 VanDerWaalsContact CG1-CB 3.47Å; V35-I325 HydrophobicContact CG1-CD1 3.75Å; V35-I325 HydrophobicContact CG1-CG1 4.24Å; V35-I325 HydrophobicContact CG1-CG2 3.48Å; V35-I325 VanDerWaalsContact CG1-CG2 3.48Å; V35-I325 HydrophobicContact CG2-CD1 4.45Å; Q36-I325 WeakPolarHBondContact O-CA 3.18Å; F37-I325 HydrophobicContact CD1-CG2 3.56Å; F37-I325 HydrophobicContact CE1-CG2 3.6Å; F37-I325 HydrophobicContact CG-CG2 4.15Å; F37-I325 HydrophobicContact CZ-CG2 4.22Å; I325-F327 HydrophobicContact CD1-CD1 3.65Å; I325-F327 HydrophobicContact CD1-CE1 3.9Å; I325-F327 HydrophobicContact CG1-CD1 4.06Å; I325-F327 HydrophobicContact CG1-CE1 4.24Å
326	W	91.8	Very high	86.2	Confident	20 Å²	20	53.1 Å²	53.1	8%	0.076	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.5	166.4	-71	109.7	0	0	0	110.1	M10 L12 Q36 P363 P364 F823	M10-W326 HydrophobicContact CB-CE3 4.02Å; M10-W326 HydrophobicContact CB-CZ3 4.31Å; L12-W326 HydrophobicContact CB-CD2 4.31Å; L12-W326 HydrophobicContact CB-CE3 3.9Å; L12-W326 HydrophobicContact CB-CH2 3.71Å; L12-W326 HydrophobicContact CB-CZ2 4.11Å; L12-W326 HydrophobicContact CB-CZ3 3.58Å; L12-W326 HydrophobicContact CD1-CD2 3.93Å; L12-W326 HydrophobicContact CD1-CE3 4.39Å; L12-W326 HydrophobicContact CD1-CG 4.33Å; L12-W326 HydrophobicContact CD1-CH2 4.48Å; L12-W326 HydrophobicContact CD1-CZ2 4.03Å; L12-W326 HydrophobicContact CD2-CZ2 4.41Å; L12-W326 HydrophobicContact CG-CH2 4.48Å; L12-W326 HydrophobicContact CG-CZ2 4.42Å; Q36-W326 HydrophobicContact CB-CB 4.29Å; Q36-W326 PolarHBondContact N-O 2.94Å; Q36-W326 PolarHBondContact O-N 3.06Å; W326-P363 HydrophobicContact CE3-CB 4.03Å; W326-P363 HydrophobicContact CH2-CB 3.6Å; W326-P363 HydrophobicContact CZ2-CB 4.26Å; W326-P363 HydrophobicContact CZ3-CB 3.47Å; W326-P363 VanDerWaalsContact CZ3-CB 3.47Å; W326-P364 HydrophobicContact CB-CG 3.85Å; W326-P364 HydrophobicContact CD2-CG 4.21Å; W326-P364 HydrophobicContact CG-CG 3.84Å; W326-F823 HydrophobicContact CB-CE2 4.33Å
327	F	90.8	Very high	87.1	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	158.6	171.1	61	-89	0	0	0	112.3	C11 S13 V35 I325 A332 I335 M354	C11-F327 HydrophobicContact CB-CE2 4.33Å; C11-F327 HydrophobicContact CB-CZ 4.31Å; C11-F327 PolarHBondContact N-O 3.33Å; C11-F327 PolarHBondContact O-N 3.15Å; S13-F327 WeakPolarHBondContact OG-CE1 3.4Å; S13-F327 VanDerWaalsContact OG-CZ 3.28Å; S13-F327 WeakPolarHBondContact OG-CZ 3.42Å; V35-F327 HydrophobicContact CG2-CB 4.42Å; I325-F327 HydrophobicContact CD1-CD1 3.65Å; I325-F327 HydrophobicContact CD1-CE1 3.9Å; I325-F327 HydrophobicContact CG1-CD1 4.06Å; I325-F327 HydrophobicContact CG1-CE1 4.24Å; F327-A332 HydrophobicContact CD2-CB 4.44Å; F327-A332 HydrophobicContact CE2-CB 3.71Å; F327-I335 HydrophobicContact CB-CD1 3.39Å; F327-I335 HydrophobicContact CD1-CD1 4.16Å; F327-I335 HydrophobicContact CD2-CD1 3.58Å; F327-I335 HydrophobicContact CE2-CD1 4.42Å; F327-I335 HydrophobicContact CG-CD1 3.44Å; F327-I335 VanDerWaalsContact CG-CD1 3.44Å; F327-M354 HydrophobicContact CE1-SD 3.85Å; F327-M354 HydrophobicContact CZ-CE 3.91Å; F327-M354 HydrophobicContact CZ-SD 3.72Å
328	P	90.8	Very high	87.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	131.3	175.2	-18.8	31.7	0	0	0	111.9	E9 M10 A330 D331 F366	E9-P328 WeakPolarHBondContact O-CA 3.48Å; M10-P328 HydrophobicContact CE-CG 4.3Å; M10-P328 HydrophobicContact SD-CB 4.37Å; M10-P328 HydrophobicContact SD-CG 4.06Å; P328-A330 PolarHBondContact O-N 3.4Å; P328-D331 PolarHBondContact O-N 2.86Å; P328-F366 HydrophobicContact CG-CD1 3.83Å; P328-F366 HydrophobicContact CG-CE1 4Å
329	V	88	Confident	88.8	Confident	72 Å²	72	42.4 Å²	42.4	44%	0.436	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-54.2	-34.2	-179.8	174.5	0	0	0	0	112.1	E9 C11 D331 A332	E9-V329 HydrophobicContact CB-CB 4.48Å; E9-V329 HydrophobicContact CB-CG2 4.15Å; E9-V329 WeakPolarHBondContact O-CG2 3.4Å; E9-V329 PolarHBondContact O-N 2.73Å; C11-V329 HydrophobicContact CB-CG2 3.87Å; V329-D331 VanDerWaalsContact C-N 3.27Å; V329-D331 PolarHBondContact O-N 3.09Å; V329-A332 PolarHBondContact O-N 3.31Å
330	A	87.1	Confident	89.1	Confident	71 Å²	71	40.6 Å²	40.6	59%	0.587	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-63.2	-29.1	179	0	0	0	0	0	113.8	P328	P328-A330 PolarHBondContact O-N 3.4Å
331	D	87.6	Confident	89.2	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.043	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-102.3	6.5	-173.6	-70	-58.9	0	0	0	113.4	L34 P328 V329 T333 R334 I335 R368	L34-D331 HydrophobicContact CD1-CB 3.8Å; P328-D331 PolarHBondContact O-N 2.86Å; V329-D331 VanDerWaalsContact C-N 3.27Å; V329-D331 PolarHBondContact O-N 3.09Å; D331-T333 PolarHBondContact O-N 3.38Å; D331-T333 VanDerWaalsContact O-N 3.11Å; D331-R334 WeakPolarHBondContact O-CB 3.44Å; D331-R334 PolarHBondContact O-N 2.88Å; D331-R334 WeakPolarHBondContact OD1-CD 3.25Å; D331-R334 IonicContact OD1-CZ 3.95Å; D331-R334 IonicContact OD1-NE 3.19Å; D331-R334 IonicContact OD1-NH1 3.28Å; D331-R334 PolarHBondContact OD1-NH1 3.3Å; D331-I335 PolarHBondContact O-N 2.94Å; D331-R368 IonicContact OD2-CZ 2.79Å; D331-R368 IonicContact OD2-NH2 2.89Å; D331-R368 PolarHBondContact OD2-NH2 3.22Å
332	A	88.1	Confident	89	Confident	23 Å²	23	44.1 Å²	44.1	19%	0.19	22%	0.22	C	C	.	.	H	α-helix	trans	-52.1	-37.5	178.3	0	0	0	0	0	113.5	F327 V329 K336	F327-A332 HydrophobicContact CD2-CB 4.44Å; F327-A332 HydrophobicContact CE2-CB 3.71Å; V329-A332 PolarHBondContact O-N 3.31Å; A332-K336 WeakPolarHBondContact O-CG 3.26Å; A332-K336 PolarHBondContact O-N 3.06Å; A332-K336 VanDerWaalsContact O-N 3.12Å
333	T	89.9	Confident	88.7	Confident	80 Å²	80	44.2 Å²	44.2	49%	0.491	22%	0.22	S	C	.	.	H	α-helix	trans	-70.3	-31.4	180	57.5	0	0	0	0	112.9	D331 R337	D331-T333 PolarHBondContact O-N 3.38Å; D331-T333 VanDerWaalsContact O-N 3.11Å; T333-R337 WeakPolarHBondContact O-CG 3.5Å; T333-R337 PolarHBondContact O-N 3.47Å
334	R	90.1	Very high	88.5	Confident	128 Å²	128	51 Å²	51	48%	0.483	25%	0.252	S	S	.	.	H	α-helix	trans	-74	-40.6	177.8	-66.4	175.3	171.7	169.6	-11.8	110.8	L32 D331 R337 A338	L32-R334 HydrophobicContact CD1-CB 4.12Å; D331-R334 WeakPolarHBondContact O-CB 3.44Å; D331-R334 PolarHBondContact O-N 2.88Å; D331-R334 WeakPolarHBondContact OD1-CD 3.25Å; D331-R334 IonicContact OD1-CZ 3.95Å; D331-R334 IonicContact OD1-NE 3.19Å; D331-R334 IonicContact OD1-NH1 3.28Å; D331-R334 PolarHBondContact OD1-NH1 3.3Å; R334-R337 PolarHBondContact O-N 3.38Å; R334-A338 PolarHBondContact O-N 3.02Å
335	I	89.8	Confident	88.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-45.6	176.2	-66.1	166.4	0	0	0	110.6	L29 L32 V35 F327 D331 R337 A338 L339 M354	L29-I335 HydrophobicContact CD2-CG2 3.86Å; L32-I335 HydrophobicContact CD2-CG1 4.08Å; V35-I335 HydrophobicContact CG2-CD1 3.73Å; V35-I335 HydrophobicContact CG2-CG1 4.03Å; V35-I335 HydrophobicContact CG2-CG2 4.46Å; F327-I335 HydrophobicContact CB-CD1 3.39Å; F327-I335 HydrophobicContact CD1-CD1 4.16Å; F327-I335 HydrophobicContact CD2-CD1 3.58Å; F327-I335 HydrophobicContact CE2-CD1 4.42Å; F327-I335 HydrophobicContact CG-CD1 3.44Å; F327-I335 VanDerWaalsContact CG-CD1 3.44Å; D331-I335 PolarHBondContact O-N 2.94Å; I335-R337 VanDerWaalsContact C-N 3.35Å; I335-R337 PolarHBondContact O-N 2.9Å; I335-A338 PolarHBondContact O-N 3.45Å; I335-L339 HydrophobicContact CG2-CD1 4.04Å; I335-L339 HydrophobicContact CG2-CG 4.5Å; I335-L339 WeakPolarHBondContact O-CG 3.38Å; I335-L339 PolarHBondContact O-N 3.46Å; I335-M354 HydrophobicContact CG2-SD 4.48Å
336	K	88.8	Confident	87.5	Confident	105 Å²	105	56.6 Å²	56.6	46%	0.457	29%	0.285	S	S	.	.	H	α-helix	trans	-57.1	-44.9	175.7	-74.5	-176.3	178.6	-169.4	0	112.8	A332 L339 E340 M354	A332-K336 WeakPolarHBondContact O-CG 3.26Å; A332-K336 PolarHBondContact O-N 3.06Å; A332-K336 VanDerWaalsContact O-N 3.12Å; K336-L339 WeakPolarHBondContact O-CB 3.3Å; K336-L339 PolarHBondContact O-N 2.84Å; K336-E340 WeakPolarHBondContact O-CG 3.33Å; K336-E340 PolarHBondContact O-N 2.91Å; K336-M354 HydrophobicContact CD-CE 4.27Å; K336-M354 HydrophobicContact CG-CE 3.97Å
337	R	89.9	Confident	86.9	Confident	143 Å²	143	59 Å²	59	54%	0.54	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-39.6	177.2	-69.9	-176.6	-145.8	137	3.9	112.9	T333 R334 I335 L339 E340 Q341	T333-R337 WeakPolarHBondContact O-CG 3.5Å; T333-R337 PolarHBondContact O-N 3.47Å; R334-R337 PolarHBondContact O-N 3.38Å; I335-R337 VanDerWaalsContact C-N 3.35Å; I335-R337 PolarHBondContact O-N 2.9Å; R337-L339 VanDerWaalsContact C-N 3.31Å; R337-E340 PolarHBondContact O-N 2.91Å; R337-Q341 WeakPolarHBondContact O-CG 3.2Å; R337-Q341 PolarHBondContact O-N 2.96Å
338	A	87.4	Confident	86.3	Confident	3 Å²	3	59.5 Å²	59.5	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-65.2	-37.7	176.8	0	0	0	0	0	111.7	E28 L32 R334 I335 Q341 G342	E28-A338 HydrophobicContact CB-CB 4.47Å; L32-A338 HydrophobicContact CD1-CB 3.84Å; R334-A338 PolarHBondContact O-N 3.02Å; I335-A338 PolarHBondContact O-N 3.45Å; A338-Q341 PolarHBondContact O-N 3.39Å; A338-G342 PolarHBondContact O-N 2.93Å
339	L	87.9	Confident	85.3	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.021	36%	0.359	C	S	.	.	H	α-helix	trans	-64.6	-41.6	173.6	-74.2	170.7	0	0	0	112.3	L15 L17 C25 L29 I335 K336 R337 G342 M343 P352	L15-L339 HydrophobicContact CD2-CD1 3.58Å; L17-L339 HydrophobicContact CD2-CD2 4.06Å; C25-L339 HydrophobicContact CB-CD2 3.98Å; L29-L339 HydrophobicContact CD1-CD2 3.99Å; L29-L339 HydrophobicContact CD2-CD2 4.25Å; L29-L339 HydrophobicContact CD2-CG 4.26Å; L29-L339 HydrophobicContact CG-CD2 4.17Å; I335-L339 HydrophobicContact CG2-CD1 4.04Å; I335-L339 HydrophobicContact CG2-CG 4.5Å; I335-L339 WeakPolarHBondContact O-CG 3.38Å; I335-L339 PolarHBondContact O-N 3.46Å; K336-L339 WeakPolarHBondContact O-CB 3.3Å; K336-L339 PolarHBondContact O-N 2.84Å; R337-L339 VanDerWaalsContact C-N 3.31Å; L339-G342 PolarHBondContact O-N 3.39Å; L339-M343 PolarHBondContact O-N 3Å; L339-P352 HydrophobicContact CB-CB 4.49Å; L339-P352 HydrophobicContact CB-CG 3.71Å
340	E	87.3	Confident	84.6	Confident	104 Å²	104	67.8 Å²	67.8	49%	0.486	37%	0.368	S	S	.	.	H	α-helix	trans	-61.8	-43.5	173.9	-72.1	164.9	-178	0	0	111.5	K336 R337 M343 E344	K336-E340 WeakPolarHBondContact O-CG 3.33Å; K336-E340 PolarHBondContact O-N 2.91Å; R337-E340 PolarHBondContact O-N 2.91Å; E340-M343 WeakPolarHBondContact O-CB 3.26Å; E340-M343 PolarHBondContact O-N 3.41Å; E340-E344 WeakPolarHBondContact O-CG 3.39Å; E340-E344 PolarHBondContact O-N 3.22Å
341	Q	86.8	Confident	83.9	Confident	103 Å²	103	67.6 Å²	67.6	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-43.6	175.5	-73	174	-18.5	0	0	112.4	R337 A338 M343 E344 L345	R337-Q341 WeakPolarHBondContact O-CG 3.2Å; R337-Q341 PolarHBondContact O-N 2.96Å; A338-Q341 PolarHBondContact O-N 3.39Å; Q341-M343 VanDerWaalsContact C-N 3.27Å; Q341-M343 PolarHBondContact O-N 2.78Å; Q341-E344 PolarHBondContact O-N 3.05Å; Q341-L345 WeakPolarHBondContact O-CG 3.26Å; Q341-L345 PolarHBondContact O-N 3.48Å
342	G	84.1	Confident	83.6	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-61.9	-35.4	175.8	0	0	0	0	0	112.8	C24 A338 L339 S346	C24-G342 VanDerWaalsContact CB-O 3.32Å; C24-G342 WeakPolarHBondContact CB-O 3.44Å; A338-G342 PolarHBondContact O-N 2.93Å; L339-G342 PolarHBondContact O-N 3.39Å; G342-S346 PolarHBondContact O-N 3Å
343	M	85	Confident	83.4	Confident	35 Å²	35	72.3 Å²	72.3	17%	0.172	39%	0.389	C	S	.	.	H	α-helix	trans	-65.7	-48.8	173.2	178.6	-164.6	70.7	0	0	111.3	L339 E340 Q341 L345 S346 G347 A351	L339-M343 PolarHBondContact O-N 3Å; E340-M343 WeakPolarHBondContact O-CB 3.26Å; E340-M343 PolarHBondContact O-N 3.41Å; Q341-M343 VanDerWaalsContact C-N 3.27Å; Q341-M343 PolarHBondContact O-N 2.78Å; M343-L345 VanDerWaalsContact C-N 3.28Å; M343-L345 PolarHBondContact O-N 3.25Å; M343-S346 PolarHBondContact O-N 2.9Å; M343-S346 PolarHBondContact O-OG 2.87Å; M343-G347 PolarHBondContact O-N 3.4Å; M343-G347 VanDerWaalsContact O-N 3.13Å; M343-A351 VanDerWaalsContact SD-CA 3.57Å; M343-A351 HydrophobicContact SD-CB 4.21Å
344	E	85.9	Confident	83.1	Confident	143 Å²	143	70.3 Å²	70.3	67%	0.668	38%	0.375	S	S	*	.	H	α-helix	trans	-57.3	-40.9	179	-73.6	178.8	179.3	0	0	112.2	E340 Q341 S346 G347	E340-E344 WeakPolarHBondContact O-CG 3.39Å; E340-E344 PolarHBondContact O-N 3.22Å; Q341-E344 PolarHBondContact O-N 3.05Å; E344-S346 VanDerWaalsContact C-N 3.3Å; E344-S346 PolarHBondContact O-N 3.44Å; E344-G347 PolarHBondContact O-N 3.38Å
345	L	82.2	Confident	82.9	Confident	107 Å²	107	67.3 Å²	67.3	56%	0.56	37%	0.371	S	S	*	.	H	α-helix	trans	-64.1	-33.6	176.6	-72	170	0	0	0	113.2	E28 Q341 M343	E28-L345 HydrophobicContact CG-CD1 4.38Å; E28-L345 WeakPolarHBondContact OE1-CD1 3.33Å; Q341-L345 WeakPolarHBondContact O-CG 3.26Å; Q341-L345 PolarHBondContact O-N 3.48Å; M343-L345 VanDerWaalsContact C-N 3.28Å; M343-L345 PolarHBondContact O-N 3.25Å
346	S	78.9	Confident	82.6	Confident	36 Å²	36	71.9 Å²	71.9	25%	0.252	40%	0.399	S	S	.	.	H	α-helix	trans	-79.6	-17.8	178.2	71.4	0	0	0	0	113.6	A21 G342 M343 E344 S348	A21-S346 WeakPolarHBondContact CB-OG 3.36Å; G342-S346 PolarHBondContact O-N 3Å; M343-S346 PolarHBondContact O-N 2.9Å; M343-S346 PolarHBondContact O-OG 2.87Å; E344-S346 VanDerWaalsContact C-N 3.3Å; E344-S346 PolarHBondContact O-N 3.44Å; S346-S348 PolarHBondContact O-N 2.97Å; S346-S348 PolarHBondContact OG-N 3.47Å
347	G	78.4	Confident	82.3	Confident	69 Å²	69	69 Å²	69	71%	0.711	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	12.5	-174.6	0	0	0	0	0	114.5	M343 E344	M343-G347 PolarHBondContact O-N 3.4Å; M343-G347 VanDerWaalsContact O-N 3.13Å; E344-G347 PolarHBondContact O-N 3.38Å
348	S	77.9	Confident	81.5	Confident	16 Å²	16	71.7 Å²	71.7	11%	0.112	41%	0.408	C	S	.	.			trans	-71.8	146.6	175.3	173.3	0	0	0	0	111.7	Q18 S346 M350	Q18-S348 PolarHBondContact OE1-OG 3.47Å; S346-S348 PolarHBondContact O-N 2.97Å; S346-S348 PolarHBondContact OG-N 3.47Å; S348-M350 PolarHBondContact OG-N 2.92Å
349	S	71.3	Confident	80.8	Confident	118 Å²	118	74 Å²	74	83%	0.825	42%	0.424	S	S	*	.	S	Bend	trans	-90.9	-11.3	178.5	58.3	0	0	0	0	114.4
350	M	72	Confident	80	Confident	127 Å²	127	83.2 Å²	83.2	63%	0.626	46%	0.464	S	S	*	.	S	Bend	trans	-99	122.8	-179	-77.6	-163.7	-112.7	0	0	112	S348	S348-M350 PolarHBondContact OG-N 2.92Å
351	A	73.4	Confident	79.5	Confident	68 Å²	68	81.2 Å²	81.2	56%	0.562	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-70.6	136.2	177.4	0	0	0	0	0	111.7	M343 I353	M343-A351 VanDerWaalsContact SD-CA 3.57Å; M343-A351 HydrophobicContact SD-CB 4.21Å; A351-I353 PolarHBondContact O-N 3.2Å
352	P	80.1	Confident	79.2	Confident	28 Å²	28	79.7 Å²	79.7	18%	0.182	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-64.6	130.2	175.3	25.5	-32.3	0	0	0	110.5	F16 L17 L339	F16-P352 WeakPolarHBondContact O-CA 3.3Å; L17-P352 HydrophobicContact CD2-CB 3.71Å; L339-P352 HydrophobicContact CB-CB 4.49Å; L339-P352 HydrophobicContact CB-CG 3.71Å
353	I	84.4	Confident	79.4	Confident	102 Å²	102	80.7 Å²	80.7	52%	0.523	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.7	-176.9	-54.6	173.6	0	0	0	108.5	L15 F16 A351	L15-I353 WeakPolarHBondContact CA-O 3.48Å; F16-I353 HydrophobicContact CB-CB 4.29Å; F16-I353 HydrophobicContact CD2-CB 4.34Å; F16-I353 PolarHBondContact N-O 2.91Å; F16-I353 PolarHBondContact O-N 3.39Å; A351-I353 PolarHBondContact O-N 3.2Å
354	M	84.4	Confident	79.6	Confident	37 Å²	37	79 Å²	79	18%	0.182	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.6	174	-172.2	178.1	76	0	0	109.7	Q14 L15 F327 I335 K336	Q14-M354 WeakPolarHBondContact O-CA 3.36Å; L15-M354 HydrophobicContact CD2-CB 3.85Å; L15-M354 HydrophobicContact CD2-CG 3.9Å; L15-M354 HydrophobicContact CD2-SD 4.43Å; F327-M354 HydrophobicContact CE1-SD 3.85Å; F327-M354 HydrophobicContact CZ-CE 3.91Å; F327-M354 HydrophobicContact CZ-SD 3.72Å; I335-M354 HydrophobicContact CG2-SD 4.48Å; K336-M354 HydrophobicContact CD-CE 4.27Å; K336-M354 HydrophobicContact CG-CE 3.97Å
355	T	85.8	Confident	79.8	Confident	66 Å²	66	72.8 Å²	72.8	41%	0.405	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.9	179.6	-55.5	0	0	0	0	110	S13 Q14	S13-T355 CarbonylContact C-O 3.51Å; S13-T355 VanDerWaalsContact CA-O 3.23Å; S13-T355 WeakPolarHBondContact CA-O 2.85Å; S13-T355 WeakPolarHBondContact CB-O 3.23Å; Q14-T355 PolarHBondContact N-O 3.35Å; Q14-T355 PolarHBondContact O-N 3Å
356	T	81.9	Confident	80.1	Confident	96 Å²	96	69.7 Å²	69.7	59%	0.589	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	127.3	177	54.2	0	0	0	0	110.5
357	V	82.9	Confident	80.4	Confident	43 Å²	43	69.4 Å²	69.4	26%	0.261	41%	0.412	S	S	.	.			trans	-106.9	130.5	179.7	-179.9	0	0	0	0	109.6	L12 Q14 S359	L12-V357 HydrophobicContact CD2-CB 4.39Å; L12-V357 HydrophobicContact CD2-CG1 4.44Å; L12-V357 PolarHBondContact O-N 2.91Å; Q14-V357 HydrophobicContact CB-CG2 4.08Å; Q14-V357 HydrophobicContact CG-CG2 3.65Å; V357-S359 PolarHBondContact O-N 3.39Å
358	Q	73.1	Confident	80.7	Confident	200 Å²	200	70.3 Å²	70.3	94%	0.935	39%	0.394	S	S	*	.			trans	-85	98.4	170.5	-66.3	-171.7	2.3	0	0	108.9
359	S	73.4	Confident	80.9	Confident	51 Å²	51	72.8 Å²	72.8	36%	0.357	41%	0.408	S	S	.	.			trans	-103	149.3	175.1	-179.2	0	0	0	0	111.5	V357 T361	V357-S359 PolarHBondContact O-N 3.39Å; S359-T361 VanDerWaalsContact C-N 3.33Å; S359-T361 WeakPolarHBondContact CB-OG1 3.42Å; S359-T361 WeakPolarHBondContact OG-CB 3.37Å; S359-T361 WeakPolarHBondContact OG-CG2 3.12Å; S359-T361 PolarHBondContact OG-N 3.26Å; S359-T361 VanDerWaalsContact OG-N 3.09Å; S359-T361 PolarHBondContact OG-OG1 2.99Å
360	K	70.2	Confident	81.5	Confident	198 Å²	198	72.8 Å²	72.8	86%	0.861	40%	0.399	S	S	*	.			trans	-82.8	-8.2	170.2	-67.4	-179.2	-178.4	175.1	0	113.1
361	T	77.5	Confident	81.9	Confident	63 Å²	63	73.9 Å²	73.9	39%	0.387	40%	0.4	S	S	.	.	S	Bend	trans	-62.8	135.3	178	52.4	0	0	0	0	110.6	S359	S359-T361 VanDerWaalsContact C-N 3.33Å; S359-T361 WeakPolarHBondContact CB-OG1 3.42Å; S359-T361 WeakPolarHBondContact OG-CB 3.37Å; S359-T361 WeakPolarHBondContact OG-CG2 3.12Å; S359-T361 PolarHBondContact OG-N 3.26Å; S359-T361 VanDerWaalsContact OG-N 3.09Å; S359-T361 PolarHBondContact OG-OG1 2.99Å
362	A	80.5	Confident	82.5	Confident	71 Å²	71	74.2 Å²	74.2	59%	0.587	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-56.7	130.9	172.5	0	0	0	0	0	109.2	Y821	A362-Y821 HydrophobicContact CB-CE1 4.4Å; A362-Y821 WeakPolarHBondContact O-CE1 3.43Å; A362-Y821 PolarHBondContact O-OH 3.12Å
363	P	88.1	Confident	82.8	Confident	21 Å²	21	73.5 Å²	73.5	14%	0.136	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-82.3	160.3	176.5	31.4	-35.7	0	0	0	112.4	M10 W326 Y388 Y821	M10-P363 HydrophobicContact CB-CB 3.88Å; M10-P363 HydrophobicContact CG-CB 4.48Å; W326-P363 HydrophobicContact CE3-CB 4.03Å; W326-P363 HydrophobicContact CH2-CB 3.6Å; W326-P363 HydrophobicContact CZ2-CB 4.26Å; W326-P363 HydrophobicContact CZ3-CB 3.47Å; W326-P363 VanDerWaalsContact CZ3-CB 3.47Å; P363-Y388 HydrophobicContact CB-CD2 4.2Å; P363-Y388 HydrophobicContact CB-CE2 4.14Å; P363-Y388 HydrophobicContact CB-CG 4.47Å; P363-Y388 HydrophobicContact CG-CD1 3.34Å; P363-Y388 HydrophobicContact CG-CD2 3.47Å; P363-Y388 VanDerWaalsContact CG-CD2 3.47Å; P363-Y388 HydrophobicContact CG-CE1 3.46Å; P363-Y388 VanDerWaalsContact CG-CE1 3.46Å; P363-Y388 HydrophobicContact CG-CE2 3.6Å; P363-Y388 HydrophobicContact CG-CG 3.33Å; P363-Y821 VanDerWaalsContact C-CZ 3.45Å; P363-Y821 VanDerWaalsContact C-OH 3.26Å; P363-Y821 WeakPolarHBondContact CA-OH 3.31Å
364	P	89.8	Confident	82.8	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-70.3	153.1	177.8	25.1	-27.5	0	0	0	111.2	M10 W326 Y821 F823	M10-P364 HydrophobicContact CE-CG 4.32Å; M10-P364 HydrophobicContact CG-CG 4.26Å; M10-P364 WeakPolarHBondContact CG-O 3.24Å; W326-P364 HydrophobicContact CB-CG 3.85Å; W326-P364 HydrophobicContact CD2-CG 4.21Å; W326-P364 HydrophobicContact CG-CG 3.84Å; P364-Y821 HydrophobicContact CB-CD2 3.88Å; P364-Y821 HydrophobicContact CB-CE2 3.37Å; P364-Y821 WeakPolarHBondContact CD-OH 3.37Å; P364-Y821 HydrophobicContact CG-CE2 4.08Å; P364-Y821 VanDerWaalsContact N-OH 3.09Å; P364-F823 HydrophobicContact CB-CB 3.98Å; P364-F823 HydrophobicContact CB-CD2 3.94Å; P364-F823 HydrophobicContact CB-CG 4.48Å; P364-F823 HydrophobicContact CG-CD2 3.66Å; P364-F823 HydrophobicContact CG-CE2 4.41Å
365	T	88.9	Confident	82.8	Confident	12 Å²	12	69 Å²	69	7%	0.074	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-95.6	126.7	174.6	60.3	0	0	0	0	111.9	V385 G386 Y821 F823	T365-V385 WeakPolarHBondContact OG1-CG1 3.44Å; T365-G386 WeakPolarHBondContact CG2-O 3.39Å; T365-G386 PolarHBondContact OG1-O 2.95Å; T365-Y821 PolarHBondContact N-O 3.49Å; T365-Y821 PolarHBondContact OG1-O 3.15Å; T365-F823 VanDerWaalsContact O-CB 3.3Å; T365-F823 WeakPolarHBondContact O-CB 3.08Å; T365-F823 PolarHBondContact O-N 3.37Å
366	F	88.6	Confident	82.9	Confident	42 Å²	42	66.1 Å²	66.1	18%	0.184	35%	0.352	C	S	.	.			trans	-127.3	129.4	175.8	-179.9	-124.8	0	0	0	110.4	S7 E8 M10 P328 R368 F823	S7-F366 WeakPolarHBondContact CA-O 3.36Å; E8-F366 HydrophobicContact CB-CD1 4.19Å; E8-F366 HydrophobicContact CG-CD1 3.85Å; E8-F366 HydrophobicContact CG-CE1 4.49Å; E8-F366 PolarHBondContact N-O 2.91Å; M10-F366 HydrophobicContact CE-CB 3.1Å; M10-F366 HydrophobicContact CE-CD1 4.26Å; M10-F366 HydrophobicContact CE-CG 3.97Å; P328-F366 HydrophobicContact CG-CD1 3.83Å; P328-F366 HydrophobicContact CG-CE1 4Å; F366-R368 HydrophobicContact CE1-CG 3.86Å; F366-R368 HydrophobicContact CZ-CG 4.19Å; F366-F823 HydrophobicContact CB-CB 3.77Å; F366-F823 HydrophobicContact CB-CD1 3.94Å; F366-F823 HydrophobicContact CB-CG 3.99Å; F366-F823 HydrophobicContact CD2-CB 4.25Å; F366-F823 AromaticContact CD2-CD1 3.45Å; F366-F823 HydrophobicContact CD2-CD1 3.45Å; F366-F823 VanDerWaalsContact CD2-CD1 3.45Å; F366-F823 HydrophobicContact CD2-CE1 4.22Å; F366-F823 HydrophobicContact CD2-CG 4.24Å; F366-F823 HydrophobicContact CE2-CD1 4.02Å; F366-F823 HydrophobicContact CE2-CE1 4.46Å; F366-F823 HydrophobicContact CG-CB 4.4Å; F366-F823 AromaticContact CG-CD1 3.75Å; F366-F823 HydrophobicContact CG-CD1 3.75Å; F366-F823 HydrophobicContact CG-CE1 4.38Å; F366-F823 HydrophobicContact CG-CG 4.31Å
367	N	85.9	Confident	83.3	Confident	29 Å²	29	61.9 Å²	61.9	16%	0.155	33%	0.326	C	S	.	.			trans	-119.6	127.5	174	-62.5	-26.7	0	0	0	107.4	S7 T369 Q377 N392	S7-N367 VanDerWaalsContact CA-OD1 3.28Å; S7-N367 WeakPolarHBondContact CA-OD1 3.44Å; N367-T369 PolarHBondContact O-N 3.25Å; N367-T369 VanDerWaalsContact O-N 3.11Å; N367-Q377 PolarHBondContact ND2-NE2 3.15Å; N367-Q377 VanDerWaalsContact ND2-NE2 3.11Å; N367-N392 PolarHBondContact ND2-ND2 2.95Å
368	R	83.6	Confident	83.5	Confident	89 Å²	89	63.7 Å²	63.7	34%	0.336	33%	0.334	S	S	.	.			trans	-71.3	110.7	176.7	-72.6	-173.3	-171	-168.2	5.8	109.9	E8 D331 F366	E8-R368 WeakPolarHBondContact OE1-CD 3.47Å; E8-R368 VanDerWaalsContact OE1-CG 3.28Å; E8-R368 WeakPolarHBondContact OE1-CG 3.43Å; E8-R368 IonicContact OE1-CZ 3.79Å; E8-R368 IonicContact OE1-NE 2.72Å; E8-R368 PolarHBondContact OE1-NE 3.01Å; E8-R368 IonicContact OE1-NH2 3.98Å; E8-R368 IonicContact OE2-CZ 2.72Å; E8-R368 IonicContact OE2-NE 3.63Å; E8-R368 PolarHBondContact OE2-NE 3.08Å; E8-R368 IonicContact OE2-NH2 3.98Å; E8-R368 PolarHBondContact OE2-NH2 3.03Å; D331-R368 IonicContact OD2-CZ 2.79Å; D331-R368 IonicContact OD2-NH2 2.89Å; D331-R368 PolarHBondContact OD2-NH2 3.22Å; F366-R368 HydrophobicContact CE1-CG 3.86Å; F366-R368 HydrophobicContact CZ-CG 4.19Å
369	T	82	Confident	84.3	Confident	67 Å²	67	56 Å²	56	41%	0.411	30%	0.299	S	S	.	.			trans	-93.9	129.1	176.7	55	0	0	0	0	111	N367 Q377	N367-T369 PolarHBondContact O-N 3.25Å; N367-T369 VanDerWaalsContact O-N 3.11Å; T369-Q377 HydrophobicContact CG2-CB 3.78Å; T369-Q377 HydrophobicContact CG2-CG 3.84Å
370	N	84.5	Confident	85.1	Confident	118 Å²	118	53.6 Å²	53.6	63%	0.631	28%	0.282	S	S	*	.			trans	-84.7	166.3	162.1	-72.6	-19.8	0	0	0	110	F372 T373 A374	N370-F372 PolarHBondContact O-N 2.79Å; N370-T373 PolarHBondContact O-N 3.19Å; N370-A374 WeakPolarHBondContact O-CB 3.48Å; N370-A374 PolarHBondContact O-N 3.37Å
371	K	81.8	Confident	85.9	Confident	150 Å²	150	45.6 Å²	45.6	65%	0.652	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-35.1	174.1	-65	-173.6	175.4	-166.4	0	113.5	Y450	K371-Y450 HydrophobicContact CB-CE2 4.45Å; K371-Y450 WeakPolarHBondContact O-CE2 3.38Å
372	F	85.4	Confident	86.5	Confident	75 Å²	75	46 Å²	46	33%	0.329	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-45	177.1	179.8	-100.7	0	0	0	113	N370 F376 I398 Y450 L454	N370-F372 PolarHBondContact O-N 2.79Å; F372-F376 HydrophobicContact CE1-CE2 4.39Å; F372-F376 HydrophobicContact CZ-CE2 4.22Å; F372-I398 HydrophobicContact CE1-CD1 4.36Å; F372-I398 HydrophobicContact CE1-CG2 3.71Å; F372-I398 HydrophobicContact CZ-CG2 4.02Å; F372-Y450 AromaticContact CD2-CD1 3.82Å; F372-Y450 HydrophobicContact CD2-CD1 3.82Å; F372-Y450 HydrophobicContact CD2-CD2 4.39Å; F372-Y450 AromaticContact CD2-CG 3.72Å; F372-Y450 HydrophobicContact CD2-CG 3.72Å; F372-Y450 HydrophobicContact CE2-CD1 4.39Å; F372-Y450 HydrophobicContact CE2-CG 4.36Å; F372-L454 HydrophobicContact CE2-CD1 4.11Å; F372-L454 HydrophobicContact CZ-CD1 3.6Å; F372-L454 HydrophobicContact CZ-CG 4.47Å
373	T	85.8	Confident	86.9	Confident	13 Å²	13	47.5 Å²	47.5	8%	0.08	25%	0.25	C	C	.	.	H	α-helix	trans	-80.3	-21.9	-174	-49	0	0	0	0	113.1	V4 N370 G375 F376 Q377 I398	V4-T373 HydrophobicContact CG1-CG2 4.36Å; N370-T373 PolarHBondContact O-N 3.19Å; T373-G375 PolarHBondContact O-N 3.3Å; T373-F376 PolarHBondContact O-N 2.91Å; T373-Q377 PolarHBondContact O-N 2.99Å; T373-I398 HydrophobicContact CG2-CD1 4.24Å
374	A	84.4	Confident	86.9	Confident	29 Å²	29	47.3 Å²	47.3	24%	0.24	25%	0.251	C	S	.	.	H	α-helix	trans	-56.1	-44.8	-176.6	0	0	0	0	0	113.2	N370 F376 Q377 N378	N370-A374 WeakPolarHBondContact O-CB 3.48Å; N370-A374 PolarHBondContact O-N 3.37Å; A374-F376 PolarHBondContact O-N 2.8Å; A374-Q377 PolarHBondContact O-N 2.91Å; A374-N378 VanDerWaalsContact O-CG 3.26Å; A374-N378 PolarHBondContact O-N 3.39Å; A374-N378 PolarHBondContact O-OD1 2.9Å
375	G	85.1	Confident	86.8	Confident	17 Å²	17	48.6 Å²	48.6	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-41.5	178.6	0	0	0	0	0	113	T373 I379	T373-G375 PolarHBondContact O-N 3.3Å; G375-I379 WeakPolarHBondContact O-CG1 3.42Å; G375-I379 PolarHBondContact O-N 3.14Å
376	F	87.4	Confident	86.6	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-71.1	-36.8	177.4	-65.1	-81.3	0	0	0	112.4	F372 T373 A374 I379 V380 I398 P402 L451 L454	F372-F376 HydrophobicContact CE1-CE2 4.39Å; F372-F376 HydrophobicContact CZ-CE2 4.22Å; T373-F376 PolarHBondContact O-N 2.91Å; A374-F376 PolarHBondContact O-N 2.8Å; F376-I379 PolarHBondContact O-N 3.04Å; F376-V380 WeakPolarHBondContact O-CG2 3.17Å; F376-V380 PolarHBondContact O-N 3.02Å; F376-I398 HydrophobicContact CB-CG1 4.04Å; F376-I398 HydrophobicContact CD1-CG1 4.25Å; F376-I398 HydrophobicContact CD2-CG1 3.78Å; F376-I398 HydrophobicContact CE2-CG1 4.28Å; F376-I398 HydrophobicContact CG-CG1 3.76Å; F376-P402 HydrophobicContact CE1-CG 4.22Å; F376-L451 HydrophobicContact CD1-CD1 4.09Å; F376-L451 HydrophobicContact CE1-CB 4.05Å; F376-L451 HydrophobicContact CE1-CD1 3.83Å; F376-L451 HydrophobicContact CE1-CG 4.04Å; F376-L451 HydrophobicContact CE2-CB 4.42Å; F376-L451 HydrophobicContact CZ-CB 3.84Å; F376-L451 HydrophobicContact CZ-CD1 4.46Å; F376-L451 HydrophobicContact CZ-CG 4.3Å; F376-L454 HydrophobicContact CE2-CD1 4.14Å; F376-L454 HydrophobicContact CZ-CD1 3.64Å
377	Q	89.5	Confident	86.6	Confident	7 Å²	7	48 Å²	48	3%	0.033	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-44.7	176.4	-171.6	65.1	41.7	0	0	110.8	N367 T369 T373 A374 I379 V380 D381 N392	N367-Q377 PolarHBondContact ND2-NE2 3.15Å; N367-Q377 VanDerWaalsContact ND2-NE2 3.11Å; T369-Q377 HydrophobicContact CG2-CB 3.78Å; T369-Q377 HydrophobicContact CG2-CG 3.84Å; T373-Q377 PolarHBondContact O-N 2.99Å; A374-Q377 PolarHBondContact O-N 2.91Å; Q377-I379 VanDerWaalsContact C-N 3.26Å; Q377-I379 PolarHBondContact O-N 3.25Å; Q377-V380 PolarHBondContact O-N 3.11Å; Q377-D381 PolarHBondContact NE2-OD1 3.31Å; Q377-D381 WeakPolarHBondContact O-CB 3.37Å; Q377-D381 VanDerWaalsContact O-CG 3.3Å; Q377-D381 PolarHBondContact O-N 3.49Å; Q377-N392 PolarHBondContact OE1-ND2 3.41Å
378	N	88.2	Confident	86.7	Confident	82 Å²	82	49.4 Å²	49.4	44%	0.439	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-35.8	178.7	-70.8	-8.6	0	0	0	112.4	A374 V380 A382	A374-N378 VanDerWaalsContact O-CG 3.26Å; A374-N378 PolarHBondContact O-N 3.39Å; A374-N378 PolarHBondContact O-OD1 2.9Å; N378-V380 VanDerWaalsContact C-N 3.34Å; N378-A382 VanDerWaalsContact O-CB 3.32Å; N378-A382 WeakPolarHBondContact O-CB 3.41Å; N378-A382 PolarHBondContact O-N 2.99Å
379	I	89.8	Confident	86.8	Confident	38 Å²	38	48.6 Å²	48.6	20%	0.195	26%	0.263	C	S	.	.	H	α-helix	trans	-67.5	-35.2	175.3	-69.7	169.7	0	0	0	112	G375 F376 Q377 L451 F800 L804 W808	G375-I379 WeakPolarHBondContact O-CG1 3.42Å; G375-I379 PolarHBondContact O-N 3.14Å; F376-I379 PolarHBondContact O-N 3.04Å; Q377-I379 VanDerWaalsContact C-N 3.26Å; Q377-I379 PolarHBondContact O-N 3.25Å; I379-L451 HydrophobicContact CD1-CD1 3.25Å; I379-F800 HydrophobicContact CD1-CE2 4.49Å; I379-F800 HydrophobicContact CD1-CZ 4.22Å; I379-L804 HydrophobicContact CG2-CD1 3.74Å; I379-L804 HydrophobicContact CG2-CG 4.34Å; I379-W808 WeakPolarHBondContact O-CZ2 3.28Å; I379-W808 PolarHBondContact O-NE1 3.41Å; I379-W808 VanDerWaalsContact O-NE1 3.17Å
380	V	89.5	Confident	87.1	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-72.6	-47.4	175.9	173.6	0	0	0	0	110.1	F376 Q377 N378 A382 Y383 P393 A394 T397	F376-V380 WeakPolarHBondContact O-CG2 3.17Å; F376-V380 PolarHBondContact O-N 3.02Å; Q377-V380 PolarHBondContact O-N 3.11Å; N378-V380 VanDerWaalsContact C-N 3.34Å; V380-A382 PolarHBondContact O-N 3.07Å; V380-Y383 PolarHBondContact O-N 3.32Å; V380-Y383 VanDerWaalsContact O-N 3.13Å; V380-P393 HydrophobicContact CG1-CB 4.2Å; V380-P393 HydrophobicContact CG1-CG 3.98Å; V380-P393 HydrophobicContact CG2-CB 4.4Å; V380-A394 HydrophobicContact CG2-CB 4.26Å; V380-T397 HydrophobicContact CG2-CG2 4.11Å
381	D	88.3	Confident	87.3	Confident	29 Å²	29	40.6 Å²	40.6	16%	0.155	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-27.2	179.6	-67.9	-4	0	0	0	112.5	Q377 Y383 G384 K822	Q377-D381 PolarHBondContact NE2-OD1 3.31Å; Q377-D381 WeakPolarHBondContact O-CB 3.37Å; Q377-D381 VanDerWaalsContact O-CG 3.3Å; Q377-D381 PolarHBondContact O-N 3.49Å; D381-Y383 VanDerWaalsContact C-N 3.28Å; D381-Y383 PolarHBondContact O-N 3.28Å; D381-G384 WeakPolarHBondContact CA-O 3.41Å; D381-G384 CarbonylContact O-C 3.27Å; D381-G384 PolarHBondContact O-N 2.96Å; D381-K822 IonicContact OD2-NZ 2.66Å
382	A	88.7	Confident	87.7	Confident	71 Å²	71	33.9 Å²	33.9	59%	0.587	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.4	177.2	0	0	0	0	0	113.9	N378 V380 W808	N378-A382 VanDerWaalsContact O-CB 3.32Å; N378-A382 WeakPolarHBondContact O-CB 3.41Å; N378-A382 PolarHBondContact O-N 2.99Å; V380-A382 PolarHBondContact O-N 3.07Å; A382-W808 HydrophobicContact CB-CH2 4.48Å; A382-W808 HydrophobicContact CB-CZ2 4.17Å
383	Y	89.4	Confident	87.8	Confident	104 Å²	104	30.3 Å²	30.3	41%	0.408	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-39.7	173.2	-178	-112.8	0	0	0	111.8	V380 D381 W808 Q812 Y816	V380-Y383 PolarHBondContact O-N 3.32Å; V380-Y383 VanDerWaalsContact O-N 3.13Å; D381-Y383 VanDerWaalsContact C-N 3.28Å; D381-Y383 PolarHBondContact O-N 3.28Å; Y383-W808 HydrophobicContact CD2-CB 3.65Å; Y383-W808 AromaticContact CD2-CD2 3.78Å; Y383-W808 HydrophobicContact CD2-CD2 3.78Å; Y383-W808 AromaticContact CD2-CE3 3.94Å; Y383-W808 HydrophobicContact CD2-CE3 3.94Å; Y383-W808 AromaticContact CD2-CG 3.69Å; Y383-W808 HydrophobicContact CD2-CG 3.69Å; Y383-W808 HydrophobicContact CE2-CB 3.86Å; Y383-W808 HydrophobicContact CE2-CG 4.4Å; Y383-W808 HydrophobicContact CG-CB 4.03Å; Y383-W808 AromaticContact CG-CD1 4Å; Y383-W808 HydrophobicContact CG-CD2 4.11Å; Y383-W808 AromaticContact CG-CG 3.82Å; Y383-W808 HydrophobicContact CG-CG 3.82Å; Y383-Q812 HydrophobicContact CE1-CB 4.5Å; Y383-Y816 HydrophobicContact CD1-CD1 4.48Å; Y383-Y816 HydrophobicContact CD1-CE1 4.42Å
384	G	87.6	Confident	87.9	Confident	17 Å²	17	29.7 Å²	29.7	18%	0.175	17%	0.17	C	C	.	.			trans	178	162.5	179.6	0	0	0	0	0	109.2	D381 Y816	D381-G384 WeakPolarHBondContact CA-O 3.41Å; D381-G384 CarbonylContact O-C 3.27Å; D381-G384 PolarHBondContact O-N 2.96Å; G384-Y816 PolarHBondContact O-OH 3.41Å
385	V	88.1	Confident	88.2	Confident	26 Å²	26	29.5 Å²	29.5	16%	0.158	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-96.2	134.2	176.7	179.5	0	0	0	0	108.8	T365 G818 G820 K822	T365-V385 WeakPolarHBondContact OG1-CG1 3.44Å; V385-G818 CarbonylContact O-C 3.57Å; V385-G818 WeakPolarHBondContact O-CA 3.45Å; V385-G818 VanDerWaalsContact O-O 3.07Å; V385-G820 WeakPolarHBondContact O-CA 3.5Å; V385-G820 PolarHBondContact O-N 2.79Å; V385-K822 HydrophobicContact CG1-CB 4.21Å; V385-K822 HydrophobicContact CG2-CB 4.03Å
386	G	85.8	Confident	88.4	Confident	13 Å²	13	31.4 Å²	31.4	13%	0.134	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-65.9	148.3	-172.4	0	0	0	0	0	110.6	T365 Y816 G820	T365-G386 WeakPolarHBondContact CG2-O 3.39Å; T365-G386 PolarHBondContact OG1-O 2.95Å; G386-Y816 WeakPolarHBondContact CA-OH 3.39Å; G386-Y816 PolarHBondContact N-OH 3.28Å; G386-G820 WeakPolarHBondContact O-CA 3.4Å
387	S	87.3	Confident	88.6	Confident	30 Å²	30	31.7 Å²	31.7	21%	0.21	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-69.8	158.5	173.6	68.5	0	0	0	0	111	R389 E390	S387-R389 PolarHBondContact O-N 3.4Å; S387-E390 WeakPolarHBondContact CB-OE2 3.45Å; S387-E390 PolarHBondContact N-OE2 3.38Å; S387-E390 WeakPolarHBondContact O-CB 3.16Å; S387-E390 PolarHBondContact O-N 3.2Å; S387-E390 VanDerWaalsContact O-N 3.1Å; S387-E390 WeakPolarHBondContact OG-CB 3.28Å; S387-E390 VanDerWaalsContact OG-CD 3.26Å; S387-E390 PolarHBondContact OG-OE2 3.07Å
388	Y	88.1	Confident	88.6	Confident	57 Å²	57	32.5 Å²	32.5	22%	0.224	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	125.8	-174.7	-179	-113.4	0	0	0	112.8	E8 E9 M10 P363 E390 F566	E8-Y388 VanDerWaalsContact O-CE2 3.22Å; E8-Y388 WeakPolarHBondContact O-CE2 3.3Å; E9-Y388 VanDerWaalsContact CA-OH 3.31Å; E9-Y388 WeakPolarHBondContact CA-OH 3.24Å; M10-Y388 HydrophobicContact CB-CE2 4.05Å; M10-Y388 HydrophobicContact CG-CE2 4.07Å; M10-Y388 PolarHBondContact N-OH 3.22Å; P363-Y388 HydrophobicContact CB-CD2 4.2Å; P363-Y388 HydrophobicContact CB-CE2 4.14Å; P363-Y388 HydrophobicContact CB-CG 4.47Å; P363-Y388 HydrophobicContact CG-CD1 3.34Å; P363-Y388 HydrophobicContact CG-CD2 3.47Å; P363-Y388 VanDerWaalsContact CG-CD2 3.47Å; P363-Y388 HydrophobicContact CG-CE1 3.46Å; P363-Y388 VanDerWaalsContact CG-CE1 3.46Å; P363-Y388 HydrophobicContact CG-CE2 3.6Å; P363-Y388 HydrophobicContact CG-CG 3.33Å; Y388-E390 PolarHBondContact O-N 3.4Å; Y388-F566 WeakPolarHBondContact O-CZ 3.38Å
389	R	87.1	Confident	88.9	Confident	72 Å²	72	32.8 Å²	32.8	27%	0.272	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	18.3	-176.6	-52.8	-175.7	77.8	-174.4	1.8	115.4	R6 S7 E9 S387 Y565	R6-R389 PolarHBondContact NH1-O 2.96Å; S7-R389 VanDerWaalsContact OG-CA 3.29Å; S7-R389 WeakPolarHBondContact OG-CA 3.32Å; S7-R389 PolarHBondContact OG-N 2.96Å; E9-R389 IonicContact OE1-CZ 3.35Å; E9-R389 IonicContact OE1-NE 3.49Å; E9-R389 IonicContact OE1-NH1 3.68Å; E9-R389 PolarHBondContact OE1-NH1 3.41Å; E9-R389 IonicContact OE1-NH2 3.78Å; E9-R389 PolarHBondContact OE1-NH2 2.92Å; S387-R389 PolarHBondContact O-N 3.4Å; R389-Y565 HydrophobicContact CB-CE1 3.73Å; R389-Y565 PolarHBondContact NE-OH 3.27Å; R389-Y565 PolarHBondContact NH2-OH 2.95Å
390	E	87.7	Confident	89	Confident	8 Å²	8	32.7 Å²	32.7	4%	0.037	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-68.3	157.2	166.6	-165.1	166.1	-159.7	0	0	111.4	R6 S387 Y388 N392 Y816 V817	R6-E390 WeakPolarHBondContact CA-O 3.34Å; S387-E390 WeakPolarHBondContact CB-OE2 3.45Å; S387-E390 PolarHBondContact N-OE2 3.38Å; S387-E390 WeakPolarHBondContact O-CB 3.16Å; S387-E390 PolarHBondContact O-N 3.2Å; S387-E390 VanDerWaalsContact O-N 3.1Å; S387-E390 WeakPolarHBondContact OG-CB 3.28Å; S387-E390 VanDerWaalsContact OG-CD 3.26Å; S387-E390 PolarHBondContact OG-OE2 3.07Å; Y388-E390 PolarHBondContact O-N 3.4Å; E390-N392 PolarHBondContact O-N 3.33Å; E390-Y816 VanDerWaalsContact OE1-CA 3.29Å; E390-Y816 WeakPolarHBondContact OE1-CA 3.28Å; E390-V817 PolarHBondContact OE1-N 3.47Å
391	I	89	Confident	89.2	Confident	10 Å²	10	32.9 Å²	32.9	5%	0.051	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-67.7	125.2	172.4	-69.7	163.4	0	0	0	109.4	F5 R6 P393 Y396 F561 N562	F5-I391 WeakPolarHBondContact O-CA 3.38Å; R6-I391 HydrophobicContact CG-CG1 4.39Å; I391-P393 WeakPolarHBondContact O-CD 3.33Å; I391-Y396 HydrophobicContact CG2-CE2 4.06Å; I391-F561 HydrophobicContact CD1-CB 3.39Å; I391-N562 VanDerWaalsContact CD1-OD1 3.28Å; I391-N562 WeakPolarHBondContact CD1-OD1 3.39Å; I391-N562 WeakPolarHBondContact CG1-OD1 3.43Å; I391-N562 PolarHBondContact N-OD1 3.42Å; I391-N562 VanDerWaalsContact N-OD1 3.1Å
392	N	88.8	Confident	89.5	Confident	9 Å²	9	31.5 Å²	31.5	5%	0.048	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-74.8	126.9	175	-173.8	2	0	0	0	109.8	V4 F5 N367 Q377 E390 A394 P395	V4-N392 WeakPolarHBondContact O-CB 3.48Å; V4-N392 PolarHBondContact O-ND2 3.39Å; F5-N392 PolarHBondContact O-N 3.38Å; N367-N392 PolarHBondContact ND2-ND2 2.95Å; Q377-N392 PolarHBondContact OE1-ND2 3.41Å; E390-N392 PolarHBondContact O-N 3.33Å; N392-A394 PolarHBondContact O-N 3.07Å; N392-A394 VanDerWaalsContact OD1-CB 3.3Å; N392-A394 WeakPolarHBondContact OD1-CB 3.3Å; N392-A394 PolarHBondContact OD1-N 3.03Å; N392-P395 VanDerWaalsContact O-CD 3.25Å; N392-P395 WeakPolarHBondContact O-CD 3.06Å
393	P	88.4	Confident	89.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-65.5	-24.1	171.8	-19.9	30.5	0	0	0	113.9	V380 I391 P395 Y396 T397 Q812 F815 Y816	V380-P393 HydrophobicContact CG1-CB 4.2Å; V380-P393 HydrophobicContact CG1-CG 3.98Å; V380-P393 HydrophobicContact CG2-CB 4.4Å; I391-P393 WeakPolarHBondContact O-CD 3.33Å; P393-P395 VanDerWaalsContact C-CD 3.48Å; P393-Y396 PolarHBondContact O-N 3.34Å; P393-T397 HydrophobicContact CB-CG2 4.34Å; P393-T397 PolarHBondContact O-N 3.43Å; P393-Q812 HydrophobicContact CB-CG 4.36Å; P393-Q812 HydrophobicContact CG-CG 4.13Å; P393-F815 HydrophobicContact CB-CE2 4.44Å; P393-F815 HydrophobicContact CB-CZ 4.05Å; P393-F815 HydrophobicContact CG-CE2 3.85Å; P393-F815 HydrophobicContact CG-CZ 3.85Å; P393-Y816 HydrophobicContact CG-CD2 3.71Å; P393-Y816 HydrophobicContact CG-CE2 3.97Å; P393-Y816 HydrophobicContact CG-CG 4.31Å
394	A	88.1	Confident	90	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-55.1	-42.4	-168.4	0	0	0	0	0	115.8	V380 N392 Y396 T397 I398	V380-A394 HydrophobicContact CG2-CB 4.26Å; N392-A394 PolarHBondContact O-N 3.07Å; N392-A394 VanDerWaalsContact OD1-CB 3.3Å; N392-A394 WeakPolarHBondContact OD1-CB 3.3Å; N392-A394 PolarHBondContact OD1-N 3.03Å; A394-Y396 PolarHBondContact O-N 3.42Å; A394-T397 WeakPolarHBondContact CA-OG1 3.44Å; A394-T397 PolarHBondContact O-N 3.47Å; A394-T397 PolarHBondContact O-OG1 3.39Å; A394-I398 VanDerWaalsContact O-CG1 3.3Å; A394-I398 WeakPolarHBondContact O-CG1 3.4Å; A394-I398 PolarHBondContact O-N 2.96Å; A394-I398 VanDerWaalsContact O-N 3.08Å
395	P	89.5	Confident	90.3	Very high	25 Å²	25	25.3 Å²	25.3	16%	0.162	13%	0.127	C	C	.	.	H	α-helix	trans	-56.3	-36.9	175.9	-24.5	33.5	0	0	0	113.6	V4 F5 N392 P393	V4-P395 HydrophobicContact CB-CG 4.47Å; V4-P395 HydrophobicContact CG1-CG 3.86Å; V4-P395 WeakPolarHBondContact O-CG 3.43Å; F5-P395 HydrophobicContact CD1-CG 4.33Å; F5-P395 HydrophobicContact CE1-CB 4.35Å; N392-P395 VanDerWaalsContact O-CD 3.25Å; N392-P395 WeakPolarHBondContact O-CD 3.06Å; P393-P395 VanDerWaalsContact C-CD 3.48Å
396	Y	90.4	Very high	90.6	Very high	57 Å²	57	24 Å²	24	22%	0.224	12%	0.12	C	C	.	.	H	α-helix	trans	-78.1	-42.4	-179.4	-53.2	-62	0	0	0	110.5	I391 P393 A394 I398 I399 T400 F554 L558	I391-Y396 HydrophobicContact CG2-CE2 4.06Å; P393-Y396 PolarHBondContact O-N 3.34Å; A394-Y396 PolarHBondContact O-N 3.42Å; Y396-I398 PolarHBondContact O-N 2.8Å; Y396-I399 PolarHBondContact O-N 2.93Å; Y396-I399 VanDerWaalsContact O-N 3.13Å; Y396-T400 PolarHBondContact O-N 3.45Å; Y396-T400 PolarHBondContact O-OG1 2.97Å; Y396-F554 AromaticContact CD1-CE1 3.87Å; Y396-F554 HydrophobicContact CD1-CE1 3.87Å; Y396-F554 AromaticContact CD1-CZ 3.58Å; Y396-F554 HydrophobicContact CD1-CZ 3.58Å; Y396-F554 HydrophobicContact CE1-CE1 4.35Å; Y396-F554 AromaticContact CE1-CZ 3.63Å; Y396-F554 HydrophobicContact CE1-CZ 3.63Å; Y396-F554 AromaticContact CG-CE1 3.96Å; Y396-F554 HydrophobicContact CG-CE1 3.96Å; Y396-F554 HydrophobicContact CG-CZ 4.08Å; Y396-L558 HydrophobicContact CD2-CD1 3.84Å; Y396-L558 HydrophobicContact CE2-CD1 3.7Å; Y396-L558 HydrophobicContact CE2-CD2 3.78Å; Y396-L558 HydrophobicContact CE2-CG 4.43Å
397	T	90.6	Very high	91	Very high	10 Å²	10	23.5 Å²	23.5	6%	0.061	11%	0.114	C	C	.	.	H	α-helix	trans	-61.4	-30.2	178.5	63.1	0	0	0	0	112.3	V380 P393 A394 I399 F401 P402	V380-T397 HydrophobicContact CG2-CG2 4.11Å; P393-T397 HydrophobicContact CB-CG2 4.34Å; P393-T397 PolarHBondContact O-N 3.43Å; A394-T397 WeakPolarHBondContact CA-OG1 3.44Å; A394-T397 PolarHBondContact O-N 3.47Å; A394-T397 PolarHBondContact O-OG1 3.39Å; T397-I399 PolarHBondContact O-N 3.13Å; T397-F401 WeakPolarHBondContact O-CB 3.3Å; T397-F401 PolarHBondContact O-N 2.89Å; T397-P402 WeakPolarHBondContact O-CD 3.43Å
398	I	91.3	Very high	91.3	Very high	23 Å²	23	22.1 Å²	22.1	12%	0.118	10%	0.104	C	C	.	.	H	α-helix	trans	-49.7	-37.6	174.8	-71.2	164.9	0	0	0	112.6	F372 T373 F376 A394 Y396 P402 L454	F372-I398 HydrophobicContact CE1-CD1 4.36Å; F372-I398 HydrophobicContact CE1-CG2 3.71Å; F372-I398 HydrophobicContact CZ-CG2 4.02Å; T373-I398 HydrophobicContact CG2-CD1 4.24Å; F376-I398 HydrophobicContact CB-CG1 4.04Å; F376-I398 HydrophobicContact CD1-CG1 4.25Å; F376-I398 HydrophobicContact CD2-CG1 3.78Å; F376-I398 HydrophobicContact CE2-CG1 4.28Å; F376-I398 HydrophobicContact CG-CG1 3.76Å; A394-I398 VanDerWaalsContact O-CG1 3.3Å; A394-I398 WeakPolarHBondContact O-CG1 3.4Å; A394-I398 PolarHBondContact O-N 2.96Å; A394-I398 VanDerWaalsContact O-N 3.08Å; Y396-I398 PolarHBondContact O-N 2.8Å; I398-P402 VanDerWaalsContact O-CD 3.31Å; I398-P402 WeakPolarHBondContact O-CD 3.46Å; I398-P402 WeakPolarHBondContact O-CG 3.22Å; I398-L454 HydrophobicContact CG2-CD1 4.13Å
399	I	92.6	Very high	91.5	Very high	89 Å²	89	19.4 Å²	19.4	46%	0.456	9%	0.093	S	C	.	.	H	α-helix	trans	-105.1	-45.2	-178.3	-60.2	-59.7	0	0	0	111.9	Y396 T397 F401 F403 F458	Y396-I399 PolarHBondContact O-N 2.93Å; Y396-I399 VanDerWaalsContact O-N 3.13Å; T397-I399 PolarHBondContact O-N 3.13Å; I399-F401 VanDerWaalsContact C-N 3.31Å; I399-F401 PolarHBondContact O-N 3.45Å; I399-F403 VanDerWaalsContact O-CB 3.27Å; I399-F403 WeakPolarHBondContact O-CB 3.35Å; I399-F403 PolarHBondContact O-N 3.07Å; I399-F458 HydrophobicContact CD1-CE2 4.46Å; I399-F458 HydrophobicContact CD1-CZ 4.34Å; I399-F458 HydrophobicContact CG2-CZ 4.09Å
400	T	92.9	Very high	91.6	Very high	36 Å²	36	16.3 Å²	16.3	22%	0.221	8%	0.083	C	C	.	.	H	α-helix	trans	-68.7	-32.6	-174.8	60.9	0	0	0	0	112.1	Y396 F403 L404 H807	Y396-T400 PolarHBondContact O-N 3.45Å; Y396-T400 PolarHBondContact O-OG1 2.97Å; T400-F403 PolarHBondContact O-N 2.65Å; T400-L404 WeakPolarHBondContact O-CG 3.4Å; T400-L404 PolarHBondContact O-N 3.02Å; T400-H807 PolarHBondContact OG1-NE2 3.09Å
401	F	93.6	Very high	91.8	Very high	4 Å²	4	16.1 Å²	16.1	2%	0.018	8%	0.083	C	C	.	.	H	α-helix	trans	-67.4	-56.3	-179.6	174.9	-90.3	0	0	0	112.5	T397 I399 F403 L404 F405 L451 M455 F800 A803 L804 H807	T397-F401 WeakPolarHBondContact O-CB 3.3Å; T397-F401 PolarHBondContact O-N 2.89Å; I399-F401 VanDerWaalsContact C-N 3.31Å; I399-F401 PolarHBondContact O-N 3.45Å; F401-F403 PolarHBondContact O-N 3.42Å; F401-L404 PolarHBondContact O-N 3.08Å; F401-F405 PolarHBondContact O-N 3.46Å; F401-F405 VanDerWaalsContact O-N 3.08Å; F401-L451 HydrophobicContact CD1-CD1 4.01Å; F401-L451 HydrophobicContact CD1-CG 4.38Å; F401-L451 HydrophobicContact CE1-CD1 3.75Å; F401-L451 HydrophobicContact CE1-CD2 4.19Å; F401-L451 HydrophobicContact CE1-CG 4.06Å; F401-M455 HydrophobicContact CE1-SD 4.13Å; F401-F800 AromaticContact CE1-CD2 3.74Å; F401-F800 HydrophobicContact CE1-CD2 3.74Å; F401-F800 AromaticContact CE1-CE2 3.58Å; F401-F800 HydrophobicContact CE1-CE2 3.58Å; F401-F800 HydrophobicContact CE2-CE2 4.45Å; F401-F800 AromaticContact CZ-CD2 3.34Å; F401-F800 HydrophobicContact CZ-CD2 3.34Å; F401-F800 AromaticContact CZ-CE2 3.29Å; F401-F800 HydrophobicContact CZ-CE2 3.29Å; F401-F800 HydrophobicContact CZ-CG 4.14Å; F401-F800 HydrophobicContact CZ-CZ 4.09Å; F401-A803 HydrophobicContact CD2-CB 4.27Å; F401-A803 HydrophobicContact CE2-CB 3.84Å; F401-A803 HydrophobicContact CZ-CB 4.4Å; F401-L804 HydrophobicContact CE2-CB 3.71Å; F401-L804 HydrophobicContact CZ-CB 4.44Å; F401-H807 VanDerWaalsContact CA-CE1 3.41Å; F401-H807 WeakPolarHBondContact CA-CE1 3.15Å; F401-H807 AromaticContact CD2-ND1 3.8Å; F401-H807 PolarHBondContact N-NE2 3.49Å
402	P	94.4	Very high	92	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.6	-31.6	174.6	-28.1	39.4	0	0	0	113.6	F376 T397 I398 A406 L454 M455 F458	F376-P402 HydrophobicContact CE1-CG 4.22Å; T397-P402 WeakPolarHBondContact O-CD 3.43Å; I398-P402 VanDerWaalsContact O-CD 3.31Å; I398-P402 WeakPolarHBondContact O-CD 3.46Å; I398-P402 WeakPolarHBondContact O-CG 3.22Å; P402-A406 VanDerWaalsContact O-CB 3.28Å; P402-A406 WeakPolarHBondContact O-CB 3.39Å; P402-A406 PolarHBondContact O-N 2.97Å; P402-L454 HydrophobicContact CB-CB 3.95Å; P402-L454 HydrophobicContact CG-CB 3.75Å; P402-L454 HydrophobicContact CG-CD1 4.38Å; P402-M455 HydrophobicContact CB-CG 4.07Å; P402-M455 HydrophobicContact CG-CG 4.46Å; P402-F458 HydrophobicContact CB-CD2 3.52Å; P402-F458 HydrophobicContact CB-CE2 4.06Å; P402-F458 HydrophobicContact CB-CG 4.43Å
403	F	94.8	Very high	92.1	Very high	57 Å²	57	16.2 Å²	16.2	25%	0.25	9%	0.085	C	C	.	.	H	α-helix	trans	-67.5	-48.3	177.8	178.5	-101.1	0	0	0	112.8	I399 T400 F401 F405 A406 V407 F458 L547	I399-F403 VanDerWaalsContact O-CB 3.27Å; I399-F403 WeakPolarHBondContact O-CB 3.35Å; I399-F403 PolarHBondContact O-N 3.07Å; T400-F403 PolarHBondContact O-N 2.65Å; F401-F403 PolarHBondContact O-N 3.42Å; F403-F405 VanDerWaalsContact C-N 3.3Å; F403-F405 PolarHBondContact O-N 3.37Å; F403-A406 WeakPolarHBondContact O-CB 3.43Å; F403-A406 PolarHBondContact O-N 3.24Å; F403-A406 VanDerWaalsContact O-N 3.16Å; F403-V407 HydrophobicContact CE1-CG2 4.3Å; F403-V407 HydrophobicContact CZ-CG2 4.3Å; F403-V407 WeakPolarHBondContact O-CG2 3.47Å; F403-V407 PolarHBondContact O-N 3.26Å; F403-V407 VanDerWaalsContact O-N 3.11Å; F403-F458 HydrophobicContact CD2-CD1 4.31Å; F403-L547 HydrophobicContact CE1-CD1 4.1Å; F403-L547 HydrophobicContact CE1-CD2 3.8Å; F403-L547 HydrophobicContact CZ-CD2 4.25Å
404	L	94	Very high	92.2	Very high	5 Å²	5	16.2 Å²	16.2	3%	0.026	9%	0.085	C	C	.	.	H	α-helix	trans	-64.7	-37.6	176.3	-68.8	-174.4	0	0	0	112	T400 F401 A406 V407 M408 Q551 L742 A803 L806	T400-L404 WeakPolarHBondContact O-CG 3.4Å; T400-L404 PolarHBondContact O-N 3.02Å; F401-L404 PolarHBondContact O-N 3.08Å; L404-A406 VanDerWaalsContact C-N 3.31Å; L404-A406 PolarHBondContact O-N 3.5Å; L404-V407 PolarHBondContact O-N 3.39Å; L404-M408 PolarHBondContact O-N 3.3Å; L404-Q551 VanDerWaalsContact CD1-OE1 3.23Å; L404-L742 HydrophobicContact CB-CD2 4.12Å; L404-L742 HydrophobicContact CD2-CD1 4.19Å; L404-L742 HydrophobicContact CD2-CD2 4.11Å; L404-A803 HydrophobicContact CB-CB 4.45Å; L404-L806 HydrophobicContact CD1-CB 4.29Å; L404-L806 HydrophobicContact CD1-CD1 4.28Å
405	F	95	Very high	92.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-56.7	-47.6	171.4	171.7	-97.1	0	0	0	111.1	F401 F403 V407 M408 F409 M418 M455 G796 A799 F800 A803	F401-F405 PolarHBondContact O-N 3.46Å; F401-F405 VanDerWaalsContact O-N 3.08Å; F403-F405 VanDerWaalsContact C-N 3.3Å; F403-F405 PolarHBondContact O-N 3.37Å; F405-V407 VanDerWaalsContact C-N 3.27Å; F405-V407 PolarHBondContact O-N 2.95Å; F405-M408 WeakPolarHBondContact O-CB 3.38Å; F405-M408 PolarHBondContact O-N 3.27Å; F405-M408 VanDerWaalsContact O-N 3.12Å; F405-F409 HydrophobicContact CD1-CB 4.4Å; F405-F409 HydrophobicContact CE1-CB 3.81Å; F405-F409 AromaticContact CE1-CD1 3.98Å; F405-F409 HydrophobicContact CE1-CD1 3.98Å; F405-F409 HydrophobicContact CE1-CG 4.13Å; F405-F409 HydrophobicContact CE2-CB 3.99Å; F405-F409 HydrophobicContact CE2-CG 4.39Å; F405-F409 HydrophobicContact CZ-CB 3.59Å; F405-F409 AromaticContact CZ-CD1 3.84Å; F405-F409 HydrophobicContact CZ-CD1 3.84Å; F405-F409 HydrophobicContact CZ-CD2 4.44Å; F405-F409 AromaticContact CZ-CG 3.7Å; F405-F409 HydrophobicContact CZ-CG 3.7Å; F405-F409 WeakPolarHBondContact O-CB 3.28Å; F405-F409 PolarHBondContact O-N 3.46Å; F405-M418 HydrophobicContact CE1-CE 4.2Å; F405-M418 HydrophobicContact CE1-SD 4.07Å; F405-M418 HydrophobicContact CZ-CE 3.96Å; F405-M418 HydrophobicContact CZ-SD 4.35Å; F405-M455 HydrophobicContact CB-CE 4.49Å; F405-M455 HydrophobicContact CB-CG 4.35Å; F405-M455 HydrophobicContact CD1-CB 3.6Å; F405-M455 HydrophobicContact CD1-CE 3.47Å; F405-M455 VanDerWaalsContact CD1-CE 3.47Å; F405-M455 HydrophobicContact CD1-CG 3.6Å; F405-M455 HydrophobicContact CD1-SD 4.32Å; F405-M455 HydrophobicContact CD2-CE 3.46Å; F405-M455 VanDerWaalsContact CD2-CE 3.46Å; F405-M455 HydrophobicContact CE1-CB 3.78Å; F405-M455 HydrophobicContact CE1-CE 3.38Å; F405-M455 HydrophobicContact CE1-CG 4.15Å; F405-M455 HydrophobicContact CE2-CE 3.35Å; F405-M455 HydrophobicContact CG-CB 4.49Å; F405-M455 HydrophobicContact CG-CE 3.5Å; F405-M455 HydrophobicContact CG-CG 4.02Å; F405-M455 HydrophobicContact CG-SD 4.41Å; F405-M455 HydrophobicContact CZ-CE 3.32Å; F405-G796 WeakPolarHBondContact CE2-O 3.42Å; F405-A799 HydrophobicContact CD2-CB 3.87Å; F405-A799 HydrophobicContact CE2-CB 3.63Å; F405-F800 HydrophobicContact CD2-CB 4.37Å; F405-F800 HydrophobicContact CE2-CB 4.36Å; F405-A803 HydrophobicContact CB-CB 4.21Å
406	A	94.3	Very high	92.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-28.7	-179.5	0	0	0	0	0	113.7	P402 F403 L404 F409 G410 F458 T462	P402-A406 VanDerWaalsContact O-CB 3.28Å; P402-A406 WeakPolarHBondContact O-CB 3.39Å; P402-A406 PolarHBondContact O-N 2.97Å; F403-A406 WeakPolarHBondContact O-CB 3.43Å; F403-A406 PolarHBondContact O-N 3.24Å; F403-A406 VanDerWaalsContact O-N 3.16Å; L404-A406 VanDerWaalsContact C-N 3.31Å; L404-A406 PolarHBondContact O-N 3.5Å; A406-F409 CarbonylContact O-C 3.55Å; A406-F409 VanDerWaalsContact O-C 3.27Å; A406-G410 VanDerWaalsContact O-CA 3.23Å; A406-G410 WeakPolarHBondContact O-CA 3.45Å; A406-G410 PolarHBondContact O-N 2.79Å; A406-G410 VanDerWaalsContact O-N 3.14Å; A406-F458 HydrophobicContact CB-CB 3.56Å; A406-F458 WeakPolarHBondContact CB-O 3.23Å; A406-T462 HydrophobicContact CB-CG2 3.68Å; A406-T462 WeakPolarHBondContact CB-OG1 3.46Å; A406-T462 WeakPolarHBondContact O-CB 3.49Å; A406-T462 PolarHBondContact O-OG1 2.98Å
407	V	93.9	Very high	92.8	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-68.7	-39.6	173.7	171.5	0	0	0	0	111.3	F403 L404 F405 T462 Y466 M543 L547 L742 S746	F403-V407 HydrophobicContact CE1-CG2 4.3Å; F403-V407 HydrophobicContact CZ-CG2 4.3Å; F403-V407 WeakPolarHBondContact O-CG2 3.47Å; F403-V407 PolarHBondContact O-N 3.26Å; F403-V407 VanDerWaalsContact O-N 3.11Å; L404-V407 PolarHBondContact O-N 3.39Å; F405-V407 VanDerWaalsContact C-N 3.27Å; F405-V407 PolarHBondContact O-N 2.95Å; V407-T462 HydrophobicContact CG2-CG2 4.3Å; V407-Y466 PolarHBondContact O-OH 2.77Å; V407-M543 HydrophobicContact CG1-CE 3.94Å; V407-M543 HydrophobicContact CG1-SD 3.86Å; V407-M543 HydrophobicContact CG2-CE 3.86Å; V407-L547 HydrophobicContact CG1-CD1 4.25Å; V407-L547 HydrophobicContact CG2-CD1 3.93Å; V407-L742 HydrophobicContact CG1-CB 4.24Å; V407-L742 HydrophobicContact CG1-CD2 4.42Å; V407-S746 VanDerWaalsContact O-CB 3.27Å; V407-S746 WeakPolarHBondContact O-CB 3.34Å; V407-S746 PolarHBondContact O-OG 3.1Å
408	M	93.9	Very high	92.9	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-70.9	-41	173.4	-72.7	168.7	160.9	0	0	112	L404 F405 R741 L742 L745 S746 A799 H802 L806	L404-M408 PolarHBondContact O-N 3.3Å; F405-M408 WeakPolarHBondContact O-CB 3.38Å; F405-M408 PolarHBondContact O-N 3.27Å; F405-M408 VanDerWaalsContact O-N 3.12Å; M408-R741 HydrophobicContact CE-CB 3.97Å; M408-L742 HydrophobicContact CE-CB 4.43Å; M408-L742 HydrophobicContact CE-CD2 3.72Å; M408-L742 HydrophobicContact CE-CG 4.09Å; M408-L742 HydrophobicContact CG-CB 4.46Å; M408-L742 HydrophobicContact CG-CD2 3.85Å; M408-L742 HydrophobicContact SD-CD2 4.05Å; M408-L745 HydrophobicContact CB-CB 4.25Å; M408-L745 HydrophobicContact CG-CB 4.17Å; M408-L745 HydrophobicContact SD-CD2 4.49Å; M408-S746 VanDerWaalsContact O-CA 3.26Å; M408-S746 WeakPolarHBondContact O-CA 3.34Å; M408-A799 HydrophobicContact CB-CB 3.94Å; M408-H802 HydrophobicContact CE-CB 3.72Å; M408-H802 HydrophobicContact SD-CB 3.99Å; M408-L806 HydrophobicContact CE-CD1 4Å
409	F	91.9	Very high	93	Very high	1 Å²	1	19.2 Å²	19.2	0%	0.004	11%	0.107	C	C	.	.	S	Bend	trans	-111.6	59.3	-175.4	-162.5	-99.1	0	0	0	110.6	F405 A406 D411 H414 M418 S459 H749 L791 L792 A799	F405-F409 HydrophobicContact CD1-CB 4.4Å; F405-F409 HydrophobicContact CE1-CB 3.81Å; F405-F409 AromaticContact CE1-CD1 3.98Å; F405-F409 HydrophobicContact CE1-CD1 3.98Å; F405-F409 HydrophobicContact CE1-CG 4.13Å; F405-F409 HydrophobicContact CE2-CB 3.99Å; F405-F409 HydrophobicContact CE2-CG 4.39Å; F405-F409 HydrophobicContact CZ-CB 3.59Å; F405-F409 AromaticContact CZ-CD1 3.84Å; F405-F409 HydrophobicContact CZ-CD1 3.84Å; F405-F409 HydrophobicContact CZ-CD2 4.44Å; F405-F409 AromaticContact CZ-CG 3.7Å; F405-F409 HydrophobicContact CZ-CG 3.7Å; F405-F409 WeakPolarHBondContact O-CB 3.28Å; F405-F409 PolarHBondContact O-N 3.46Å; A406-F409 CarbonylContact O-C 3.55Å; A406-F409 VanDerWaalsContact O-C 3.27Å; F409-D411 PolarHBondContact O-N 3.27Å; F409-H414 HydrophobicContact CE1-CB 3.54Å; F409-H414 HydrophobicContact CZ-CB 3.62Å; F409-M418 HydrophobicContact CD1-CE 4.12Å; F409-M418 HydrophobicContact CE1-CE 3.75Å; F409-M418 HydrophobicContact CZ-CE 4.38Å; F409-S459 PolarHBondContact O-OG 3.49Å; F409-H749 AromaticContact CD2-CE1 3.64Å; F409-H749 AromaticContact CD2-ND1 3.79Å; F409-H749 AromaticContact CE2-CE1 3.12Å; F409-H749 WeakPolarHBondContact CE2-CE1 3.25Å; F409-H749 AromaticContact CE2-ND1 3.57Å; F409-H749 AromaticContact CE2-NE2 3.78Å; F409-H749 AromaticContact CZ-CE1 3.67Å; F409-L791 VanDerWaalsContact CE2-O 3.23Å; F409-L791 WeakPolarHBondContact CE2-O 3.42Å; F409-L792 HydrophobicContact CE1-CD2 4.3Å; F409-L792 HydrophobicContact CZ-CD2 4.09Å; F409-A799 HydrophobicContact CB-CB 4.41Å
410	G	88.3	Confident	93.1	Very high	6 Å²	6	20.2 Å²	20.2	6%	0.062	11%	0.113	C	C	.	.			trans	-92.9	77.4	-174.8	0	0	0	0	0	113	A406	A406-G410 VanDerWaalsContact O-CA 3.23Å; A406-G410 WeakPolarHBondContact O-CA 3.45Å; A406-G410 PolarHBondContact O-N 2.79Å; A406-G410 VanDerWaalsContact O-N 3.14Å
411	D	92.6	Very high	93	Very high	4 Å²	4	20.9 Å²	20.9	2%	0.021	12%	0.122	C	C	.	.			trans	-135.5	124.9	172.3	-171.2	-35.8	0	0	0	110.1	F409 G413 H414 G415 S459 C469 F470	F409-D411 PolarHBondContact O-N 3.27Å; D411-G413 VanDerWaalsContact C-N 3.3Å; D411-G413 PolarHBondContact O-N 2.96Å; D411-G413 WeakPolarHBondContact OD1-CA 3.22Å; D411-G413 PolarHBondContact OD1-N 3.4Å; D411-H414 HydrophobicContact CB-CB 4.16Å; D411-H414 IonicContact OD2-CE1 3.14Å; D411-H414 PolarHBondContact OD2-CE1 2.86Å; D411-H414 VanDerWaalsContact OD2-CE1 3.28Å; D411-H414 IonicContact OD2-CG 2.7Å; D411-H414 IonicContact OD2-ND1 2.61Å; D411-H414 PolarHBondContact OD2-ND1 2.75Å; D411-G415 PolarHBondContact O-N 3.4Å; D411-S459 PolarHBondContact O-OG 2.99Å; D411-C469 WeakPolarHBondContact OD1-CA 3.31Å; D411-F470 PolarHBondContact OD1-N 3.02Å; D411-F470 PolarHBondContact OD2-N 2.99Å
412	C	91.8	Very high	92.9	Very high	17 Å²	17	20.7 Å²	20.7	12%	0.115	12%	0.122	C	C	.	.	H	α-helix	trans	-63.3	-35.9	-179.4	-174.2	0	0	0	0	112.5	T416 D468 C469	C412-T416 WeakPolarHBondContact O-CB 3.45Å; C412-T416 PolarHBondContact O-N 3.39Å; C412-T416 VanDerWaalsContact O-N 3.13Å; C412-T416 PolarHBondContact O-OG1 3.33Å; C412-D468 PolarHBondContact N-O 3.35Å; C412-C469 HydrophobicContact CB-CB 4.15Å
413	G	91.3	Very high	92.8	Very high	4 Å²	4	24.4 Å²	24.4	4%	0.041	14%	0.141	C	C	.	.	H	α-helix	trans	-69.6	-55.8	-179.3	0	0	0	0	0	111.4	D411 G415 T416 V417 F470	D411-G413 VanDerWaalsContact C-N 3.3Å; D411-G413 PolarHBondContact O-N 2.96Å; D411-G413 WeakPolarHBondContact OD1-CA 3.22Å; D411-G413 PolarHBondContact OD1-N 3.4Å; G413-G415 VanDerWaalsContact C-N 3.33Å; G413-G415 PolarHBondContact O-N 3.29Å; G413-T416 WeakPolarHBondContact O-CB 3.29Å; G413-T416 PolarHBondContact O-N 3.26Å; G413-T416 VanDerWaalsContact O-N 3.15Å; G413-V417 PolarHBondContact O-N 2.83Å; G413-F470 VanDerWaalsContact CA-CE2 3.48Å
414	H	91.9	Very high	92.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-40.8	177.6	-58.1	140.1	0	0	0	112.1	F409 D411 T416 V417 M418 F470 H749 T787 L792	F409-H414 HydrophobicContact CE1-CB 3.54Å; F409-H414 HydrophobicContact CZ-CB 3.62Å; D411-H414 HydrophobicContact CB-CB 4.16Å; D411-H414 IonicContact OD2-CE1 3.14Å; D411-H414 PolarHBondContact OD2-CE1 2.86Å; D411-H414 VanDerWaalsContact OD2-CE1 3.28Å; D411-H414 IonicContact OD2-CG 2.7Å; D411-H414 IonicContact OD2-ND1 2.61Å; D411-H414 PolarHBondContact OD2-ND1 2.75Å; H414-T416 VanDerWaalsContact C-N 3.28Å; H414-T416 PolarHBondContact O-N 2.96Å; H414-V417 PolarHBondContact O-N 3.18Å; H414-M418 PolarHBondContact O-N 3.31Å; H414-F470 AromaticContact CD2-CD1 3.91Å; H414-F470 AromaticContact CD2-CE1 3.55Å; H414-F470 AromaticContact NE2-CD1 3.64Å; H414-F470 AromaticContact NE2-CE1 3.73Å; H414-H749 AromaticContact CE1-CE1 3.84Å; H414-H749 AromaticContact CE1-NE2 3.81Å; H414-H749 AromaticContact ND1-CE1 3.32Å; H414-H749 PolarHBondContact ND1-CE1 3.12Å; H414-H749 VanDerWaalsContact ND1-CE1 3.32Å; H414-H749 AromaticContact ND1-NE2 3.13Å; H414-H749 PolarHBondContact ND1-NE2 3.3Å; H414-H749 VanDerWaalsContact ND1-NE2 3.13Å; H414-T787 VanDerWaalsContact NE2-CG2 3.32Å; H414-T787 WeakPolarHBondContact NE2-CG2 3.32Å; H414-L792 HydrophobicContact CB-CD2 4.08Å; H414-L792 HydrophobicContact CB-CG 4.4Å
415	G	92.9	Very high	92.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-37.4	175.3	0	0	0	0	0	112.9	D411 G413 M418 L419	D411-G415 PolarHBondContact O-N 3.4Å; G413-G415 VanDerWaalsContact C-N 3.33Å; G413-G415 PolarHBondContact O-N 3.29Å; G415-M418 PolarHBondContact O-N 3.03Å; G415-L419 WeakPolarHBondContact O-CB 3.33Å; G415-L419 PolarHBondContact O-N 3.34Å
416	T	93.4	Very high	92.1	Very high	57 Å²	57	30 Å²	30	35%	0.35	17%	0.165	S	C	.	.	H	α-helix	trans	-66.5	-42.2	175.5	-57.1	0	0	0	0	112	C412 G413 H414 L419 L420	C412-T416 WeakPolarHBondContact O-CB 3.45Å; C412-T416 PolarHBondContact O-N 3.39Å; C412-T416 VanDerWaalsContact O-N 3.13Å; C412-T416 PolarHBondContact O-OG1 3.33Å; G413-T416 WeakPolarHBondContact O-CB 3.29Å; G413-T416 PolarHBondContact O-N 3.26Å; G413-T416 VanDerWaalsContact O-N 3.15Å; H414-T416 VanDerWaalsContact C-N 3.28Å; H414-T416 PolarHBondContact O-N 2.96Å; T416-L419 PolarHBondContact O-N 3.23Å; T416-L420 HydrophobicContact CG2-CD1 4.32Å; T416-L420 WeakPolarHBondContact O-CG 3.26Å; T416-L420 PolarHBondContact O-N 3.13Å
417	V	93.5	Very high	91.8	Very high	60 Å²	60	36.3 Å²	36.3	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-63.6	-44	175.9	-178.9	0	0	0	0	110.9	G413 H414 L419 L420 A421 F470 L792	G413-V417 PolarHBondContact O-N 2.83Å; H414-V417 PolarHBondContact O-N 3.18Å; V417-L419 PolarHBondContact O-N 3.43Å; V417-L420 PolarHBondContact O-N 3.26Å; V417-A421 PolarHBondContact O-N 3.43Å; V417-F470 HydrophobicContact CG2-CZ 4.5Å; V417-L792 HydrophobicContact CB-CD1 4.02Å; V417-L792 HydrophobicContact CG1-CD1 3.73Å
418	M	92.9	Very high	91.4	Very high	20 Å²	20	39.2 Å²	39.2	10%	0.099	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-42.5	176.5	-172.8	178.9	-62.6	0	0	112	F405 F409 H414 G415 A421 A422 I452 M455 L792	F405-M418 HydrophobicContact CE1-CE 4.2Å; F405-M418 HydrophobicContact CE1-SD 4.07Å; F405-M418 HydrophobicContact CZ-CE 3.96Å; F405-M418 HydrophobicContact CZ-SD 4.35Å; F409-M418 HydrophobicContact CD1-CE 4.12Å; F409-M418 HydrophobicContact CE1-CE 3.75Å; F409-M418 HydrophobicContact CZ-CE 4.38Å; H414-M418 PolarHBondContact O-N 3.31Å; G415-M418 PolarHBondContact O-N 3.03Å; M418-A421 PolarHBondContact O-N 3.32Å; M418-A422 WeakPolarHBondContact O-CB 3.48Å; M418-A422 PolarHBondContact O-N 2.89Å; M418-I452 HydrophobicContact CG-CG2 3.6Å; M418-I452 HydrophobicContact SD-CG2 4.24Å; M418-M455 HydrophobicContact SD-CB 4.07Å; M418-L792 HydrophobicContact CB-CD2 4.3Å; M418-L792 HydrophobicContact CE-CD2 4.04Å
419	L	94.1	Very high	90.8	Very high	41 Å²	41	41 Å²	41	22%	0.215	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-46.2	176	-175.3	79.8	0	0	0	111.6	G415 T416 V417 A422 L423 L453 I457 I460	G415-L419 WeakPolarHBondContact O-CB 3.33Å; G415-L419 PolarHBondContact O-N 3.34Å; T416-L419 PolarHBondContact O-N 3.23Å; V417-L419 PolarHBondContact O-N 3.43Å; L419-A422 PolarHBondContact O-N 3.07Å; L419-L423 VanDerWaalsContact O-CB 3.27Å; L419-L423 WeakPolarHBondContact O-CB 3.17Å; L419-L423 PolarHBondContact O-N 3.19Å; L419-L453 HydrophobicContact CD1-CD1 4Å; L419-I457 HydrophobicContact CD1-CD1 4.26Å; L419-I457 HydrophobicContact CD1-CG1 3.41Å; L419-I457 VanDerWaalsContact CD1-CG1 3.41Å; L419-I460 HydrophobicContact CB-CD1 4.21Å; L419-I460 HydrophobicContact CD2-CD1 3.83Å
420	L	94.3	Very high	90.2	Very high	111 Å²	111	51.7 Å²	51.7	58%	0.581	26%	0.262	S	S	*	.	H	α-helix	trans	-63.1	-43.5	179.3	-74.2	171.9	0	0	0	111.8	T416 V417 L423 W424	T416-L420 HydrophobicContact CG2-CD1 4.32Å; T416-L420 WeakPolarHBondContact O-CG 3.26Å; T416-L420 PolarHBondContact O-N 3.13Å; V417-L420 PolarHBondContact O-N 3.26Å; L420-L423 PolarHBondContact O-N 2.97Å; L420-W424 WeakPolarHBondContact O-CB 2.91Å; L420-W424 PolarHBondContact O-N 3.32Å
421	A	90.9	Very high	89.6	Confident	50 Å²	50	59.9 Å²	59.9	41%	0.413	29%	0.291	S	S	.	.	H	α-helix	trans	-62	-43.9	175.3	0	0	0	0	0	111.7	V417 M418 W424 M425	V417-A421 PolarHBondContact O-N 3.43Å; M418-A421 PolarHBondContact O-N 3.32Å; A421-W424 PolarHBondContact O-N 3.47Å; A421-M425 WeakPolarHBondContact O-CG 3.29Å; A421-M425 PolarHBondContact O-N 3.02Å; A421-M425 VanDerWaalsContact O-N 3.12Å
422	A	91.5	Very high	88.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.4	-43.9	176.5	0	0	0	0	0	112.6	M418 L419 W424 M425 V426 I452 L453	M418-A422 WeakPolarHBondContact O-CB 3.48Å; M418-A422 PolarHBondContact O-N 2.89Å; L419-A422 PolarHBondContact O-N 3.07Å; A422-W424 VanDerWaalsContact C-N 3.33Å; A422-W424 PolarHBondContact O-N 2.94Å; A422-M425 HydrophobicContact CB-CE 4.47Å; A422-M425 PolarHBondContact O-N 3.11Å; A422-V426 WeakPolarHBondContact O-CG2 3.49Å; A422-V426 PolarHBondContact O-N 3.12Å; A422-I452 HydrophobicContact CB-CB 4.23Å; A422-I452 HydrophobicContact CB-CG2 3.97Å; A422-L453 HydrophobicContact CB-CB 4Å; A422-L453 HydrophobicContact CB-CD1 4.08Å
423	L	92.9	Very high	87.8	Confident	78 Å²	78	65.9 Å²	65.9	41%	0.408	32%	0.321	S	S	.	.	H	α-helix	trans	-65.5	-38.6	179.4	-166.7	148.3	0	0	0	111.1	L419 L420 M425 V426 L427	L419-L423 VanDerWaalsContact O-CB 3.27Å; L419-L423 WeakPolarHBondContact O-CB 3.17Å; L419-L423 PolarHBondContact O-N 3.19Å; L420-L423 PolarHBondContact O-N 2.97Å; L423-M425 PolarHBondContact O-N 3.31Å; L423-V426 PolarHBondContact O-N 2.85Å; L423-L427 HydrophobicContact CD2-CD1 3.41Å; L423-L427 VanDerWaalsContact CD2-CD1 3.41Å; L423-L427 HydrophobicContact CD2-CG 3.87Å; L423-L427 WeakPolarHBondContact O-CG 3.37Å; L423-L427 PolarHBondContact O-N 3.38Å
424	W	91.9	Very high	86.5	Confident	128 Å²	128	70.2 Å²	70.2	49%	0.485	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-42.3	172.6	177.2	89.6	0	0	0	112.3	L420 A421 A422 N428 L432 W442	L420-W424 WeakPolarHBondContact O-CB 2.91Å; L420-W424 PolarHBondContact O-N 3.32Å; A421-W424 PolarHBondContact O-N 3.47Å; A422-W424 VanDerWaalsContact C-N 3.33Å; A422-W424 PolarHBondContact O-N 2.94Å; W424-N428 PolarHBondContact NE1-ND2 3.23Å; W424-N428 PolarHBondContact O-N 3.33Å; W424-L432 HydrophobicContact CH2-CD1 4.44Å; W424-L432 HydrophobicContact CZ3-CD1 4.25Å; W424-W442 AromaticContact CH2-CH2 3.99Å; W424-W442 HydrophobicContact CH2-CH2 3.99Å; W424-W442 HydrophobicContact CH2-CZ2 4.24Å; W424-W442 AromaticContact CZ3-CH2 3.61Å; W424-W442 HydrophobicContact CZ3-CH2 3.61Å; W424-W442 HydrophobicContact CZ3-CZ2 4.02Å
425	M	87.5	Confident	85.3	Confident	15 Å²	15	75.1 Å²	75.1	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-65.4	-38	175.5	-70.2	-175.2	-75.2	0	0	112.6	A421 A422 L423 E429 R449 I452	A421-M425 WeakPolarHBondContact O-CG 3.29Å; A421-M425 PolarHBondContact O-N 3.02Å; A421-M425 VanDerWaalsContact O-N 3.12Å; A422-M425 HydrophobicContact CB-CE 4.47Å; A422-M425 PolarHBondContact O-N 3.11Å; L423-M425 PolarHBondContact O-N 3.31Å; M425-E429 PolarHBondContact O-N 3.23Å; M425-R449 HydrophobicContact CB-CB 4.37Å; M425-I452 HydrophobicContact CE-CD1 3.92Å
426	V	88.5	Confident	83.7	Confident	37 Å²	37	84 Å²	84	22%	0.224	41%	0.412	C	S	.	.	H	α-helix	trans	-72.3	-41.4	180	173.3	0	0	0	0	111.7	A422 L423 N428 R449 Y450	A422-V426 WeakPolarHBondContact O-CG2 3.49Å; A422-V426 PolarHBondContact O-N 3.12Å; L423-V426 PolarHBondContact O-N 2.85Å; V426-N428 PolarHBondContact O-N 3.41Å; V426-R449 HydrophobicContact CG2-CB 4.24Å; V426-R449 HydrophobicContact CG2-CG 4.17Å; V426-Y450 HydrophobicContact CG1-CE1 4.29Å; V426-Y450 HydrophobicContact CG2-CD1 4.42Å; V426-Y450 HydrophobicContact CG2-CE1 4.28Å
427	L	88.6	Confident	82.1	Confident	131 Å²	131	83.2 Å²	83.2	69%	0.686	41%	0.408	S	S	*	.	H	α-helix	trans	-66.6	-36.6	179	-71.2	-178.9	0	0	0	112.6	L423 E429	L423-L427 HydrophobicContact CD2-CD1 3.41Å; L423-L427 VanDerWaalsContact CD2-CD1 3.41Å; L423-L427 HydrophobicContact CD2-CG 3.87Å; L423-L427 WeakPolarHBondContact O-CG 3.37Å; L423-L427 PolarHBondContact O-N 3.38Å; L427-E429 VanDerWaalsContact C-N 3.34Å; L427-E429 PolarHBondContact O-N 2.8Å
428	N	85.3	Confident	80.6	Confident	62 Å²	62	87.1 Å²	87.1	33%	0.332	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	17.2	-177.4	-70.4	-22.5	0	0	0	114.1	W424 V426 R430 R431 L432	W424-N428 PolarHBondContact NE1-ND2 3.23Å; W424-N428 PolarHBondContact O-N 3.33Å; V426-N428 PolarHBondContact O-N 3.41Å; N428-R430 VanDerWaalsContact C-N 3.32Å; N428-R430 PolarHBondContact O-N 3.01Å; N428-R431 PolarHBondContact O-N 3.45Å; N428-R431 VanDerWaalsContact O-N 3.14Å; N428-L432 HydrophobicContact CB-CD1 4.17Å; N428-L432 HydrophobicContact CB-CG 4.38Å; N428-L432 PolarHBondContact O-N 3.17Å; N428-L432 VanDerWaalsContact O-N 3.09Å
429	E	81.9	Confident	79.8	Confident	38 Å²	38	91.4 Å²	91.4	18%	0.178	45%	0.45	C	S	.	.	H	α-helix	trans	-50	-46.7	-173.6	-178.6	-175.8	-170.1	0	0	113.1	M425 L427 R431 L432 L433 F446 R449	M425-E429 PolarHBondContact O-N 3.23Å; L427-E429 VanDerWaalsContact C-N 3.34Å; L427-E429 PolarHBondContact O-N 2.8Å; E429-R431 PolarHBondContact O-N 3.1Å; E429-L432 PolarHBondContact O-N 3.08Å; E429-L433 VanDerWaalsContact O-CB 3.27Å; E429-L433 WeakPolarHBondContact O-CB 3.29Å; E429-L433 PolarHBondContact O-N 3.05Å; E429-F446 HydrophobicContact CG-CZ 4.18Å; E429-R449 IonicContact OE1-CZ 2.78Å; E429-R449 IonicContact OE1-NE 3.17Å; E429-R449 IonicContact OE1-NH2 3Å; E429-R449 PolarHBondContact OE1-NH2 3.42Å
430	R	78.2	Confident	79.2	Confident	227 Å²	227	97.1 Å²	97.1	86%	0.857	48%	0.475	S	S	*	.	H	α-helix	trans	-64.8	-40.8	-176.1	-66.6	-174.3	-177.7	-174.8	0.5	112.8	N428 S434	N428-R430 VanDerWaalsContact C-N 3.32Å; N428-R430 PolarHBondContact O-N 3.01Å; R430-S434 PolarHBondContact O-N 2.62Å; R430-S434 PolarHBondContact O-OG 3.43Å
431	R	76.4	Confident	78.7	Confident	177 Å²	177	97.8 Å²	97.8	67%	0.668	48%	0.478	S	S	*	.	H	α-helix	trans	-71.8	-41.3	-178.5	-176	177	178	170.2	0.9	111.1	N428 E429 S434 Q435	N428-R431 PolarHBondContact O-N 3.45Å; N428-R431 VanDerWaalsContact O-N 3.14Å; E429-R431 PolarHBondContact O-N 3.1Å; R431-S434 PolarHBondContact O-N 2.89Å; R431-S434 PolarHBondContact O-OG 2.81Å; R431-Q435 PolarHBondContact O-N 3.24Å
432	L	73.7	Confident	78.4	Confident	21 Å²	21	99.2 Å²	99.2	11%	0.11	47%	0.473	C	S	.	.	H	α-helix	trans	-71.2	-38.2	179.6	-68.3	172.7	0	0	0	112	W424 N428 E429 S434 Q435 W442 F446	W424-L432 HydrophobicContact CH2-CD1 4.44Å; W424-L432 HydrophobicContact CZ3-CD1 4.25Å; N428-L432 HydrophobicContact CB-CD1 4.17Å; N428-L432 HydrophobicContact CB-CG 4.38Å; N428-L432 PolarHBondContact O-N 3.17Å; N428-L432 VanDerWaalsContact O-N 3.09Å; E429-L432 PolarHBondContact O-N 3.08Å; L432-S434 VanDerWaalsContact C-N 3.28Å; L432-S434 PolarHBondContact O-N 3.06Å; L432-Q435 PolarHBondContact O-N 3.47Å; L432-Q435 VanDerWaalsContact O-N 3.16Å; L432-W442 HydrophobicContact CD1-CZ2 4.21Å; L432-W442 HydrophobicContact CD2-CZ2 4.05Å; L432-F446 HydrophobicContact CB-CD2 4.33Å; L432-F446 HydrophobicContact CB-CE2 3.72Å; L432-F446 HydrophobicContact CB-CZ 4.15Å; L432-F446 HydrophobicContact CD1-CD2 4.24Å; L432-F446 HydrophobicContact CD1-CE2 3.97Å
433	L	72.4	Confident	78	Confident	126 Å²	126	102 Å²	102	66%	0.66	49%	0.488	S	S	*	.	H	α-helix	trans	-64	-34.5	175.6	-164	81.5	0	0	0	112.1	E429 Q435 F446	E429-L433 VanDerWaalsContact O-CB 3.27Å; E429-L433 WeakPolarHBondContact O-CB 3.29Å; E429-L433 PolarHBondContact O-N 3.05Å; L433-Q435 VanDerWaalsContact C-N 3.3Å; L433-Q435 PolarHBondContact O-N 2.86Å; L433-F446 HydrophobicContact CD1-CE1 3.89Å; L433-F446 HydrophobicContact CD1-CZ 4.49Å
434	S	64.1	Low	77.6	Confident	95 Å²	95	103.2 Å²	103.2	66%	0.664	50%	0.499	S	S	*	.	H	α-helix	trans	-72.8	-20.6	175.9	61.1	0	0	0	0	114.1	R430 R431 L432 K436	R430-S434 PolarHBondContact O-N 2.62Å; R430-S434 PolarHBondContact O-OG 3.43Å; R431-S434 PolarHBondContact O-N 2.89Å; R431-S434 PolarHBondContact O-OG 2.81Å; L432-S434 VanDerWaalsContact C-N 3.28Å; L432-S434 PolarHBondContact O-N 3.06Å; S434-K436 PolarHBondContact O-N 2.75Å
435	Q	66.4	Low	77.2	Confident	103 Å²	103	101.7 Å²	101.7	48%	0.481	50%	0.496	S	S	.	.	S	Bend	trans	-91.4	91.8	176.3	-74.2	-176.7	-24.1	0	0	108.9	R431 L432 L433 T437	R431-Q435 PolarHBondContact O-N 3.24Å; L432-Q435 PolarHBondContact O-N 3.47Å; L432-Q435 VanDerWaalsContact O-N 3.16Å; L433-Q435 VanDerWaalsContact C-N 3.3Å; L433-Q435 PolarHBondContact O-N 2.86Å; Q435-T437 PolarHBondContact O-N 2.92Å; Q435-T437 PolarHBondContact O-OG1 2.76Å
436	K	60.5	Low	77	Confident	186 Å²	186	101.7 Å²	101.7	81%	0.809	50%	0.495	S	S	*	.			trans	-60.2	102.8	171.4	-159.9	173.5	-175.5	-179.3	0	107.8	S434	S434-K436 PolarHBondContact O-N 2.75Å
437	T	59.6	Low	76.7	Confident	41 Å²	41	105.9 Å²	105.9	25%	0.252	51%	0.512	S	S	.	.			trans	-106.3	127.6	-176.8	-49	0	0	0	0	107.5	Q435 N439 N443	Q435-T437 PolarHBondContact O-N 2.92Å; Q435-T437 PolarHBondContact O-OG1 2.76Å; T437-N439 HydrophobicContact CG2-CB 4.11Å; T437-N439 PolarHBondContact O-N 3.29Å; T437-N443 PolarHBondContact O-ND2 3.24Å; T437-N443 PolarHBondContact O-OD1 2.82Å
438	D	60.4	Low	76.5	Confident	142 Å²	142	100.4 Å²	100.4	76%	0.759	49%	0.488	S	S	*	.			trans	-80.5	-3.9	-176.3	-59.1	-30.1	0	0	0	112.9	E440	D438-E440 PolarHBondContact O-N 3.46Å; D438-E440 VanDerWaalsContact O-N 3.07Å
439	N	77.5	Confident	76.7	Confident	111 Å²	111	98.6 Å²	98.6	59%	0.594	48%	0.476	S	S	*	.			trans	-73.5	101.8	176.7	-70.6	-16.9	0	0	0	110.7	T437 I441 W442 N443	T437-N439 HydrophobicContact CG2-CB 4.11Å; T437-N439 PolarHBondContact O-N 3.29Å; N439-I441 PolarHBondContact O-N 3.4Å; N439-W442 HydrophobicContact CB-CB 3.98Å; N439-W442 WeakPolarHBondContact O-CB 3.44Å; N439-W442 PolarHBondContact O-N 3.39Å; N439-N443 PolarHBondContact O-N 3.03Å; N439-N443 VanDerWaalsContact O-N 3.08Å
440	E	81.7	Confident	77.1	Confident	160 Å²	160	98.8 Å²	98.8	75%	0.748	48%	0.475	S	S	*	.	H	α-helix	trans	-53	-39.6	178.5	-64.5	-177.8	174.3	0	0	113.5	D438 W442 N443 T444	D438-E440 PolarHBondContact O-N 3.46Å; D438-E440 VanDerWaalsContact O-N 3.07Å; E440-W442 VanDerWaalsContact C-N 3.33Å; E440-W442 PolarHBondContact O-N 3.49Å; E440-N443 PolarHBondContact O-N 2.77Å; E440-T444 PolarHBondContact O-N 2.97Å; E440-T444 PolarHBondContact O-OG1 2.92Å
441	I	83.2	Confident	77.7	Confident	125 Å²	125	88.4 Å²	88.4	64%	0.641	44%	0.437	S	S	*	.	H	α-helix	trans	-59.9	-47.8	177.8	-61.8	170.2	0	0	0	109.5	N439 N443 T444 F445	N439-I441 PolarHBondContact O-N 3.4Å; I441-N443 VanDerWaalsContact C-N 3.35Å; I441-N443 PolarHBondContact O-N 3.37Å; I441-T444 PolarHBondContact O-N 2.98Å; I441-F445 HydrophobicContact CG2-CD2 3.71Å; I441-F445 HydrophobicContact CG2-CE2 3.65Å; I441-F445 VanDerWaalsContact O-CD2 3.22Å; I441-F445 WeakPolarHBondContact O-CD2 3.17Å; I441-F445 PolarHBondContact O-N 3.46Å
442	W	83.8	Confident	78.5	Confident	80 Å²	80	81 Å²	81	30%	0.303	41%	0.411	S	S	.	.	H	α-helix	trans	-62.1	-44	179.3	-176.2	-106.8	0	0	0	111.8	W424 L432 N439 E440 T444 F445 F446	W424-W442 AromaticContact CH2-CH2 3.99Å; W424-W442 HydrophobicContact CH2-CH2 3.99Å; W424-W442 HydrophobicContact CH2-CZ2 4.24Å; W424-W442 AromaticContact CZ3-CH2 3.61Å; W424-W442 HydrophobicContact CZ3-CH2 3.61Å; W424-W442 HydrophobicContact CZ3-CZ2 4.02Å; L432-W442 HydrophobicContact CD1-CZ2 4.21Å; L432-W442 HydrophobicContact CD2-CZ2 4.05Å; N439-W442 HydrophobicContact CB-CB 3.98Å; N439-W442 WeakPolarHBondContact O-CB 3.44Å; N439-W442 PolarHBondContact O-N 3.39Å; E440-W442 VanDerWaalsContact C-N 3.33Å; E440-W442 PolarHBondContact O-N 3.49Å; W442-T444 VanDerWaalsContact C-N 3.3Å; W442-T444 PolarHBondContact O-N 3.38Å; W442-F445 PolarHBondContact O-N 3.31Å; W442-F446 VanDerWaalsContact O-CB 3.32Å; W442-F446 WeakPolarHBondContact O-CB 3.34Å; W442-F446 PolarHBondContact O-N 3.13Å
443	N	82.8	Confident	79.4	Confident	60 Å²	60	81.8 Å²	81.8	32%	0.321	42%	0.415	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177.3	-70.4	-21.8	0	0	0	111	T437 N439 E440 I441 F446 H447	T437-N443 PolarHBondContact O-ND2 3.24Å; T437-N443 PolarHBondContact O-OD1 2.82Å; N439-N443 PolarHBondContact O-N 3.03Å; N439-N443 VanDerWaalsContact O-N 3.08Å; E440-N443 PolarHBondContact O-N 2.77Å; I441-N443 VanDerWaalsContact C-N 3.35Å; I441-N443 PolarHBondContact O-N 3.37Å; N443-F446 PolarHBondContact O-N 3.41Å; N443-H447 PolarHBondContact O-N 2.9Å; N443-H447 PolarHBondContact O-ND1 3.08Å
444	T	84.7	Confident	80.4	Confident	102 Å²	102	77 Å²	77	63%	0.626	39%	0.39	S	S	*	.	H	α-helix	trans	-62	-47.9	177	-54.9	0	0	0	0	111.7	E440 I441 W442 F446 H447 G448	E440-T444 PolarHBondContact O-N 2.97Å; E440-T444 PolarHBondContact O-OG1 2.92Å; I441-T444 PolarHBondContact O-N 2.98Å; W442-T444 VanDerWaalsContact C-N 3.3Å; W442-T444 PolarHBondContact O-N 3.38Å; T444-F446 VanDerWaalsContact C-N 3.34Å; T444-F446 PolarHBondContact O-N 2.88Å; T444-H447 PolarHBondContact O-N 3.07Å; T444-G448 PolarHBondContact O-N 3.21Å
445	F	83.7	Confident	81.8	Confident	97 Å²	97	73 Å²	73	43%	0.425	36%	0.36	S	S	.	.	H	α-helix	trans	-63.3	-38.4	176.5	-82.6	-76.8	0	0	0	112.4	I441 W442 G448 R449 I452	I441-F445 HydrophobicContact CG2-CD2 3.71Å; I441-F445 HydrophobicContact CG2-CE2 3.65Å; I441-F445 VanDerWaalsContact O-CD2 3.22Å; I441-F445 WeakPolarHBondContact O-CD2 3.17Å; I441-F445 PolarHBondContact O-N 3.46Å; W442-F445 PolarHBondContact O-N 3.31Å; F445-G448 CarbonylContact O-C 3.44Å; F445-G448 PolarHBondContact O-N 3Å; F445-R449 PolarHBondContact O-N 2.72Å; F445-I452 HydrophobicContact CD1-CD1 3.74Å; F445-I452 HydrophobicContact CE1-CD1 4.49Å
446	F	84.1	Confident	83.1	Confident	14 Å²	14	68 Å²	68	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-68.2	-39.5	-179.8	-175.6	-103.2	0	0	0	112.9	E429 L432 L433 W442 N443 T444 G448 R449	E429-F446 HydrophobicContact CG-CZ 4.18Å; L432-F446 HydrophobicContact CB-CD2 4.33Å; L432-F446 HydrophobicContact CB-CE2 3.72Å; L432-F446 HydrophobicContact CB-CZ 4.15Å; L432-F446 HydrophobicContact CD1-CD2 4.24Å; L432-F446 HydrophobicContact CD1-CE2 3.97Å; L433-F446 HydrophobicContact CD1-CE1 3.89Å; L433-F446 HydrophobicContact CD1-CZ 4.49Å; W442-F446 VanDerWaalsContact O-CB 3.32Å; W442-F446 WeakPolarHBondContact O-CB 3.34Å; W442-F446 PolarHBondContact O-N 3.13Å; N443-F446 PolarHBondContact O-N 3.41Å; T444-F446 VanDerWaalsContact C-N 3.34Å; T444-F446 PolarHBondContact O-N 2.88Å; F446-G448 PolarHBondContact O-N 3.35Å; F446-R449 WeakPolarHBondContact O-CB 3.39Å; F446-R449 WeakPolarHBondContact O-CG 3.5Å; F446-R449 PolarHBondContact O-N 3.35Å; F446-R449 PolarHBondContact O-NH1 3.18Å
447	H	81.9	Confident	84.8	Confident	125 Å²	125	63.1 Å²	63.1	58%	0.579	32%	0.319	S	S	*	.	H	α-helix	trans	-63.1	-32.9	171.7	-74.7	92.1	0	0	0	111.5	N443 T444	N443-H447 PolarHBondContact O-N 2.9Å; N443-H447 PolarHBondContact O-ND1 3.08Å; T444-H447 PolarHBondContact O-N 3.07Å
448	G	84.6	Confident	86.5	Confident	17 Å²	17	63.2 Å²	63.2	18%	0.175	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	8.4	177.3	0	0	0	0	0	116.7	T444 F445 F446 Y450 L451 I452	T444-G448 PolarHBondContact O-N 3.21Å; F445-G448 CarbonylContact O-C 3.44Å; F445-G448 PolarHBondContact O-N 3Å; F446-G448 PolarHBondContact O-N 3.35Å; G448-Y450 PolarHBondContact O-N 3.48Å; G448-L451 WeakPolarHBondContact O-CA 3.25Å; G448-L451 WeakPolarHBondContact O-CB 3.14Å; G448-L451 PolarHBondContact O-N 3.26Å; G448-I452 PolarHBondContact O-N 2.64Å; G448-I452 VanDerWaalsContact O-N 3.1Å
449	R	89.8	Confident	88.1	Confident	23 Å²	23	56.5 Å²	56.5	9%	0.087	28%	0.28	C	S	.	.	H	α-helix	trans	-54	-42.3	-170.1	65.6	-174	173.3	-82	4.7	115.5	M425 V426 E429 F445 F446 L451 L453	M425-R449 HydrophobicContact CB-CB 4.37Å; V426-R449 HydrophobicContact CG2-CB 4.24Å; V426-R449 HydrophobicContact CG2-CG 4.17Å; E429-R449 IonicContact OE1-CZ 2.78Å; E429-R449 IonicContact OE1-NE 3.17Å; E429-R449 IonicContact OE1-NH2 3Å; E429-R449 PolarHBondContact OE1-NH2 3.42Å; F445-R449 PolarHBondContact O-N 2.72Å; F446-R449 WeakPolarHBondContact O-CB 3.39Å; F446-R449 WeakPolarHBondContact O-CG 3.5Å; F446-R449 PolarHBondContact O-N 3.35Å; F446-R449 PolarHBondContact O-NH1 3.18Å; R449-L451 VanDerWaalsContact C-N 3.3Å; R449-L451 PolarHBondContact O-N 3.13Å; R449-L453 WeakPolarHBondContact O-CB 3.48Å; R449-L453 PolarHBondContact O-N 3.25Å; R449-L453 VanDerWaalsContact O-N 3.07Å
450	Y	90.2	Very high	88.9	Confident	42 Å²	42	52.9 Å²	52.9	17%	0.165	26%	0.26	C	S	.	.	H	α-helix	trans	-72.6	-26.8	180	-65.8	-66.6	0	0	0	112.8	K371 F372 V426 G448 L454	K371-Y450 HydrophobicContact CB-CE2 4.45Å; K371-Y450 WeakPolarHBondContact O-CE2 3.38Å; F372-Y450 AromaticContact CD2-CD1 3.82Å; F372-Y450 HydrophobicContact CD2-CD1 3.82Å; F372-Y450 HydrophobicContact CD2-CD2 4.39Å; F372-Y450 AromaticContact CD2-CG 3.72Å; F372-Y450 HydrophobicContact CD2-CG 3.72Å; F372-Y450 HydrophobicContact CE2-CD1 4.39Å; F372-Y450 HydrophobicContact CE2-CG 4.36Å; V426-Y450 HydrophobicContact CG1-CE1 4.29Å; V426-Y450 HydrophobicContact CG2-CD1 4.42Å; V426-Y450 HydrophobicContact CG2-CE1 4.28Å; G448-Y450 PolarHBondContact O-N 3.48Å; Y450-L454 PolarHBondContact O-N 3.45Å; Y450-L454 VanDerWaalsContact O-N 3.15Å
451	L	90.7	Very high	89.5	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-72.2	-45	176.2	172.1	150.6	0	0	0	110.5	F376 I379 F401 G448 R449 L453 L454 M455 F800	F376-L451 HydrophobicContact CD1-CD1 4.09Å; F376-L451 HydrophobicContact CE1-CB 4.05Å; F376-L451 HydrophobicContact CE1-CD1 3.83Å; F376-L451 HydrophobicContact CE1-CG 4.04Å; F376-L451 HydrophobicContact CE2-CB 4.42Å; F376-L451 HydrophobicContact CZ-CB 3.84Å; F376-L451 HydrophobicContact CZ-CD1 4.46Å; F376-L451 HydrophobicContact CZ-CG 4.3Å; I379-L451 HydrophobicContact CD1-CD1 3.25Å; F401-L451 HydrophobicContact CD1-CD1 4.01Å; F401-L451 HydrophobicContact CD1-CG 4.38Å; F401-L451 HydrophobicContact CE1-CD1 3.75Å; F401-L451 HydrophobicContact CE1-CD2 4.19Å; F401-L451 HydrophobicContact CE1-CG 4.06Å; G448-L451 WeakPolarHBondContact O-CA 3.25Å; G448-L451 WeakPolarHBondContact O-CB 3.14Å; G448-L451 PolarHBondContact O-N 3.26Å; R449-L451 VanDerWaalsContact C-N 3.3Å; R449-L451 PolarHBondContact O-N 3.13Å; L451-L453 VanDerWaalsContact C-N 3.27Å; L451-L453 PolarHBondContact O-N 3.12Å; L451-L454 PolarHBondContact O-N 3.07Å; L451-M455 HydrophobicContact CD2-CG 4.47Å; L451-M455 HydrophobicContact CD2-SD 3.2Å; L451-M455 WeakPolarHBondContact CD2-SD 3.4Å; L451-M455 HydrophobicContact CG-SD 3.97Å; L451-M455 VanDerWaalsContact O-CG 3.31Å; L451-M455 WeakPolarHBondContact O-CG 3.32Å; L451-M455 PolarHBondContact O-N 3.15Å; L451-F800 HydrophobicContact CD1-CE2 4.15Å; L451-F800 HydrophobicContact CD2-CD2 4.15Å; L451-F800 HydrophobicContact CD2-CE2 3.66Å
452	I	91.9	Very high	90	Very high	22 Å²	22	45.2 Å²	45.2	11%	0.113	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-37.1	176.2	-56.3	165.1	0	0	0	110.2	M418 A422 M425 F445 G448 M455 G456	M418-I452 HydrophobicContact CG-CG2 3.6Å; M418-I452 HydrophobicContact SD-CG2 4.24Å; A422-I452 HydrophobicContact CB-CB 4.23Å; A422-I452 HydrophobicContact CB-CG2 3.97Å; M425-I452 HydrophobicContact CE-CD1 3.92Å; F445-I452 HydrophobicContact CD1-CD1 3.74Å; F445-I452 HydrophobicContact CE1-CD1 4.49Å; G448-I452 PolarHBondContact O-N 2.64Å; G448-I452 VanDerWaalsContact O-N 3.1Å; I452-M455 PolarHBondContact O-N 2.92Å; I452-G456 PolarHBondContact O-N 3.17Å
453	L	93.4	Very high	90.4	Very high	37 Å²	37	41.4 Å²	41.4	19%	0.194	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-50.5	174.5	-174.6	75.6	0	0	0	111.5	L419 A422 R449 L451 G456 I457	L419-L453 HydrophobicContact CD1-CD1 4Å; A422-L453 HydrophobicContact CB-CB 4Å; A422-L453 HydrophobicContact CB-CD1 4.08Å; R449-L453 WeakPolarHBondContact O-CB 3.48Å; R449-L453 PolarHBondContact O-N 3.25Å; R449-L453 VanDerWaalsContact O-N 3.07Å; L451-L453 VanDerWaalsContact C-N 3.27Å; L451-L453 PolarHBondContact O-N 3.12Å; L453-G456 PolarHBondContact O-N 3.49Å; L453-I457 HydrophobicContact CG-CD1 4.46Å; L453-I457 WeakPolarHBondContact O-CG1 3.48Å; L453-I457 PolarHBondContact O-N 2.75Å; L453-I457 VanDerWaalsContact O-N 3.12Å
454	L	93.7	Very high	90.8	Very high	26 Å²	26	41 Å²	41	14%	0.136	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-40.8	178.2	-78.1	174.4	0	0	0	112	F372 F376 I398 P402 Y450 L451 G456 I457 F458	F372-L454 HydrophobicContact CE2-CD1 4.11Å; F372-L454 HydrophobicContact CZ-CD1 3.6Å; F372-L454 HydrophobicContact CZ-CG 4.47Å; F376-L454 HydrophobicContact CE2-CD1 4.14Å; F376-L454 HydrophobicContact CZ-CD1 3.64Å; I398-L454 HydrophobicContact CG2-CD1 4.13Å; P402-L454 HydrophobicContact CB-CB 3.95Å; P402-L454 HydrophobicContact CG-CB 3.75Å; P402-L454 HydrophobicContact CG-CD1 4.38Å; Y450-L454 PolarHBondContact O-N 3.45Å; Y450-L454 VanDerWaalsContact O-N 3.15Å; L451-L454 PolarHBondContact O-N 3.07Å; L454-G456 VanDerWaalsContact C-N 3.31Å; L454-G456 PolarHBondContact O-N 3.36Å; L454-I457 PolarHBondContact O-N 3.23Å; L454-F458 HydrophobicContact CD2-CE2 4.27Å; L454-F458 VanDerWaalsContact O-CD2 3.23Å; L454-F458 WeakPolarHBondContact O-CD2 3.37Å; L454-F458 PolarHBondContact O-N 2.96Å
455	M	93.6	Very high	91.1	Very high	9 Å²	9	37.8 Å²	37.8	4%	0.044	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-42.6	175.4	-74.8	164.2	66.7	0	0	111.9	F401 P402 F405 M418 L451 I452 S459 F800	F401-M455 HydrophobicContact CE1-SD 4.13Å; P402-M455 HydrophobicContact CB-CG 4.07Å; P402-M455 HydrophobicContact CG-CG 4.46Å; F405-M455 HydrophobicContact CB-CE 4.49Å; F405-M455 HydrophobicContact CB-CG 4.35Å; F405-M455 HydrophobicContact CD1-CB 3.6Å; F405-M455 HydrophobicContact CD1-CE 3.47Å; F405-M455 VanDerWaalsContact CD1-CE 3.47Å; F405-M455 HydrophobicContact CD1-CG 3.6Å; F405-M455 HydrophobicContact CD1-SD 4.32Å; F405-M455 HydrophobicContact CD2-CE 3.46Å; F405-M455 VanDerWaalsContact CD2-CE 3.46Å; F405-M455 HydrophobicContact CE1-CB 3.78Å; F405-M455 HydrophobicContact CE1-CE 3.38Å; F405-M455 HydrophobicContact CE1-CG 4.15Å; F405-M455 HydrophobicContact CE2-CE 3.35Å; F405-M455 HydrophobicContact CG-CB 4.49Å; F405-M455 HydrophobicContact CG-CE 3.5Å; F405-M455 HydrophobicContact CG-CG 4.02Å; F405-M455 HydrophobicContact CG-SD 4.41Å; F405-M455 HydrophobicContact CZ-CE 3.32Å; M418-M455 HydrophobicContact SD-CB 4.07Å; L451-M455 HydrophobicContact CD2-CG 4.47Å; L451-M455 HydrophobicContact CD2-SD 3.2Å; L451-M455 WeakPolarHBondContact CD2-SD 3.4Å; L451-M455 HydrophobicContact CG-SD 3.97Å; L451-M455 VanDerWaalsContact O-CG 3.31Å; L451-M455 WeakPolarHBondContact O-CG 3.32Å; L451-M455 PolarHBondContact O-N 3.15Å; I452-M455 PolarHBondContact O-N 2.92Å; M455-S459 WeakPolarHBondContact O-CB 3.4Å; M455-S459 PolarHBondContact O-N 2.77Å; M455-F800 HydrophobicContact CE-CB 4.29Å; M455-F800 HydrophobicContact CE-CD2 3.94Å; M455-F800 HydrophobicContact SD-CD2 4.08Å
456	G	94.2	Very high	91.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62	-45.8	175.4	0	0	0	0	0	112.5	I452 L453 L454 S459 I460	I452-G456 PolarHBondContact O-N 3.17Å; L453-G456 PolarHBondContact O-N 3.49Å; L454-G456 VanDerWaalsContact C-N 3.31Å; L454-G456 PolarHBondContact O-N 3.36Å; G456-S459 PolarHBondContact O-N 2.94Å; G456-I460 VanDerWaalsContact O-CG1 3.31Å; G456-I460 WeakPolarHBondContact O-CG1 3.33Å; G456-I460 PolarHBondContact O-N 3.44Å
457	I	95.3	Very high	91.7	Very high	83 Å²	83	33.3 Å²	33.3	43%	0.426	16%	0.161	S	C	.	.	H	α-helix	trans	-61.7	-48.1	178.2	-65	171.9	0	0	0	111	L419 L453 L454 I460 Y461	L419-I457 HydrophobicContact CD1-CD1 4.26Å; L419-I457 HydrophobicContact CD1-CG1 3.41Å; L419-I457 VanDerWaalsContact CD1-CG1 3.41Å; L453-I457 HydrophobicContact CG-CD1 4.46Å; L453-I457 WeakPolarHBondContact O-CG1 3.48Å; L453-I457 PolarHBondContact O-N 2.75Å; L453-I457 VanDerWaalsContact O-N 3.12Å; L454-I457 PolarHBondContact O-N 3.23Å; I457-I460 PolarHBondContact O-N 2.96Å; I457-Y461 PolarHBondContact O-N 2.74Å; I457-Y461 VanDerWaalsContact O-N 3.12Å
458	F	95.3	Very high	92	Very high	43 Å²	43	28.6 Å²	28.6	19%	0.189	14%	0.14	C	C	.	.	H	α-helix	trans	-69.2	-35.3	-180	-76.8	-67.7	0	0	0	112.2	I399 P402 F403 A406 L454 I460 Y461 T462	I399-F458 HydrophobicContact CD1-CE2 4.46Å; I399-F458 HydrophobicContact CD1-CZ 4.34Å; I399-F458 HydrophobicContact CG2-CZ 4.09Å; P402-F458 HydrophobicContact CB-CD2 3.52Å; P402-F458 HydrophobicContact CB-CE2 4.06Å; P402-F458 HydrophobicContact CB-CG 4.43Å; F403-F458 HydrophobicContact CD2-CD1 4.31Å; A406-F458 HydrophobicContact CB-CB 3.56Å; A406-F458 WeakPolarHBondContact CB-O 3.23Å; L454-F458 HydrophobicContact CD2-CE2 4.27Å; L454-F458 VanDerWaalsContact O-CD2 3.23Å; L454-F458 WeakPolarHBondContact O-CD2 3.37Å; L454-F458 PolarHBondContact O-N 2.96Å; F458-I460 VanDerWaalsContact C-N 3.35Å; F458-Y461 WeakPolarHBondContact O-CB 3.21Å; F458-Y461 PolarHBondContact O-N 3.36Å; F458-Y461 VanDerWaalsContact O-N 3.16Å; F458-T462 PolarHBondContact O-N 3.31Å; F458-T462 PolarHBondContact O-OG1 3.47Å
459	S	94.8	Very high	92.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.9	-37.3	175.4	179.4	0	0	0	0	112.2	F409 D411 M455 G456 T462 G463	F409-S459 PolarHBondContact O-OG 3.49Å; D411-S459 PolarHBondContact O-OG 2.99Å; M455-S459 WeakPolarHBondContact O-CB 3.4Å; M455-S459 PolarHBondContact O-N 2.77Å; G456-S459 PolarHBondContact O-N 2.94Å; S459-T462 PolarHBondContact O-OG1 3.1Å; S459-G463 WeakPolarHBondContact O-CA 3.41Å; S459-G463 PolarHBondContact O-N 2.95Å
460	I	94.5	Very high	92.2	Very high	36 Å²	36	31 Å²	31	19%	0.185	15%	0.149	C	C	.	.	H	α-helix	trans	-63	-46.3	170.3	-66.5	164	0	0	0	110.3	L419 G456 I457 F458 G463 L464	L419-I460 HydrophobicContact CB-CD1 4.21Å; L419-I460 HydrophobicContact CD2-CD1 3.83Å; G456-I460 VanDerWaalsContact O-CG1 3.31Å; G456-I460 WeakPolarHBondContact O-CG1 3.33Å; G456-I460 PolarHBondContact O-N 3.44Å; I457-I460 PolarHBondContact O-N 2.96Å; F458-I460 VanDerWaalsContact C-N 3.35Å; I460-G463 PolarHBondContact O-N 3.39Å; I460-L464 HydrophobicContact CG2-CD1 4.22Å; I460-L464 WeakPolarHBondContact O-CB 3.23Å; I460-L464 VanDerWaalsContact O-CG 3.3Å; I460-L464 WeakPolarHBondContact O-CG 3.28Å; I460-L464 PolarHBondContact O-N 3.48Å
461	Y	94.3	Very high	91.9	Very high	117 Å²	117	29.4 Å²	29.4	46%	0.459	15%	0.145	S	C	.	.	H	α-helix	trans	-59.8	-49.4	178.3	170.8	-101.8	0	0	0	112.4	I457 F458 L464 I465	I457-Y461 PolarHBondContact O-N 2.74Å; I457-Y461 VanDerWaalsContact O-N 3.12Å; F458-Y461 WeakPolarHBondContact O-CB 3.21Å; F458-Y461 PolarHBondContact O-N 3.36Å; F458-Y461 VanDerWaalsContact O-N 3.16Å; Y461-L464 PolarHBondContact O-N 3.42Å; Y461-I465 HydrophobicContact CE1-CG1 4.29Å; Y461-I465 HydrophobicContact CE2-CD1 4.47Å; Y461-I465 HydrophobicContact CE2-CG1 4.36Å; Y461-I465 WeakPolarHBondContact O-CG1 3.44Å; Y461-I465 PolarHBondContact O-N 3.22Å; Y461-I465 VanDerWaalsContact O-N 3.1Å
462	T	92.3	Very high	91.8	Very high	7 Å²	7	33.4 Å²	33.4	4%	0.043	16%	0.162	C	C	.	.	H	α-helix	trans	-70.8	-34.8	179.2	55.6	0	0	0	0	112.4	A406 V407 F458 S459 L464 I465 Y466	A406-T462 HydrophobicContact CB-CG2 3.68Å; A406-T462 WeakPolarHBondContact CB-OG1 3.46Å; A406-T462 WeakPolarHBondContact O-CB 3.49Å; A406-T462 PolarHBondContact O-OG1 2.98Å; V407-T462 HydrophobicContact CG2-CG2 4.3Å; F458-T462 PolarHBondContact O-N 3.31Å; F458-T462 PolarHBondContact O-OG1 3.47Å; S459-T462 PolarHBondContact O-OG1 3.1Å; T462-L464 VanDerWaalsContact C-N 3.29Å; T462-L464 PolarHBondContact O-N 2.98Å; T462-I465 WeakPolarHBondContact O-CB 3.43Å; T462-I465 PolarHBondContact O-N 3.2Å; T462-I465 VanDerWaalsContact O-N 3.12Å; T462-Y466 PolarHBondContact O-N 3.2Å
463	G	92.1	Very high	91.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-38.4	173.6	0	0	0	0	0	112.2	S459 I460 Y466 N467 D468	S459-G463 WeakPolarHBondContact O-CA 3.41Å; S459-G463 PolarHBondContact O-N 2.95Å; I460-G463 PolarHBondContact O-N 3.39Å; G463-Y466 PolarHBondContact O-N 2.66Å; G463-N467 WeakPolarHBondContact O-CA 3.28Å; G463-N467 PolarHBondContact O-N 3.29Å; G463-D468 PolarHBondContact O-N 3.31Å
464	L	91.2	Very high	91.1	Very high	50 Å²	50	35.6 Å²	35.6	26%	0.262	18%	0.176	S	C	.	.	H	α-helix	trans	-68.8	-36.2	171.9	-72.3	174.6	0	0	0	112.8	I460 Y461 T462 N467 L474 F520	I460-L464 HydrophobicContact CG2-CD1 4.22Å; I460-L464 WeakPolarHBondContact O-CB 3.23Å; I460-L464 VanDerWaalsContact O-CG 3.3Å; I460-L464 WeakPolarHBondContact O-CG 3.28Å; I460-L464 PolarHBondContact O-N 3.48Å; Y461-L464 PolarHBondContact O-N 3.42Å; T462-L464 VanDerWaalsContact C-N 3.29Å; T462-L464 PolarHBondContact O-N 2.98Å; L464-N467 PolarHBondContact O-N 3.34Å; L464-L474 HydrophobicContact CD2-CD1 4.19Å; L464-F520 HydrophobicContact CB-CE1 3.81Å; L464-F520 HydrophobicContact CB-CZ 4.11Å
465	I	92.1	Very high	90.7	Very high	36 Å²	36	39.6 Å²	39.6	19%	0.185	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-42.6	173.5	-67.3	-67	0	0	0	111.4	Y461 T462 N467 F520 G521 I522	Y461-I465 HydrophobicContact CE1-CG1 4.29Å; Y461-I465 HydrophobicContact CE2-CD1 4.47Å; Y461-I465 HydrophobicContact CE2-CG1 4.36Å; Y461-I465 WeakPolarHBondContact O-CG1 3.44Å; Y461-I465 PolarHBondContact O-N 3.22Å; Y461-I465 VanDerWaalsContact O-N 3.1Å; T462-I465 WeakPolarHBondContact O-CB 3.43Å; T462-I465 PolarHBondContact O-N 3.2Å; T462-I465 VanDerWaalsContact O-N 3.12Å; I465-N467 PolarHBondContact O-N 2.88Å; I465-F520 HydrophobicContact CD1-CD2 4.18Å; I465-F520 HydrophobicContact CD1-CE2 3.59Å; I465-F520 HydrophobicContact CD1-CZ 3.99Å; I465-G521 CarbonylContact O-C 3.37Å; I465-G521 WeakPolarHBondContact O-CA 3.29Å; I465-I522 PolarHBondContact O-N 2.89Å
466	Y	90.5	Very high	90.2	Very high	7 Å²	7	43.8 Å²	43.8	3%	0.027	22%	0.22	C	C	.	.	H	α-helix	trans	-73.6	-16	173.9	-65.8	-22.4	0	0	0	113.2	V407 T462 G463 D468 I522 Y539 S746	V407-Y466 PolarHBondContact O-OH 2.77Å; T462-Y466 PolarHBondContact O-N 3.2Å; G463-Y466 PolarHBondContact O-N 2.66Å; Y466-D468 VanDerWaalsContact C-N 3.3Å; Y466-I522 HydrophobicContact CD1-CD1 4.37Å; Y466-Y539 HydrophobicContact CD1-CE1 4.42Å; Y466-Y539 HydrophobicContact CE1-CE1 4.1Å; Y466-S746 WeakPolarHBondContact CE2-OG 3.48Å
467	N	89.8	Confident	89.6	Confident	10 Å²	10	49.6 Å²	49.6	5%	0.053	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	44.1	-174.8	-162.4	9.4	0	0	0	112.2	G463 L464 I465 S473 L474 I522 P524	G463-N467 WeakPolarHBondContact O-CA 3.28Å; G463-N467 PolarHBondContact O-N 3.29Å; L464-N467 PolarHBondContact O-N 3.34Å; I465-N467 PolarHBondContact O-N 2.88Å; N467-S473 VanDerWaalsContact O-CA 3.27Å; N467-S473 WeakPolarHBondContact O-CA 3.12Å; N467-S473 WeakPolarHBondContact O-CB 3.46Å; N467-L474 PolarHBondContact ND2-O 3.46Å; N467-L474 VanDerWaalsContact ND2-O 3.13Å; N467-L474 PolarHBondContact OD1-N 3.33Å; N467-L474 PolarHBondContact OD1-O 3.1Å; N467-I522 WeakPolarHBondContact CB-O 3.16Å; N467-I522 PolarHBondContact ND2-O 3.5Å; N467-P524 WeakPolarHBondContact ND2-CG 3.46Å
468	D	88.6	Confident	88.8	Confident	26 Å²	26	47.2 Å²	47.2	14%	0.139	24%	0.241	C	C	.	.			trans	-119.9	122.5	177.2	-80.5	-30.2	0	0	0	110.1	C412 G463 Y466	C412-D468 PolarHBondContact N-O 3.35Å; G463-D468 PolarHBondContact O-N 3.31Å; Y466-D468 VanDerWaalsContact C-N 3.3Å
469	C	90	Very high	88.2	Confident	31 Å²	31	47.1 Å²	47.1	21%	0.209	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-132.8	106	173.4	-176	0	0	0	0	108.7	D411 C412 S471 K472 L474	D411-C469 WeakPolarHBondContact OD1-CA 3.31Å; C412-C469 HydrophobicContact CB-CB 4.15Å; C469-S471 PolarHBondContact O-N 3.09Å; C469-K472 PolarHBondContact N-O 3.36Å; C469-K472 PolarHBondContact O-N 3.44Å; C469-L474 HydrophobicContact CB-CG 4.47Å
470	F	87.4	Confident	87.4	Confident	58 Å²	58	47.9 Å²	47.9	25%	0.254	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	46.3	-172.6	-62.5	-68.8	0	0	0	112.5	D411 G413 H414 V417 K472 W757 T787	D411-F470 PolarHBondContact OD1-N 3.02Å; D411-F470 PolarHBondContact OD2-N 2.99Å; G413-F470 VanDerWaalsContact CA-CE2 3.48Å; H414-F470 AromaticContact CD2-CD1 3.91Å; H414-F470 AromaticContact CD2-CE1 3.55Å; H414-F470 AromaticContact NE2-CD1 3.64Å; H414-F470 AromaticContact NE2-CE1 3.73Å; V417-F470 HydrophobicContact CG2-CZ 4.5Å; F470-K472 VanDerWaalsContact C-N 3.26Å; F470-K472 PolarHBondContact O-N 3.24Å; F470-W757 HydrophobicContact CB-CE3 4.25Å; F470-W757 HydrophobicContact CB-CZ3 4.2Å; F470-T787 HydrophobicContact CE1-CG2 4.35Å
471	S	85.2	Confident	86.8	Confident	10 Å²	10	48.5 Å²	48.5	7%	0.07	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	4.8	-173.4	78.1	0	0	0	0	117.5	C469 N527 S753 W757	C469-S471 PolarHBondContact O-N 3.09Å; S471-N527 PolarHBondContact O-ND2 3.3Å; S471-S753 PolarHBondContact N-OG 2.72Å; S471-W757 WeakPolarHBondContact OG-CB 3.28Å
472	K	87.7	Confident	86	Confident	94 Å²	94	43.8 Å²	43.8	41%	0.409	24%	0.235	S	C	.	.	B	Isolated β-bridge	trans	-109.9	146.1	177.3	-62.7	-57.6	179.6	-166.8	0	111.9	C469 F470 N527 W757	C469-K472 PolarHBondContact N-O 3.36Å; C469-K472 PolarHBondContact O-N 3.44Å; F470-K472 VanDerWaalsContact C-N 3.26Å; F470-K472 PolarHBondContact O-N 3.24Å; K472-N527 WeakPolarHBondContact CA-ND2 3.45Å; K472-W757 HydrophobicContact CG-CZ2 4.38Å
473	S	86.9	Confident	85.3	Confident	37 Å²	37	46.1 Å²	46.1	26%	0.259	25%	0.249	S	C	.	.			trans	-93.1	144.7	-179.8	54.8	0	0	0	0	112.1	N467 N527	N467-S473 VanDerWaalsContact O-CA 3.27Å; N467-S473 WeakPolarHBondContact O-CA 3.12Å; N467-S473 WeakPolarHBondContact O-CB 3.46Å; S473-N527 PolarHBondContact N-ND2 2.8Å; S473-N527 VanDerWaalsContact N-ND2 3.16Å
474	L	84.4	Confident	84.5	Confident	68 Å²	68	53.9 Å²	53.9	36%	0.356	29%	0.285	S	S	.	.			trans	-97	127.7	176.8	-60.4	173.8	0	0	0	110.1	L464 N467 C469 I476 P524	L464-L474 HydrophobicContact CD2-CD1 4.19Å; N467-L474 PolarHBondContact ND2-O 3.46Å; N467-L474 VanDerWaalsContact ND2-O 3.13Å; N467-L474 PolarHBondContact OD1-N 3.33Å; N467-L474 PolarHBondContact OD1-O 3.1Å; C469-L474 HydrophobicContact CB-CG 4.47Å; L474-I476 HydrophobicContact CB-CD1 4.38Å; L474-I476 HydrophobicContact CB-CG1 4.18Å; L474-I476 PolarHBondContact O-N 3.11Å; L474-P524 WeakPolarHBondContact O-CG 3.5Å
475	N	85.8	Confident	83.6	Confident	109 Å²	109	52.8 Å²	52.8	58%	0.583	28%	0.281	S	S	*	.			trans	-96.5	89.6	175.2	-173.2	13	0	0	0	110.4	G478 P524	N475-G478 WeakPolarHBondContact OD1-CA 3.28Å; N475-G478 PolarHBondContact OD1-N 3.11Å; N475-G478 VanDerWaalsContact OD1-N 3.09Å; N475-P524 HydrophobicContact CB-CG 4.23Å
476	I	82.2	Confident	82.5	Confident	98 Å²	98	51.3 Å²	51.3	50%	0.503	27%	0.273	S	S	.	.	S	Bend	trans	-93.7	-43.6	-175.5	-57.2	172.3	0	0	0	111.4	L474 Y518	L474-I476 HydrophobicContact CB-CD1 4.38Å; L474-I476 HydrophobicContact CB-CG1 4.18Å; L474-I476 PolarHBondContact O-N 3.11Å; I476-Y518 PolarHBondContact N-OH 3.44Å
477	F	81	Confident	81.6	Confident	122 Å²	122	55.7 Å²	55.7	54%	0.535	29%	0.293	S	S	.	.	S	Bend	trans	-109	1.7	-173	-63.3	-77.2	0	0	0	114.5	Y518 P519 F520	F477-Y518 HydrophobicContact CB-CD2 4.48Å; F477-Y518 HydrophobicContact CB-CE2 3.68Å; F477-Y518 HydrophobicContact CD2-CE1 4.42Å; F477-Y518 HydrophobicContact CD2-CE2 4.46Å; F477-Y518 AromaticContact CD2-CZ 3.95Å; F477-Y518 PolarHBondContact N-OH 3.32Å; F477-P519 HydrophobicContact CB-CG 4.39Å; F477-P519 HydrophobicContact CG-CG 4.46Å; F477-F520 HydrophobicContact CD2-CB 4.42Å; F477-F520 HydrophobicContact CE2-CB 3.89Å
478	G	79.4	Confident	80.7	Confident	33 Å²	33	66.4 Å²	66.4	34%	0.34	33%	0.332	S	S	.	.			trans	83.9	144.9	-171.2	0	0	0	0	0	112.6	N475 Y518	N475-G478 WeakPolarHBondContact OD1-CA 3.28Å; N475-G478 PolarHBondContact OD1-N 3.11Å; N475-G478 VanDerWaalsContact OD1-N 3.09Å; G478-Y518 WeakPolarHBondContact O-CD2 3.49Å; G478-Y518 VanDerWaalsContact O-CE2 3.24Å; G478-Y518 WeakPolarHBondContact O-CE2 3.48Å
479	S	81.7	Confident	79.6	Confident	41 Å²	41	70 Å²	70	29%	0.287	35%	0.352	S	S	.	.			trans	-66.9	134.9	177.4	167	0	0	0	0	111	W481	S479-W481 PolarHBondContact O-N 3.11Å; S479-W481 PolarHBondContact OG-N 2.84Å; S479-W481 VanDerWaalsContact OG-N 3.07Å; S479-W481 PolarHBondContact OG-O 2.89Å
480	S	79.2	Confident	78.4	Confident	15 Å²	15	70.4 Å²	70.4	11%	0.105	36%	0.361	C	S	.	.	S	Bend	trans	-80.4	-2.8	173.9	-57.6	0	0	0	0	112.4	F514 D523	S480-F514 VanDerWaalsContact O-CD2 3.24Å; S480-F514 WeakPolarHBondContact O-CD2 3.19Å; S480-F514 PolarHBondContact O-N 3.46Å; S480-D523 WeakPolarHBondContact CB-OD2 2.91Å; S480-D523 PolarHBondContact N-OD2 3.16Å
481	W	80.4	Confident	77.5	Confident	50 Å²	50	70.8 Å²	70.8	19%	0.189	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-103.5	131.9	172.8	-66.4	79.4	0	0	0	110.4	S479 L505 P507 V512 Y513 D523 I525 W526	S479-W481 PolarHBondContact O-N 3.11Å; S479-W481 PolarHBondContact OG-N 2.84Å; S479-W481 VanDerWaalsContact OG-N 3.07Å; S479-W481 PolarHBondContact OG-O 2.89Å; W481-L505 HydrophobicContact CZ3-CB 4.37Å; W481-P507 HydrophobicContact CH2-CB 3.88Å; W481-P507 HydrophobicContact CZ3-CB 4.1Å; W481-V512 WeakPolarHBondContact CA-O 3.46Å; W481-V512 HydrophobicContact CE3-CG1 4.17Å; W481-V512 HydrophobicContact CZ3-CG1 4.31Å; W481-Y513 HydrophobicContact CD2-CD2 4.15Å; W481-Y513 AromaticContact CE2-CD2 3.76Å; W481-Y513 AromaticContact CZ2-CD2 3.99Å; W481-Y513 HydrophobicContact CZ2-CD2 3.99Å; W481-Y513 AromaticContact NE1-CD2 3.9Å; W481-D523 VanDerWaalsContact CD1-OD2 3.29Å; W481-I525 HydrophobicContact CB-CB 4.46Å; W481-I525 HydrophobicContact CB-CG1 4.29Å; W481-I525 HydrophobicContact CB-CG2 4.19Å; W481-I525 VanDerWaalsContact CD1-CG2 3.5Å; W481-I525 HydrophobicContact CG-CG2 3.86Å; W481-W526 HydrophobicContact CZ2-CZ2 4.23Å
482	S	78.5	Confident	77	Confident	17 Å²	17	71.8 Å²	71.8	12%	0.119	37%	0.37	C	S	.	.			trans	-123.7	137	174.8	83.7	0	0	0	0	111.6	P485 G511 V512	S482-P485 WeakPolarHBondContact OG-CD 3.09Å; S482-P485 WeakPolarHBondContact OG-CG 3.41Å; S482-G511 PolarHBondContact OG-O 2.99Å; S482-V512 PolarHBondContact N-O 3.38Å
483	V	77.4	Confident	76.5	Confident	56 Å²	56	71.8 Å²	71.8	34%	0.339	38%	0.375	S	S	.	.	S	Bend	trans	-90.6	-21.3	-178.6	-168.5	0	0	0	0	111.6	P485 M486 F487 W492 L505	V483-P485 VanDerWaalsContact C-CD 3.4Å; V483-M486 WeakPolarHBondContact O-CB 3.17Å; V483-M486 PolarHBondContact O-N 2.9Å; V483-M486 VanDerWaalsContact O-N 3.16Å; V483-F487 HydrophobicContact CG1-CD2 4.3Å; V483-F487 HydrophobicContact CG1-CE2 3.73Å; V483-W492 HydrophobicContact CG1-CE3 3.85Å; V483-W492 HydrophobicContact CG1-CH2 3.79Å; V483-W492 HydrophobicContact CG1-CZ3 3.12Å; V483-L505 HydrophobicContact CG2-CD2 4.35Å
484	Q	75.1	Confident	75.9	Confident	163 Å²	163	75.6 Å²	75.6	76%	0.762	40%	0.397	S	S	*	.	H	α-helix	trans	-55.6	-38.2	-176.3	-61.9	178.3	-19.5	0	0	114.7	M486 F487 R488	Q484-M486 VanDerWaalsContact C-N 3.3Å; Q484-M486 PolarHBondContact O-N 3.31Å; Q484-F487 PolarHBondContact O-N 3.47Å; Q484-R488 PolarHBondContact O-N 2.85Å
485	P	71.8	Confident	75.4	Confident	27 Å²	27	77.9 Å²	77.9	18%	0.175	41%	0.406	C	S	.	.	H	α-helix	trans	-68.9	-25.2	-179.4	-22.4	37	0	0	0	113.8	S482 V483 R488 N489 G511 V512	S482-P485 WeakPolarHBondContact OG-CD 3.09Å; S482-P485 WeakPolarHBondContact OG-CG 3.41Å; V483-P485 VanDerWaalsContact C-CD 3.4Å; P485-R488 PolarHBondContact O-N 3.03Å; P485-N489 WeakPolarHBondContact O-CB 3.29Å; P485-N489 PolarHBondContact O-N 3.28Å; P485-G511 WeakPolarHBondContact CG-O 2.97Å; P485-V512 HydrophobicContact CB-CG2 4.04Å
486	M	69.6	Low	75	Confident	5 Å²	5	74.7 Å²	74.7	3%	0.025	39%	0.39	C	S	.	.	H	α-helix	trans	-65.1	-42	174	-82.5	-77.2	-143.3	0	0	112.2	V483 Q484 R488 G490 T491 W492 Q504 L505 I509 V512	V483-M486 WeakPolarHBondContact O-CB 3.17Å; V483-M486 PolarHBondContact O-N 2.9Å; V483-M486 VanDerWaalsContact O-N 3.16Å; Q484-M486 VanDerWaalsContact C-N 3.3Å; Q484-M486 PolarHBondContact O-N 3.31Å; M486-R488 VanDerWaalsContact C-N 3.33Å; M486-G490 PolarHBondContact O-N 3.45Å; M486-T491 PolarHBondContact O-N 3.45Å; M486-T491 PolarHBondContact O-OG1 2.91Å; M486-T491 VanDerWaalsContact O-OG1 3.04Å; M486-T491 PolarHBondContact SD-OG1 3.17Å; M486-W492 HydrophobicContact CB-CD2 3.68Å; M486-W492 HydrophobicContact CB-CE3 3.95Å; M486-W492 HydrophobicContact CB-CG 3.96Å; M486-W492 HydrophobicContact CE-CZ2 3.61Å; M486-W492 HydrophobicContact CG-CD2 4.08Å; M486-W492 HydrophobicContact CG-CZ2 4.07Å; M486-W492 HydrophobicContact SD-CD2 4.33Å; M486-W492 HydrophobicContact SD-CG 4.38Å; M486-W492 HydrophobicContact SD-CZ2 4.33Å; M486-Q504 WeakPolarHBondContact CE-O 3.41Å; M486-L505 HydrophobicContact CE-CB 4.44Å; M486-I509 HydrophobicContact SD-CD1 3.89Å; M486-V512 HydrophobicContact CG-CG2 4.05Å
487	F	71.4	Confident	74.6	Confident	99 Å²	99	74.7 Å²	74.7	43%	0.434	39%	0.389	S	S	.	.	H	α-helix	trans	-69.4	-33.6	175	-68.7	-75.2	0	0	0	112	V483 Q484 G490 W492 M497	V483-F487 HydrophobicContact CG1-CD2 4.3Å; V483-F487 HydrophobicContact CG1-CE2 3.73Å; Q484-F487 PolarHBondContact O-N 3.47Å; F487-G490 PolarHBondContact O-N 3.2Å; F487-W492 HydrophobicContact CD1-CB 4.11Å; F487-W492 HydrophobicContact CD2-CE3 4.48Å; F487-W492 HydrophobicContact CE1-CB 4.08Å; F487-W492 HydrophobicContact CE1-CE3 4.33Å; F487-W492 AromaticContact CE2-CE3 3.87Å; F487-W492 HydrophobicContact CE2-CE3 3.87Å; F487-W492 HydrophobicContact CE2-CZ3 4.33Å; F487-W492 AromaticContact CZ-CE3 3.77Å; F487-W492 HydrophobicContact CZ-CE3 3.77Å; F487-W492 HydrophobicContact CZ-CZ3 4.43Å; F487-M497 HydrophobicContact CE1-CE 4Å; F487-M497 HydrophobicContact CZ-CE 3.69Å
488	R	70.5	Confident	74.4	Confident	235 Å²	235	76.9 Å²	76.9	89%	0.887	40%	0.401	S	S	*	.	H	α-helix	trans	-74	-30.3	-179.5	-164.8	175	-178.3	178.8	0.5	113.2	Q484 P485 M486 G490	Q484-R488 PolarHBondContact O-N 2.85Å; P485-R488 PolarHBondContact O-N 3.03Å; M486-R488 VanDerWaalsContact C-N 3.33Å; R488-G490 VanDerWaalsContact C-N 3.31Å
489	N	66.4	Low	74.5	Confident	102 Å²	102	81.1 Å²	81.1	55%	0.545	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.2	178.7	-156.1	24	0	0	0	113.2	P485 T491	P485-N489 WeakPolarHBondContact O-CB 3.29Å; P485-N489 PolarHBondContact O-N 3.28Å; N489-T491 PolarHBondContact O-N 3.47Å
490	G	64.9	Low	74.4	Confident	40 Å²	40	83 Å²	83	41%	0.412	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	8.6	177.1	0	0	0	0	0	115.2	M486 F487 R488	M486-G490 PolarHBondContact O-N 3.45Å; F487-G490 PolarHBondContact O-N 3.2Å; R488-G490 VanDerWaalsContact C-N 3.31Å
491	T	68.4	Low	74.2	Confident	65 Å²	65	87.8 Å²	87.8	40%	0.399	45%	0.45	S	S	.	.	S	Bend	trans	-72.8	-31	176.1	45.8	0	0	0	0	111.7	M486 N489 I509	M486-T491 PolarHBondContact O-N 3.45Å; M486-T491 PolarHBondContact O-OG1 2.91Å; M486-T491 VanDerWaalsContact O-OG1 3.04Å; M486-T491 PolarHBondContact SD-OG1 3.17Å; N489-T491 PolarHBondContact O-N 3.47Å; T491-I509 HydrophobicContact CG2-CD1 4.45Å
492	W	74.2	Confident	74.2	Confident	31 Å²	31	94.2 Å²	94.2	12%	0.117	48%	0.475	C	S	.	.	S	Bend	trans	-110.4	109.2	174.7	-67.2	3.6	0	0	0	110.3	V483 M486 F487 L503 L505	V483-W492 HydrophobicContact CG1-CE3 3.85Å; V483-W492 HydrophobicContact CG1-CH2 3.79Å; V483-W492 HydrophobicContact CG1-CZ3 3.12Å; M486-W492 HydrophobicContact CB-CD2 3.68Å; M486-W492 HydrophobicContact CB-CE3 3.95Å; M486-W492 HydrophobicContact CB-CG 3.96Å; M486-W492 HydrophobicContact CE-CZ2 3.61Å; M486-W492 HydrophobicContact CG-CD2 4.08Å; M486-W492 HydrophobicContact CG-CZ2 4.07Å; M486-W492 HydrophobicContact SD-CD2 4.33Å; M486-W492 HydrophobicContact SD-CG 4.38Å; M486-W492 HydrophobicContact SD-CZ2 4.33Å; F487-W492 HydrophobicContact CD1-CB 4.11Å; F487-W492 HydrophobicContact CD2-CE3 4.48Å; F487-W492 HydrophobicContact CE1-CB 4.08Å; F487-W492 HydrophobicContact CE1-CE3 4.33Å; F487-W492 AromaticContact CE2-CE3 3.87Å; F487-W492 HydrophobicContact CE2-CE3 3.87Å; F487-W492 HydrophobicContact CE2-CZ3 4.33Å; F487-W492 AromaticContact CZ-CE3 3.77Å; F487-W492 HydrophobicContact CZ-CE3 3.77Å; F487-W492 HydrophobicContact CZ-CZ3 4.43Å; W492-L503 HydrophobicContact CE3-CD1 4.2Å; W492-L503 HydrophobicContact CH2-CB 3.91Å; W492-L503 HydrophobicContact CH2-CD1 4.22Å; W492-L503 HydrophobicContact CZ2-CB 3.76Å; W492-L503 HydrophobicContact CZ3-CD1 3.98Å; W492-L505 HydrophobicContact CH2-CD1 4.32Å; W492-L505 HydrophobicContact CH2-CD2 4.4Å; W492-L505 HydrophobicContact CH2-CG 4Å; W492-L505 HydrophobicContact CZ2-CG 4.08Å
493	N	78.1	Confident	74.3	Confident	94 Å²	94	96.3 Å²	96.3	50%	0.503	48%	0.484	S	S	.	.			trans	-103.9	160.2	172.1	-73	-28.6	0	0	0	110.5	H495 V496 M497	N493-H495 PolarHBondContact O-N 3.17Å; N493-V496 HydrophobicContact CB-CG2 4.4Å; N493-V496 PolarHBondContact O-N 3.37Å; N493-M497 PolarHBondContact O-N 2.97Å
494	T	74.3	Confident	74.5	Confident	118 Å²	118	101.5 Å²	101.5	72%	0.724	51%	0.505	S	S	*	.	H	α-helix	trans	-53.6	-36	176.1	45.5	0	0	0	0	112.6	M497 E498	T494-M497 PolarHBondContact O-N 3.44Å; T494-E498 PolarHBondContact O-N 3.01Å
495	H	73.9	Confident	74.6	Confident	115 Å²	115	96.3 Å²	96.3	53%	0.532	48%	0.482	S	S	.	.	H	α-helix	trans	-63.4	-40.1	175	-159.4	-88.8	0	0	0	113.4	N493 M497 E498 E499	N493-H495 PolarHBondContact O-N 3.17Å; H495-M497 VanDerWaalsContact C-N 3.31Å; H495-M497 PolarHBondContact O-N 3.06Å; H495-E498 PolarHBondContact O-N 3.25Å; H495-E499 IonicContact CE1-OE1 3.06Å; H495-E499 PolarHBondContact CE1-OE1 3.3Å; H495-E499 IonicContact CE1-OE2 3.33Å; H495-E499 PolarHBondContact CE1-OE2 3.34Å; H495-E499 IonicContact ND1-OE1 3.52Å; H495-E499 IonicContact ND1-OE2 2.89Å; H495-E499 PolarHBondContact ND1-OE2 3.25Å; H495-E499 WeakPolarHBondContact O-CB 3.37Å; H495-E499 WeakPolarHBondContact O-CG 3.4Å; H495-E499 PolarHBondContact O-N 3.41Å
496	V	75.7	Confident	74.8	Confident	42 Å²	42	98.6 Å²	98.6	26%	0.255	49%	0.493	S	S	.	.	H	α-helix	trans	-70.6	-30.7	-179.4	179.6	0	0	0	0	111.2	N493 N500 L503	N493-V496 HydrophobicContact CB-CG2 4.4Å; N493-V496 PolarHBondContact O-N 3.37Å; V496-N500 WeakPolarHBondContact O-CB 3.48Å; V496-N500 PolarHBondContact O-N 3.18Å; V496-L503 HydrophobicContact CG1-CD2 4.31Å
497	M	74.3	Confident	75	Confident	99 Å²	99	100.5 Å²	100.5	49%	0.488	51%	0.506	S	S	.	.	H	α-helix	trans	-70.1	-36.1	175	-171.4	97.8	81.9	0	0	112	F487 N493 T494 H495 L503	F487-M497 HydrophobicContact CE1-CE 4Å; F487-M497 HydrophobicContact CZ-CE 3.69Å; N493-M497 PolarHBondContact O-N 2.97Å; T494-M497 PolarHBondContact O-N 3.44Å; H495-M497 VanDerWaalsContact C-N 3.31Å; H495-M497 PolarHBondContact O-N 3.06Å; M497-L503 HydrophobicContact SD-CD1 3.67Å
498	E	77	Confident	75.1	Confident	168 Å²	168	97.8 Å²	97.8	79%	0.785	50%	0.502	S	S	*	.	H	α-helix	trans	-77.7	-33.7	178.3	-71	177.9	-177.9	0	0	112.1	T494 H495	T494-E498 PolarHBondContact O-N 3.01Å; H495-E498 PolarHBondContact O-N 3.25Å
499	E	81.4	Confident	75.2	Confident	122 Å²	122	87.8 Å²	87.8	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-81.1	-37.3	-180	-74.8	-177.8	140.2	0	0	114.1	H495	H495-E499 IonicContact CE1-OE1 3.06Å; H495-E499 PolarHBondContact CE1-OE1 3.3Å; H495-E499 IonicContact CE1-OE2 3.33Å; H495-E499 PolarHBondContact CE1-OE2 3.34Å; H495-E499 IonicContact ND1-OE1 3.52Å; H495-E499 IonicContact ND1-OE2 2.89Å; H495-E499 PolarHBondContact ND1-OE2 3.25Å; H495-E499 WeakPolarHBondContact O-CB 3.37Å; H495-E499 WeakPolarHBondContact O-CG 3.4Å; H495-E499 PolarHBondContact O-N 3.41Å
500	N	79.1	Confident	75.3	Confident	81 Å²	81	88.6 Å²	88.6	43%	0.433	48%	0.477	S	S	.	.			trans	-110.1	118.3	-172.8	-67	-56.2	0	0	0	112.5	V496 Y502	V496-N500 WeakPolarHBondContact O-CB 3.48Å; V496-N500 PolarHBondContact O-N 3.18Å; N500-Y502 PolarHBondContact O-N 2.74Å
501	P	76.2	Confident	75.4	Confident	115 Å²	115	88 Å²	88	75%	0.747	47%	0.47	S	S	*	.	S	Bend	trans	-72.9	-16.1	176.7	28.9	-34.3	0	0	0	113.5
502	Y	79.8	Confident	75.4	Confident	184 Å²	184	84.9 Å²	84.9	72%	0.722	45%	0.451	S	S	*	.			trans	-123.1	125.5	178.4	-61	-72	0	0	0	110.5	N500	N500-Y502 PolarHBondContact O-N 2.74Å
503	L	81.2	Confident	75.3	Confident	61 Å²	61	86.7 Å²	86.7	32%	0.319	46%	0.458	S	S	.	.			trans	-110.8	130.9	177.9	-64.5	169.5	0	0	0	109.7	W492 V496 M497	W492-L503 HydrophobicContact CE3-CD1 4.2Å; W492-L503 HydrophobicContact CH2-CB 3.91Å; W492-L503 HydrophobicContact CH2-CD1 4.22Å; W492-L503 HydrophobicContact CZ2-CB 3.76Å; W492-L503 HydrophobicContact CZ3-CD1 3.98Å; V496-L503 HydrophobicContact CG1-CD2 4.31Å; M497-L503 HydrophobicContact SD-CD1 3.67Å
504	Q	80.4	Confident	74.6	Confident	166 Å²	166	88.3 Å²	88.3	78%	0.776	46%	0.461	S	S	*	.			trans	-97.4	130.8	176	-176.4	172.9	-12.5	0	0	110.1	M486	M486-Q504 WeakPolarHBondContact CE-O 3.41Å
505	L	78.3	Confident	74.1	Confident	53 Å²	53	85 Å²	85	28%	0.277	45%	0.45	S	S	.	.			trans	-87.1	123	168.9	-68.1	104.7	0	0	0	110	W481 V483 M486 W492 P507 V512	W481-L505 HydrophobicContact CZ3-CB 4.37Å; V483-L505 HydrophobicContact CG2-CD2 4.35Å; M486-L505 HydrophobicContact CE-CB 4.44Å; W492-L505 HydrophobicContact CH2-CD1 4.32Å; W492-L505 HydrophobicContact CH2-CD2 4.4Å; W492-L505 HydrophobicContact CH2-CG 4Å; W492-L505 HydrophobicContact CZ2-CG 4.08Å; L505-P507 WeakPolarHBondContact O-CD 3.3Å; L505-V512 HydrophobicContact CB-CG1 4.16Å; L505-V512 HydrophobicContact CD2-CG1 3.85Å
506	D	75.3	Confident	74	Confident	75 Å²	75	85 Å²	85	40%	0.401	45%	0.454	S	S	.	.			trans	-89.9	113.3	172.9	-171.6	-6.3	0	0	0	109.8	A508 I509	D506-A508 PolarHBondContact O-N 3.49Å; D506-A508 WeakPolarHBondContact OD1-CB 3.39Å; D506-A508 PolarHBondContact OD1-N 2.52Å; D506-I509 HydrophobicContact CB-CD1 4Å; D506-I509 HydrophobicContact CB-CG1 4.19Å; D506-I509 PolarHBondContact O-N 2.92Å
507	P	74.6	Confident	74.2	Confident	46 Å²	46	87.6 Å²	87.6	30%	0.299	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.4	178.9	28	-33.3	0	0	0	113.7	W481 L505 I509 V603	W481-P507 HydrophobicContact CH2-CB 3.88Å; W481-P507 HydrophobicContact CZ3-CB 4.1Å; L505-P507 WeakPolarHBondContact O-CD 3.3Å; P507-I509 PolarHBondContact O-N 3.2Å; P507-V603 HydrophobicContact CB-CG1 3.93Å; P507-V603 HydrophobicContact CB-CG2 3.83Å; P507-V603 HydrophobicContact CG-CG1 3.7Å; P507-V603 HydrophobicContact CG-CG2 4.14Å
508	A	72.4	Confident	74.7	Confident	42 Å²	42	84 Å²	84	35%	0.347	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-16	179.3	0	0	0	0	0	112.8	D506 V603	D506-A508 PolarHBondContact O-N 3.49Å; D506-A508 WeakPolarHBondContact OD1-CB 3.39Å; D506-A508 PolarHBondContact OD1-N 2.52Å; A508-V603 HydrophobicContact CB-CG1 3.92Å
509	I	73.3	Confident	75	Confident	25 Å²	25	80.7 Å²	80.7	13%	0.128	45%	0.446	C	S	.	.	S	Bend	trans	-80.9	124.9	179.8	-56.2	174.2	0	0	0	109.3	M486 T491 D506 P507 G511 V512	M486-I509 HydrophobicContact SD-CD1 3.89Å; T491-I509 HydrophobicContact CG2-CD1 4.45Å; D506-I509 HydrophobicContact CB-CD1 4Å; D506-I509 HydrophobicContact CB-CG1 4.19Å; D506-I509 PolarHBondContact O-N 2.92Å; P507-I509 PolarHBondContact O-N 3.2Å; I509-G511 PolarHBondContact O-N 3.45Å; I509-V512 HydrophobicContact CB-CG2 3.81Å; I509-V512 HydrophobicContact CG2-CG2 3.99Å; I509-V512 PolarHBondContact O-N 2.9Å
510	P	68.8	Low	75.3	Confident	119 Å²	119	78.3 Å²	78.3	77%	0.773	43%	0.434	S	S	*	.	B	Isolated β-bridge	trans	-61.6	127	-177.9	23.7	-32.5	0	0	0	111.4
511	G	66.8	Low	75.7	Confident	26 Å²	26	75.8 Å²	75.8	27%	0.268	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	-20	179.3	0	0	0	0	0	115	S482 P485 I509 Y513	S482-G511 PolarHBondContact OG-O 2.99Å; P485-G511 WeakPolarHBondContact CG-O 2.97Å; I509-G511 PolarHBondContact O-N 3.45Å; G511-Y513 VanDerWaalsContact C-N 3.34Å
512	V	68.8	Low	76.2	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-43.4	175	174.3	0	0	0	0	110.1	W481 S482 P485 M486 L505 I509	W481-V512 WeakPolarHBondContact CA-O 3.46Å; W481-V512 HydrophobicContact CE3-CG1 4.17Å; W481-V512 HydrophobicContact CZ3-CG1 4.31Å; S482-V512 PolarHBondContact N-O 3.38Å; P485-V512 HydrophobicContact CB-CG2 4.04Å; M486-V512 HydrophobicContact CG-CG2 4.05Å; L505-V512 HydrophobicContact CB-CG1 4.16Å; L505-V512 HydrophobicContact CD2-CG1 3.85Å; I509-V512 HydrophobicContact CB-CG2 3.81Å; I509-V512 HydrophobicContact CG2-CG2 3.99Å; I509-V512 PolarHBondContact O-N 2.9Å
513	Y	72.6	Confident	76.6	Confident	70 Å²	70	62.9 Å²	62.9	28%	0.275	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-110.1	125.1	163.8	-177.8	-116.8	0	0	0	108.3	W481 G511 G515 N516	W481-Y513 HydrophobicContact CD2-CD2 4.15Å; W481-Y513 AromaticContact CE2-CD2 3.76Å; W481-Y513 AromaticContact CZ2-CD2 3.99Å; W481-Y513 HydrophobicContact CZ2-CD2 3.99Å; W481-Y513 AromaticContact NE1-CD2 3.9Å; G511-Y513 VanDerWaalsContact C-N 3.34Å; Y513-G515 VanDerWaalsContact CE1-CA 3.48Å; Y513-G515 PolarHBondContact O-N 2.99Å; Y513-G515 VanDerWaalsContact O-N 3.1Å; Y513-N516 PolarHBondContact OH-O 2.73Å
514	F	61.6	Low	76.8	Confident	127 Å²	127	60.6 Å²	60.6	56%	0.557	35%	0.353	S	S	*	.			trans	-70	-2.4	-178.3	-72.8	-72.8	0	0	0	113.8	S480 N516	S480-F514 VanDerWaalsContact O-CD2 3.24Å; S480-F514 WeakPolarHBondContact O-CD2 3.19Å; S480-F514 PolarHBondContact O-N 3.46Å; F514-N516 PolarHBondContact O-N 3.19Å
515	G	64.5	Low	77.1	Confident	48 Å²	48	54.9 Å²	54.9	50%	0.495	33%	0.327	S	S	.	.	S	Bend	trans	83.6	-9.7	178.5	0	0	0	0	0	114.5	Y513	Y513-G515 VanDerWaalsContact CE1-CA 3.48Å; Y513-G515 PolarHBondContact O-N 2.99Å; Y513-G515 VanDerWaalsContact O-N 3.1Å
516	N	71.9	Confident	77.5	Confident	115 Å²	115	54.8 Å²	54.8	62%	0.615	32%	0.323	S	S	*	.	S	Bend	trans	-104.9	132.4	177	-67.3	-23.3	0	0	0	110.3	Y513 F514	Y513-N516 PolarHBondContact OH-O 2.73Å; F514-N516 PolarHBondContact O-N 3.19Å
517	P	80.3	Confident	78	Confident	97 Å²	97	52.8 Å²	52.8	63%	0.63	31%	0.312	S	S	*	.			trans	-66.8	153.1	171.7	28.2	-33.2	0	0	0	110.8
518	Y	83.2	Confident	78.5	Confident	23 Å²	23	57.7 Å²	57.7	9%	0.09	34%	0.335	C	S	.	.			trans	-57.6	130	176.1	-170.8	-114.6	0	0	0	109.8	I476 F477 G478 F520	I476-Y518 PolarHBondContact N-OH 3.44Å; F477-Y518 HydrophobicContact CB-CD2 4.48Å; F477-Y518 HydrophobicContact CB-CE2 3.68Å; F477-Y518 HydrophobicContact CD2-CE1 4.42Å; F477-Y518 HydrophobicContact CD2-CE2 4.46Å; F477-Y518 AromaticContact CD2-CZ 3.95Å; F477-Y518 PolarHBondContact N-OH 3.32Å; G478-Y518 WeakPolarHBondContact O-CD2 3.49Å; G478-Y518 VanDerWaalsContact O-CE2 3.24Å; G478-Y518 WeakPolarHBondContact O-CE2 3.48Å; Y518-F520 WeakPolarHBondContact CD1-O 3.45Å; Y518-F520 WeakPolarHBondContact CE1-O 3.09Å; Y518-F520 PolarHBondContact O-N 2.96Å; Y518-F520 VanDerWaalsContact O-N 3.13Å
519	P	84.4	Confident	79.1	Confident	99 Å²	99	57 Å²	57	64%	0.643	33%	0.329	S	S	*	.	S	Bend	trans	-60.7	-27.7	-169.6	-28.2	35.4	0	0	0	115.4	F477	F477-P519 HydrophobicContact CB-CG 4.39Å; F477-P519 HydrophobicContact CG-CG 4.46Å
520	F	88	Confident	79.7	Confident	72 Å²	72	60.5 Å²	60.5	32%	0.316	36%	0.357	S	S	.	.	S	Bend	trans	-149.1	108.6	-175.5	-179.2	-109.4	0	0	0	112.2	L464 I465 F477 Y518	L464-F520 HydrophobicContact CB-CE1 3.81Å; L464-F520 HydrophobicContact CB-CZ 4.11Å; I465-F520 HydrophobicContact CD1-CD2 4.18Å; I465-F520 HydrophobicContact CD1-CE2 3.59Å; I465-F520 HydrophobicContact CD1-CZ 3.99Å; F477-F520 HydrophobicContact CD2-CB 4.42Å; F477-F520 HydrophobicContact CE2-CB 3.89Å; Y518-F520 WeakPolarHBondContact CD1-O 3.45Å; Y518-F520 WeakPolarHBondContact CE1-O 3.09Å; Y518-F520 PolarHBondContact O-N 2.96Å; Y518-F520 VanDerWaalsContact O-N 3.13Å
521	G	86.6	Confident	80.6	Confident	28 Å²	28	59 Å²	59	29%	0.289	34%	0.342	S	S	.	.	S	Bend	trans	84	-159.4	178.6	0	0	0	0	0	114	I465	I465-G521 CarbonylContact O-C 3.37Å; I465-G521 WeakPolarHBondContact O-CA 3.29Å
522	I	87.4	Confident	81.6	Confident	19 Å²	19	58.8 Å²	58.8	10%	0.097	33%	0.334	C	S	.	.	S	Bend	trans	-88.3	141.2	-178.8	-56.9	177	0	0	0	110.5	I465 Y466 N467 W526 F535 L536 Y539	I465-I522 PolarHBondContact O-N 2.89Å; Y466-I522 HydrophobicContact CD1-CD1 4.37Å; N467-I522 WeakPolarHBondContact CB-O 3.16Å; N467-I522 PolarHBondContact ND2-O 3.5Å; I522-W526 HydrophobicContact CG2-CB 4.41Å; I522-W526 HydrophobicContact CG2-CG 4.36Å; I522-F535 HydrophobicContact CG2-CE1 4Å; I522-L536 HydrophobicContact CD1-CD2 3.52Å; I522-Y539 HydrophobicContact CD1-CD1 4.3Å; I522-Y539 HydrophobicContact CD1-CE1 4.22Å
523	D	87.8	Confident	82.5	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.053	35%	0.353	C	S	.	.			trans	-62.9	130.3	179.8	-163.1	-41.6	0	0	0	111.3	S480 W481 I525 W526	S480-D523 WeakPolarHBondContact CB-OD2 2.91Å; S480-D523 PolarHBondContact N-OD2 3.16Å; W481-D523 VanDerWaalsContact CD1-OD2 3.29Å; D523-I525 HydrophobicContact CB-CG2 4.19Å; D523-I525 PolarHBondContact O-N 3.4Å; D523-I525 VanDerWaalsContact O-N 3.08Å; D523-I525 PolarHBondContact OD1-N 3.34Å; D523-W526 PolarHBondContact O-N 3.45Å
524	P	85.8	Confident	83.3	Confident	12 Å²	12	64.2 Å²	64.2	8%	0.078	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.3	178.7	-26.7	30.9	0	0	0	115.5	N467 L474 N475 W526 N527	N467-P524 WeakPolarHBondContact ND2-CG 3.46Å; L474-P524 WeakPolarHBondContact O-CG 3.5Å; N475-P524 HydrophobicContact CB-CG 4.23Å; P524-W526 PolarHBondContact O-N 3.29Å; P524-W526 VanDerWaalsContact O-N 3.15Å; P524-N527 PolarHBondContact O-N 2.9Å; P524-N527 VanDerWaalsContact O-N 3.12Å
525	I	86.8	Confident	84.6	Confident	47 Å²	47	61.8 Å²	61.8	24%	0.241	36%	0.36	C	S	.	.	H	α-helix	trans	-59	-29.5	-177.9	-165.2	61	0	0	0	112.4	W481 D523 N527 L528 A529	W481-I525 HydrophobicContact CB-CB 4.46Å; W481-I525 HydrophobicContact CB-CG1 4.29Å; W481-I525 HydrophobicContact CB-CG2 4.19Å; W481-I525 VanDerWaalsContact CD1-CG2 3.5Å; W481-I525 HydrophobicContact CG-CG2 3.86Å; D523-I525 HydrophobicContact CB-CG2 4.19Å; D523-I525 PolarHBondContact O-N 3.4Å; D523-I525 VanDerWaalsContact O-N 3.08Å; D523-I525 PolarHBondContact OD1-N 3.34Å; I525-N527 PolarHBondContact O-N 2.82Å; I525-L528 HydrophobicContact CD1-CD1 4.43Å; I525-L528 PolarHBondContact O-N 3.03Å; I525-L528 VanDerWaalsContact O-N 3.15Å; I525-A529 PolarHBondContact O-N 3.4Å
526	W	86.8	Confident	85.8	Confident	50 Å²	50	60.9 Å²	60.9	19%	0.189	34%	0.344	C	S	.	.	H	α-helix	trans	-66.1	-25.8	-179.2	-68.5	109.7	0	0	0	112.8	W481 I522 D523 P524 L528 A529 K532 F535	W481-W526 HydrophobicContact CZ2-CZ2 4.23Å; I522-W526 HydrophobicContact CG2-CB 4.41Å; I522-W526 HydrophobicContact CG2-CG 4.36Å; D523-W526 PolarHBondContact O-N 3.45Å; P524-W526 PolarHBondContact O-N 3.29Å; P524-W526 VanDerWaalsContact O-N 3.15Å; W526-L528 VanDerWaalsContact C-N 3.28Å; W526-L528 PolarHBondContact O-N 2.87Å; W526-A529 HydrophobicContact CE3-CB 4.37Å; W526-A529 PolarHBondContact O-N 3.23Å; W526-K532 WeakPolarHBondContact O-CB 3.41Å; W526-F535 AromaticContact CD2-CD1 3.95Å; W526-F535 HydrophobicContact CD2-CD1 3.95Å; W526-F535 HydrophobicContact CD2-CE1 4.35Å; W526-F535 HydrophobicContact CD2-CG 4.23Å; W526-F535 HydrophobicContact CE3-CB 4.16Å; W526-F535 HydrophobicContact CE3-CD1 4.3Å; W526-F535 HydrophobicContact CE3-CG 4.23Å; W526-F535 HydrophobicContact CG-CD1 4.17Å; W526-F535 HydrophobicContact CG-CE1 4.32Å; W526-F535 HydrophobicContact CH2-CB 4.48Å; W526-F535 HydrophobicContact CH2-CD2 4.32Å; W526-F535 HydrophobicContact CH2-CG 4.34Å; W526-F535 HydrophobicContact CZ2-CD2 4.18Å; W526-F535 HydrophobicContact CZ2-CE2 4.36Å; W526-F535 HydrophobicContact CZ2-CG 4.32Å; W526-F535 HydrophobicContact CZ3-CB 4.08Å; W526-F535 HydrophobicContact CZ3-CG 4.29Å
527	N	86.1	Confident	86.7	Confident	33 Å²	33	58.2 Å²	58.2	18%	0.176	33%	0.33	C	S	.	.	H	α-helix	trans	-71.6	-27	177.1	-161.2	0.1	0	0	0	112.1	S471 K472 S473 P524 I525 K532	S471-N527 PolarHBondContact O-ND2 3.3Å; K472-N527 WeakPolarHBondContact CA-ND2 3.45Å; S473-N527 PolarHBondContact N-ND2 2.8Å; S473-N527 VanDerWaalsContact N-ND2 3.16Å; P524-N527 PolarHBondContact O-N 2.9Å; P524-N527 VanDerWaalsContact O-N 3.12Å; I525-N527 PolarHBondContact O-N 2.82Å; N527-K532 PolarHBondContact OD1-NZ 3.36Å
528	L	84	Confident	87.2	Confident	149 Å²	149	56.1 Å²	56.1	78%	0.78	32%	0.317	S	S	*	.	H	α-helix	trans	-83.6	-19.5	175.9	-63.1	173.1	0	0	0	112.9	I525 W526	I525-L528 HydrophobicContact CD1-CD1 4.43Å; I525-L528 PolarHBondContact O-N 3.03Å; I525-L528 VanDerWaalsContact O-N 3.15Å; W526-L528 VanDerWaalsContact C-N 3.28Å; W526-L528 PolarHBondContact O-N 2.87Å
529	A	86.5	Confident	87.6	Confident	27 Å²	27	58.1 Å²	58.1	22%	0.223	33%	0.325	C	S	.	.			trans	-79.7	141.5	-173.1	0	0	0	0	0	112.5	I525 W526 N531 K532	I525-A529 PolarHBondContact O-N 3.4Å; W526-A529 HydrophobicContact CE3-CB 4.37Å; W526-A529 PolarHBondContact O-N 3.23Å; A529-N531 VanDerWaalsContact C-N 3.3Å; A529-N531 WeakPolarHBondContact CB-OD1 3.4Å; A529-N531 PolarHBondContact O-N 3.24Å; A529-K532 WeakPolarHBondContact O-CB 3.49Å; A529-K532 PolarHBondContact O-N 2.86Å
530	S	84.3	Confident	87.9	Confident	100 Å²	100	53.8 Å²	53.8	70%	0.699	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-27.4	176	57.7	0	0	0	0	112.9	K532	S530-K532 VanDerWaalsContact C-N 3.32Å; S530-K532 PolarHBondContact O-N 3.46Å
531	N	88.5	Confident	88.1	Confident	87 Å²	87	53.9 Å²	53.9	47%	0.465	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	15.4	-179.6	65.8	-11.9	0	0	0	114	A529 L533 T534 F535	A529-N531 VanDerWaalsContact C-N 3.3Å; A529-N531 WeakPolarHBondContact CB-OD1 3.4Å; A529-N531 PolarHBondContact O-N 3.24Å; N531-L533 VanDerWaalsContact C-N 3.3Å; N531-L533 PolarHBondContact O-N 2.95Å; N531-T534 PolarHBondContact O-N 3.37Å; N531-F535 PolarHBondContact O-N 3.31Å
532	K	87.4	Confident	88.4	Confident	22 Å²	22	53.9 Å²	53.9	10%	0.096	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-38.7	-177.6	77.9	-179.5	-176.9	176.9	0	114	W526 N527 A529 S530 T534 F535 L536 E754	W526-K532 WeakPolarHBondContact O-CB 3.41Å; N527-K532 PolarHBondContact OD1-NZ 3.36Å; A529-K532 WeakPolarHBondContact O-CB 3.49Å; A529-K532 PolarHBondContact O-N 2.86Å; S530-K532 VanDerWaalsContact C-N 3.32Å; S530-K532 PolarHBondContact O-N 3.46Å; K532-T534 VanDerWaalsContact C-N 3.33Å; K532-T534 PolarHBondContact O-N 3.26Å; K532-F535 PolarHBondContact O-N 2.93Å; K532-L536 WeakPolarHBondContact O-CB 3.27Å; K532-L536 WeakPolarHBondContact O-CG 3.1Å; K532-L536 PolarHBondContact O-N 3.38Å; K532-E754 VanDerWaalsContact CE-OE2 3.3Å; K532-E754 WeakPolarHBondContact CE-OE2 3.3Å; K532-E754 IonicContact NZ-OE1 3.55Å; K532-E754 PolarHBondContact NZ-OE1 3.17Å; K532-E754 IonicContact NZ-OE2 2.67Å; K532-E754 PolarHBondContact NZ-OE2 3.41Å
533	L	88	Confident	88.6	Confident	76 Å²	76	54.5 Å²	54.5	40%	0.398	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-39.6	-177.2	-74.7	174.6	0	0	0	111.4	N531 F535 N537 Q751	N531-L533 VanDerWaalsContact C-N 3.3Å; N531-L533 PolarHBondContact O-N 2.95Å; L533-F535 VanDerWaalsContact C-N 3.35Å; L533-F535 PolarHBondContact O-N 3.02Å; L533-N537 WeakPolarHBondContact O-CB 3.5Å; L533-N537 PolarHBondContact O-N 3.17Å; L533-Q751 HydrophobicContact CD2-CG 4.39Å
534	T	89.7	Confident	88.9	Confident	108 Å²	108	54 Å²	54	66%	0.663	29%	0.291	S	S	*	.	H	α-helix	trans	-64.1	-41.8	178.3	-53.1	0	0	0	0	111.4	N531 K532 S538	N531-T534 PolarHBondContact O-N 3.37Å; K532-T534 VanDerWaalsContact C-N 3.33Å; K532-T534 PolarHBondContact O-N 3.26Å; T534-S538 WeakPolarHBondContact O-CB 3.15Å; T534-S538 PolarHBondContact O-N 3.4Å
535	F	89.3	Confident	89.2	Confident	75 Å²	75	54.4 Å²	54.4	33%	0.329	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-53.3	176.8	174.1	-103	0	0	0	111.9	I522 W526 N531 K532 L533 N537 S538 Y539	I522-F535 HydrophobicContact CG2-CE1 4Å; W526-F535 AromaticContact CD2-CD1 3.95Å; W526-F535 HydrophobicContact CD2-CD1 3.95Å; W526-F535 HydrophobicContact CD2-CE1 4.35Å; W526-F535 HydrophobicContact CD2-CG 4.23Å; W526-F535 HydrophobicContact CE3-CB 4.16Å; W526-F535 HydrophobicContact CE3-CD1 4.3Å; W526-F535 HydrophobicContact CE3-CG 4.23Å; W526-F535 HydrophobicContact CG-CD1 4.17Å; W526-F535 HydrophobicContact CG-CE1 4.32Å; W526-F535 HydrophobicContact CH2-CB 4.48Å; W526-F535 HydrophobicContact CH2-CD2 4.32Å; W526-F535 HydrophobicContact CH2-CG 4.34Å; W526-F535 HydrophobicContact CZ2-CD2 4.18Å; W526-F535 HydrophobicContact CZ2-CE2 4.36Å; W526-F535 HydrophobicContact CZ2-CG 4.32Å; W526-F535 HydrophobicContact CZ3-CB 4.08Å; W526-F535 HydrophobicContact CZ3-CG 4.29Å; N531-F535 PolarHBondContact O-N 3.31Å; K532-F535 PolarHBondContact O-N 2.93Å; L533-F535 VanDerWaalsContact C-N 3.35Å; L533-F535 PolarHBondContact O-N 3.02Å; F535-N537 VanDerWaalsContact C-N 3.34Å; F535-N537 PolarHBondContact O-N 3.42Å; F535-S538 PolarHBondContact O-N 2.82Å; F535-Y539 PolarHBondContact O-N 3.01Å
536	L	89.1	Confident	89.6	Confident	29 Å²	29	53.7 Å²	53.7	15%	0.152	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-38.1	-177.7	-74	173.9	0	0	0	112.5	I522 K532 Y539 K540	I522-L536 HydrophobicContact CD1-CD2 3.52Å; K532-L536 WeakPolarHBondContact O-CB 3.27Å; K532-L536 WeakPolarHBondContact O-CG 3.1Å; K532-L536 PolarHBondContact O-N 3.38Å; L536-Y539 PolarHBondContact O-N 3.23Å; L536-K540 VanDerWaalsContact O-CB 3.3Å; L536-K540 WeakPolarHBondContact O-CB 3.24Å; L536-K540 WeakPolarHBondContact O-CG 3.36Å; L536-K540 PolarHBondContact O-N 3.45Å
537	N	91.3	Very high	89.9	Confident	59 Å²	59	53 Å²	53	32%	0.316	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-51.1	176.4	-176.5	-2.3	0	0	0	110.8	L533 F535 Y539 K540 M541 W743 L747	L533-N537 WeakPolarHBondContact O-CB 3.5Å; L533-N537 PolarHBondContact O-N 3.17Å; F535-N537 VanDerWaalsContact C-N 3.34Å; F535-N537 PolarHBondContact O-N 3.42Å; N537-Y539 VanDerWaalsContact C-N 3.3Å; N537-Y539 PolarHBondContact O-N 3.43Å; N537-K540 PolarHBondContact O-N 2.98Å; N537-M541 WeakPolarHBondContact O-CB 3.32Å; N537-M541 PolarHBondContact O-N 3.33Å; N537-W743 WeakPolarHBondContact OD1-CZ2 3.46Å; N537-W743 PolarHBondContact OD1-NE1 3.5Å; N537-L747 HydrophobicContact CB-CD1 4.35Å
538	S	90.3	Very high	90.2	Very high	53 Å²	53	51.5 Å²	51.5	37%	0.371	28%	0.281	S	S	.	.	H	α-helix	trans	-58.4	-41.6	177.3	-177.3	0	0	0	0	112.3	T534 F535 K542	T534-S538 WeakPolarHBondContact O-CB 3.15Å; T534-S538 PolarHBondContact O-N 3.4Å; F535-S538 PolarHBondContact O-N 2.82Å; S538-K542 WeakPolarHBondContact O-CD 3.46Å; S538-K542 VanDerWaalsContact O-CG 3.28Å; S538-K542 WeakPolarHBondContact O-CG 3.39Å; S538-K542 PolarHBondContact O-N 3.18Å
539	Y	90.4	Very high	90.6	Very high	66 Å²	66	44.6 Å²	44.6	26%	0.259	25%	0.245	S	C	.	.	H	α-helix	trans	-68	-55.8	178.2	173.8	-103.6	0	0	0	112.5	Y466 I522 F535 L536 N537 M541 K542 M543 W598	Y466-Y539 HydrophobicContact CD1-CE1 4.42Å; Y466-Y539 HydrophobicContact CE1-CE1 4.1Å; I522-Y539 HydrophobicContact CD1-CD1 4.3Å; I522-Y539 HydrophobicContact CD1-CE1 4.22Å; F535-Y539 PolarHBondContact O-N 3.01Å; L536-Y539 PolarHBondContact O-N 3.23Å; N537-Y539 VanDerWaalsContact C-N 3.3Å; N537-Y539 PolarHBondContact O-N 3.43Å; Y539-M541 PolarHBondContact O-N 3.45Å; Y539-K542 PolarHBondContact O-N 3.12Å; Y539-M543 WeakPolarHBondContact O-CB 3.45Å; Y539-M543 PolarHBondContact O-N 3.19Å; Y539-W598 HydrophobicContact CD2-CZ2 4.4Å
540	K	91.8	Very high	90.9	Very high	7 Å²	7	47.6 Å²	47.6	3%	0.03	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-39.4	-175.6	-71.3	-170.1	178.1	-166.7	0	111.8	L536 N537 K542 M543 S544 W743 S746	L536-K540 VanDerWaalsContact O-CB 3.3Å; L536-K540 WeakPolarHBondContact O-CB 3.24Å; L536-K540 WeakPolarHBondContact O-CG 3.36Å; L536-K540 PolarHBondContact O-N 3.45Å; N537-K540 PolarHBondContact O-N 2.98Å; K540-K542 PolarHBondContact O-N 3.41Å; K540-M543 PolarHBondContact O-N 3.47Å; K540-S544 WeakPolarHBondContact O-CB 3.22Å; K540-S544 PolarHBondContact O-N 3.41Å; K540-W743 HydrophobicContact CB-CB 4.42Å; K540-W743 VanDerWaalsContact CB-CD1 3.43Å; K540-W743 HydrophobicContact CB-CG 4.22Å; K540-S746 PolarHBondContact NZ-O 3.13Å; K540-S746 PolarHBondContact NZ-OG 3.43Å
541	M	91.9	Very high	91.3	Very high	74 Å²	74	43.6 Å²	43.6	37%	0.365	23%	0.231	S	C	.	.	H	α-helix	trans	-59.1	-49.4	175.3	-174.5	-176.1	68.7	0	0	111.1	N537 Y539 M543 S544 V545 L740 W743	N537-M541 WeakPolarHBondContact O-CB 3.32Å; N537-M541 PolarHBondContact O-N 3.33Å; Y539-M541 PolarHBondContact O-N 3.45Å; M541-M543 PolarHBondContact O-N 3.18Å; M541-S544 PolarHBondContact O-N 3.44Å; M541-S544 PolarHBondContact O-OG 3.49Å; M541-V545 PolarHBondContact O-N 2.9Å; M541-L740 HydrophobicContact CG-CD2 3.81Å; M541-W743 HydrophobicContact CB-CD2 4.01Å; M541-W743 HydrophobicContact CB-CE3 4.35Å; M541-W743 HydrophobicContact CB-CG 4.16Å; M541-W743 HydrophobicContact CG-CD2 4.36Å; M541-W743 HydrophobicContact CG-CE3 4.19Å
542	K	93.1	Very high	91.4	Very high	28 Å²	28	39.5 Å²	39.5	12%	0.122	21%	0.209	C	C	.	.	H	α-helix	trans	-64.2	-42.7	178.9	-73.8	171.1	-178.5	174.4	0	112.7	S538 Y539 K540 S544 V545 I546 I594 W598	S538-K542 WeakPolarHBondContact O-CD 3.46Å; S538-K542 VanDerWaalsContact O-CG 3.28Å; S538-K542 WeakPolarHBondContact O-CG 3.39Å; S538-K542 PolarHBondContact O-N 3.18Å; Y539-K542 PolarHBondContact O-N 3.12Å; K540-K542 PolarHBondContact O-N 3.41Å; K542-S544 VanDerWaalsContact C-N 3.33Å; K542-S544 PolarHBondContact O-N 2.98Å; K542-V545 PolarHBondContact O-N 2.88Å; K542-I546 WeakPolarHBondContact O-CG1 3.29Å; K542-I546 PolarHBondContact O-N 3.3Å; K542-I594 HydrophobicContact CB-CG2 4.01Å; K542-I594 HydrophobicContact CD-CG2 4.02Å; K542-I594 HydrophobicContact CG-CD1 4.44Å; K542-I594 HydrophobicContact CG-CG2 4.14Å; K542-W598 HydrophobicContact CB-CH2 4.21Å; K542-W598 HydrophobicContact CB-CZ2 3.84Å; K542-W598 HydrophobicContact CD-CZ2 3.9Å
543	M	92.1	Very high	91.6	Very high	32 Å²	32	39.9 Å²	39.9	16%	0.158	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-40.6	177.7	-178.3	-95.4	-158.4	0	0	111.8	V407 Y539 K540 M541 V545 I546 L547	V407-M543 HydrophobicContact CG1-CE 3.94Å; V407-M543 HydrophobicContact CG1-SD 3.86Å; V407-M543 HydrophobicContact CG2-CE 3.86Å; Y539-M543 WeakPolarHBondContact O-CB 3.45Å; Y539-M543 PolarHBondContact O-N 3.19Å; K540-M543 PolarHBondContact O-N 3.47Å; M541-M543 PolarHBondContact O-N 3.18Å; M543-V545 PolarHBondContact O-N 2.95Å; M543-I546 PolarHBondContact O-N 2.93Å; M543-L547 HydrophobicContact CE-CD1 3.64Å; M543-L547 WeakPolarHBondContact O-CG 3.36Å; M543-L547 PolarHBondContact O-N 3.45Å; M543-L547 HydrophobicContact SD-CD1 3.56Å; M543-L547 VanDerWaalsContact SD-CD1 3.56Å; M543-L547 HydrophobicContact SD-CG 4.33Å
544	S	93.4	Very high	91.8	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-41.6	176.1	72.3	0	0	0	0	113.2	K540 M541 K542 G548	K540-S544 WeakPolarHBondContact O-CB 3.22Å; K540-S544 PolarHBondContact O-N 3.41Å; M541-S544 PolarHBondContact O-N 3.44Å; M541-S544 PolarHBondContact O-OG 3.49Å; K542-S544 VanDerWaalsContact C-N 3.33Å; K542-S544 PolarHBondContact O-N 2.98Å; S544-G548 PolarHBondContact O-N 3.48Å
545	V	93.1	Very high	91.8	Very high	19 Å²	19	34.4 Å²	34.4	12%	0.115	18%	0.177	C	C	.	.	H	α-helix	trans	-67.5	-41.9	178.1	173.7	0	0	0	0	111.1	M541 K542 M543 G548 I549 L590 I594 L740	M541-V545 PolarHBondContact O-N 2.9Å; K542-V545 PolarHBondContact O-N 2.88Å; M543-V545 PolarHBondContact O-N 2.95Å; V545-G548 PolarHBondContact O-N 2.89Å; V545-I549 HydrophobicContact CG1-CD1 3.58Å; V545-I549 HydrophobicContact CG1-CG1 4.47Å; V545-I549 WeakPolarHBondContact O-CD1 3.38Å; V545-I549 VanDerWaalsContact O-CG1 3.31Å; V545-I549 WeakPolarHBondContact O-CG1 3.29Å; V545-I549 PolarHBondContact O-N 3.11Å; V545-L590 HydrophobicContact CG1-CD2 3.98Å; V545-I594 HydrophobicContact CG1-CD1 4.44Å; V545-L740 HydrophobicContact CG2-CD2 4.01Å
546	I	94.2	Very high	91.9	Very high	32 Å²	32	30.8 Å²	30.8	16%	0.164	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-50	176.7	-66.1	170	0	0	0	110.5	K542 M543 G548 I549 V550 V591 I594 W598	K542-I546 WeakPolarHBondContact O-CG1 3.29Å; K542-I546 PolarHBondContact O-N 3.3Å; M543-I546 PolarHBondContact O-N 2.93Å; I546-G548 VanDerWaalsContact C-N 3.33Å; I546-G548 PolarHBondContact O-N 3.15Å; I546-I549 PolarHBondContact O-N 3.31Å; I546-V550 HydrophobicContact CG2-CG2 4.48Å; I546-V550 VanDerWaalsContact O-CG2 3.3Å; I546-V550 WeakPolarHBondContact O-CG2 3.44Å; I546-V550 PolarHBondContact O-N 3.06Å; I546-V591 HydrophobicContact CG1-CG1 4.21Å; I546-V591 HydrophobicContact CG1-CG2 4.43Å; I546-V591 HydrophobicContact CG2-CG1 4.35Å; I546-I594 HydrophobicContact CD1-CG2 3.86Å; I546-I594 HydrophobicContact CG1-CD1 4.36Å; I546-W598 HydrophobicContact CD1-CH2 3.81Å; I546-W598 HydrophobicContact CD1-CZ3 3.67Å
547	L	92.8	Very high	92	Very high	37 Å²	37	32.2 Å²	32.2	19%	0.194	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-43.3	179.1	-75	179.7	0	0	0	112.1	F403 V407 M543 V550 Q551	F403-L547 HydrophobicContact CE1-CD1 4.1Å; F403-L547 HydrophobicContact CE1-CD2 3.8Å; F403-L547 HydrophobicContact CZ-CD2 4.25Å; V407-L547 HydrophobicContact CG1-CD1 4.25Å; V407-L547 HydrophobicContact CG2-CD1 3.93Å; M543-L547 HydrophobicContact CE-CD1 3.64Å; M543-L547 WeakPolarHBondContact O-CG 3.36Å; M543-L547 PolarHBondContact O-N 3.45Å; M543-L547 HydrophobicContact SD-CD1 3.56Å; M543-L547 VanDerWaalsContact SD-CD1 3.56Å; M543-L547 HydrophobicContact SD-CG 4.33Å; L547-V550 PolarHBondContact O-N 3.02Å; L547-Q551 WeakPolarHBondContact O-CB 3.3Å; L547-Q551 PolarHBondContact O-N 3.08Å
548	G	92.3	Very high	92	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.3	-46.9	179	0	0	0	0	0	113	S544 V545 I546 Q551 M552 Y739	S544-G548 PolarHBondContact O-N 3.48Å; V545-G548 PolarHBondContact O-N 2.89Å; I546-G548 VanDerWaalsContact C-N 3.33Å; I546-G548 PolarHBondContact O-N 3.15Å; G548-Q551 PolarHBondContact O-N 3.4Å; G548-M552 WeakPolarHBondContact O-CE 3.41Å; G548-M552 WeakPolarHBondContact O-CG 3.43Å; G548-M552 PolarHBondContact O-N 3Å; G548-Y739 VanDerWaalsContact CA-CD1 3.41Å; G548-Y739 VanDerWaalsContact CA-CD2 3.48Å
549	I	93	Very high	91.8	Very high	5 Å²	5	27.2 Å²	27.2	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-66.9	-41.6	-179	-65.5	164.3	0	0	0	110.8	V545 I546 Q551 M552 V553 F587 V591 T736	V545-I549 HydrophobicContact CG1-CD1 3.58Å; V545-I549 HydrophobicContact CG1-CG1 4.47Å; V545-I549 WeakPolarHBondContact O-CD1 3.38Å; V545-I549 VanDerWaalsContact O-CG1 3.31Å; V545-I549 WeakPolarHBondContact O-CG1 3.29Å; V545-I549 PolarHBondContact O-N 3.11Å; I546-I549 PolarHBondContact O-N 3.31Å; I549-Q551 VanDerWaalsContact C-N 3.34Å; I549-Q551 PolarHBondContact O-N 2.96Å; I549-M552 HydrophobicContact CG1-CE 4.09Å; I549-M552 PolarHBondContact O-N 3.47Å; I549-V553 HydrophobicContact CG2-CG2 4.28Å; I549-V553 WeakPolarHBondContact O-CB 3.25Å; I549-V553 VanDerWaalsContact O-CG2 3.23Å; I549-V553 WeakPolarHBondContact O-CG2 3.34Å; I549-V553 PolarHBondContact O-N 2.91Å; I549-F587 HydrophobicContact CD1-CB 3.78Å; I549-F587 HydrophobicContact CD1-CD1 4.47Å; I549-F587 HydrophobicContact CG1-CB 3.99Å; I549-F587 HydrophobicContact CG2-CB 4.18Å; I549-V591 HydrophobicContact CB-CG2 3.92Å; I549-V591 HydrophobicContact CD1-CG2 3.51Å; I549-V591 HydrophobicContact CG1-CG2 4.31Å; I549-V591 HydrophobicContact CG2-CG2 3.93Å; I549-T736 HydrophobicContact CD1-CG2 4.22Å; I549-T736 HydrophobicContact CG1-CG2 4.07Å
550	V	92.8	Very high	91.8	Very high	89 Å²	89	25.9 Å²	25.9	54%	0.539	14%	0.135	S	C	.	.	H	α-helix	trans	-61.1	-43.7	175.5	171.6	0	0	0	0	111.1	I546 L547 F554	I546-V550 HydrophobicContact CG2-CG2 4.48Å; I546-V550 VanDerWaalsContact O-CG2 3.3Å; I546-V550 WeakPolarHBondContact O-CG2 3.44Å; I546-V550 PolarHBondContact O-N 3.06Å; L547-V550 PolarHBondContact O-N 3.02Å; V550-F554 WeakPolarHBondContact O-CB 3.34Å; V550-F554 PolarHBondContact O-N 3.19Å
551	Q	92.6	Very high	91.7	Very high	16 Å²	16	30.7 Å²	30.7	8%	0.075	16%	0.156	C	C	.	.	H	α-helix	trans	-66	-42.8	178.4	-171.4	-175.5	13	0	0	112.4	L404 L547 G548 I549 F554 G555 Y739 H807 F811	L404-Q551 VanDerWaalsContact CD1-OE1 3.23Å; L547-Q551 WeakPolarHBondContact O-CB 3.3Å; L547-Q551 PolarHBondContact O-N 3.08Å; G548-Q551 PolarHBondContact O-N 3.4Å; I549-Q551 VanDerWaalsContact C-N 3.34Å; I549-Q551 PolarHBondContact O-N 2.96Å; Q551-F554 WeakPolarHBondContact O-CB 3.32Å; Q551-F554 PolarHBondContact O-N 3.34Å; Q551-G555 PolarHBondContact O-N 2.98Å; Q551-Y739 VanDerWaalsContact CD-OH 3.31Å; Q551-Y739 PolarHBondContact OE1-OH 3.36Å; Q551-H807 PolarHBondContact NE2-NE2 3.3Å; Q551-F811 HydrophobicContact CG-CD2 3.9Å; Q551-F811 HydrophobicContact CG-CE2 4.5Å
552	M	91.1	Very high	91.4	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-65.8	-43.9	177.9	-73.4	-176.6	-66.2	0	0	112	G548 I549 F554 G555 V556 N735 T736 Y739	G548-M552 WeakPolarHBondContact O-CE 3.41Å; G548-M552 WeakPolarHBondContact O-CG 3.43Å; G548-M552 PolarHBondContact O-N 3Å; I549-M552 HydrophobicContact CG1-CE 4.09Å; I549-M552 PolarHBondContact O-N 3.47Å; M552-F554 VanDerWaalsContact C-N 3.26Å; M552-F554 PolarHBondContact O-N 3.26Å; M552-G555 PolarHBondContact O-N 3.23Å; M552-G555 VanDerWaalsContact O-N 3.11Å; M552-V556 PolarHBondContact O-N 2.96Å; M552-N735 HydrophobicContact SD-CB 3.79Å; M552-T736 HydrophobicContact CE-CG2 4.38Å; M552-T736 WeakPolarHBondContact CE-OG1 3.42Å; M552-Y739 HydrophobicContact CE-CD2 4.2Å; M552-Y739 HydrophobicContact CE-CE2 4.03Å; M552-Y739 HydrophobicContact CG-CE2 3.75Å; M552-Y739 HydrophobicContact SD-CD2 4.43Å; M552-Y739 HydrophobicContact SD-CE2 3.85Å
553	V	92.3	Very high	91.1	Very high	29 Å²	29	27.5 Å²	27.5	18%	0.176	14%	0.14	C	C	.	.	H	α-helix	trans	-59.5	-41.8	175	169.9	0	0	0	0	110.3	I549 G555 V556 I557 M580 I583	I549-V553 HydrophobicContact CG2-CG2 4.28Å; I549-V553 WeakPolarHBondContact O-CB 3.25Å; I549-V553 VanDerWaalsContact O-CG2 3.23Å; I549-V553 WeakPolarHBondContact O-CG2 3.34Å; I549-V553 PolarHBondContact O-N 2.91Å; V553-G555 VanDerWaalsContact C-N 3.34Å; V553-G555 PolarHBondContact O-N 3.03Å; V553-V556 PolarHBondContact O-N 3.36Å; V553-I557 HydrophobicContact CG1-CD1 3.99Å; V553-I557 VanDerWaalsContact O-CG1 3.32Å; V553-I557 WeakPolarHBondContact O-CG1 3.12Å; V553-I557 PolarHBondContact O-N 3.46Å; V553-M580 HydrophobicContact CG1-CE 4.12Å; V553-I583 HydrophobicContact CG2-CG2 3.53Å
554	F	91.9	Very high	90.9	Very high	69 Å²	69	30.2 Å²	30.2	30%	0.303	16%	0.155	S	C	.	.	H	α-helix	trans	-60.2	-42.5	174.2	179	-117	0	0	0	112.2	Y396 V550 Q551 M552 I557 L558 F811	Y396-F554 AromaticContact CD1-CE1 3.87Å; Y396-F554 HydrophobicContact CD1-CE1 3.87Å; Y396-F554 AromaticContact CD1-CZ 3.58Å; Y396-F554 HydrophobicContact CD1-CZ 3.58Å; Y396-F554 HydrophobicContact CE1-CE1 4.35Å; Y396-F554 AromaticContact CE1-CZ 3.63Å; Y396-F554 HydrophobicContact CE1-CZ 3.63Å; Y396-F554 AromaticContact CG-CE1 3.96Å; Y396-F554 HydrophobicContact CG-CE1 3.96Å; Y396-F554 HydrophobicContact CG-CZ 4.08Å; V550-F554 WeakPolarHBondContact O-CB 3.34Å; V550-F554 PolarHBondContact O-N 3.19Å; Q551-F554 WeakPolarHBondContact O-CB 3.32Å; Q551-F554 PolarHBondContact O-N 3.34Å; M552-F554 VanDerWaalsContact C-N 3.26Å; M552-F554 PolarHBondContact O-N 3.26Å; F554-I557 WeakPolarHBondContact O-CB 3.32Å; F554-I557 PolarHBondContact O-N 2.87Å; F554-L558 HydrophobicContact CE1-CD1 4.11Å; F554-L558 HydrophobicContact CE2-CD2 4.35Å; F554-L558 HydrophobicContact CZ-CD1 4.26Å; F554-L558 HydrophobicContact CZ-CD2 4.17Å; F554-L558 HydrophobicContact CZ-CG 4.38Å; F554-L558 PolarHBondContact O-N 2.95Å; F554-F811 AromaticContact CD1-CE2 3.58Å; F554-F811 HydrophobicContact CD1-CE2 3.58Å; F554-F811 AromaticContact CD1-CZ 3.93Å; F554-F811 HydrophobicContact CD1-CZ 3.93Å; F554-F811 HydrophobicContact CE1-CE2 4.05Å; F554-F811 AromaticContact CE1-CZ 3.89Å; F554-F811 HydrophobicContact CE1-CZ 3.89Å
555	G	90	Very high	90.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.2	-43.8	174.7	0	0	0	0	0	113.4	Q551 M552 V553 I557 L558 S559 F815	Q551-G555 PolarHBondContact O-N 2.98Å; M552-G555 PolarHBondContact O-N 3.23Å; M552-G555 VanDerWaalsContact O-N 3.11Å; V553-G555 VanDerWaalsContact C-N 3.34Å; V553-G555 PolarHBondContact O-N 3.03Å; G555-I557 VanDerWaalsContact C-N 3.32Å; G555-I557 PolarHBondContact O-N 2.72Å; G555-L558 WeakPolarHBondContact O-CB 3.45Å; G555-L558 PolarHBondContact O-N 3.18Å; G555-L558 VanDerWaalsContact O-N 3.12Å; G555-S559 PolarHBondContact O-N 2.69Å; G555-F815 WeakPolarHBondContact O-CD1 3.4Å
556	V	90.9	Very high	90.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-34.9	176.4	-177.5	0	0	0	0	111.2	M552 V553 L558 S559 F576 E579 M580 I583 K814	M552-V556 PolarHBondContact O-N 2.96Å; V553-V556 PolarHBondContact O-N 3.36Å; V556-L558 VanDerWaalsContact C-N 3.25Å; V556-L558 PolarHBondContact O-N 3.18Å; V556-S559 WeakPolarHBondContact O-CB 3.47Å; V556-S559 PolarHBondContact O-N 3.5Å; V556-S559 VanDerWaalsContact O-N 3.13Å; V556-S559 PolarHBondContact O-OG 3.44Å; V556-F576 HydrophobicContact CG1-CD2 3.95Å; V556-F576 HydrophobicContact CG1-CE2 3.98Å; V556-F576 VanDerWaalsContact O-CE2 3.3Å; V556-F576 WeakPolarHBondContact O-CE2 3.5Å; V556-E579 HydrophobicContact CG1-CB 4.37Å; V556-M580 HydrophobicContact CB-SD 3.79Å; V556-M580 HydrophobicContact CG1-CG 3.78Å; V556-M580 HydrophobicContact CG1-SD 3.43Å; V556-M580 WeakPolarHBondContact CG1-SD 3.24Å; V556-I583 HydrophobicContact CG2-CD1 4.08Å; V556-K814 HydrophobicContact CG2-CB 4.11Å; V556-K814 HydrophobicContact CG2-CD 4.21Å; V556-K814 HydrophobicContact CG2-CG 4.07Å
557	I	91.4	Very high	89.7	Confident	58 Å²	58	45.8 Å²	45.8	30%	0.297	21%	0.212	S	C	.	.	H	α-helix	trans	-62.2	-32.7	173.4	-68.5	165.1	0	0	0	111.7	V553 F554 G555 S559 L560 F561 M580	V553-I557 HydrophobicContact CG1-CD1 3.99Å; V553-I557 VanDerWaalsContact O-CG1 3.32Å; V553-I557 WeakPolarHBondContact O-CG1 3.12Å; V553-I557 PolarHBondContact O-N 3.46Å; F554-I557 WeakPolarHBondContact O-CB 3.32Å; F554-I557 PolarHBondContact O-N 2.87Å; G555-I557 VanDerWaalsContact C-N 3.32Å; G555-I557 PolarHBondContact O-N 2.72Å; I557-S559 VanDerWaalsContact C-N 3.31Å; I557-S559 PolarHBondContact O-N 3.1Å; I557-L560 WeakPolarHBondContact O-CB 3.32Å; I557-L560 PolarHBondContact O-N 3.24Å; I557-F561 HydrophobicContact CG2-CD2 4.36Å; I557-F561 HydrophobicContact CG2-CE2 3.86Å; I557-F561 WeakPolarHBondContact O-CD2 3.3Å; I557-M580 HydrophobicContact CG1-CE 4.22Å; I557-M580 HydrophobicContact CG1-SD 4.43Å
558	L	90	Very high	89.2	Confident	2 Å²	2	51 Å²	51	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-31.7	175.5	-63.9	178.7	0	0	0	112.7	Y396 F554 G555 V556 L560 F561 N562 F811 F815	Y396-L558 HydrophobicContact CD2-CD1 3.84Å; Y396-L558 HydrophobicContact CE2-CD1 3.7Å; Y396-L558 HydrophobicContact CE2-CD2 3.78Å; Y396-L558 HydrophobicContact CE2-CG 4.43Å; F554-L558 HydrophobicContact CE1-CD1 4.11Å; F554-L558 HydrophobicContact CE2-CD2 4.35Å; F554-L558 HydrophobicContact CZ-CD1 4.26Å; F554-L558 HydrophobicContact CZ-CD2 4.17Å; F554-L558 HydrophobicContact CZ-CG 4.38Å; F554-L558 PolarHBondContact O-N 2.95Å; G555-L558 WeakPolarHBondContact O-CB 3.45Å; G555-L558 PolarHBondContact O-N 3.18Å; G555-L558 VanDerWaalsContact O-N 3.12Å; V556-L558 VanDerWaalsContact C-N 3.25Å; V556-L558 PolarHBondContact O-N 3.18Å; L558-L560 VanDerWaalsContact C-N 3.27Å; L558-L560 PolarHBondContact O-N 3.5Å; L558-F561 HydrophobicContact CD2-CD2 4.38Å; L558-F561 PolarHBondContact O-N 3.43Å; L558-N562 PolarHBondContact O-N 2.79Å; L558-F811 HydrophobicContact CD1-CE1 4.46Å; L558-F811 HydrophobicContact CD1-CE2 4.27Å; L558-F811 HydrophobicContact CD1-CZ 3.65Å; L558-F815 HydrophobicContact CB-CB 4.11Å; L558-F815 HydrophobicContact CB-CD1 3.99Å; L558-F815 HydrophobicContact CB-CD2 4.1Å; L558-F815 HydrophobicContact CB-CE1 4.46Å; L558-F815 HydrophobicContact CB-CG 3.8Å; L558-F815 HydrophobicContact CD1-CD1 4.16Å; L558-F815 HydrophobicContact CD1-CE1 3.79Å; L558-F815 HydrophobicContact CD1-CE2 4.18Å; L558-F815 HydrophobicContact CD1-CZ 3.79Å
559	S	87.6	Confident	88.6	Confident	5 Å²	5	55.4 Å²	55.4	4%	0.035	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-34.2	176.2	84.1	0	0	0	0	111.9	G555 V556 I557 F561 N562 H563 K814	G555-S559 PolarHBondContact O-N 2.69Å; V556-S559 WeakPolarHBondContact O-CB 3.47Å; V556-S559 PolarHBondContact O-N 3.5Å; V556-S559 VanDerWaalsContact O-N 3.13Å; V556-S559 PolarHBondContact O-OG 3.44Å; I557-S559 VanDerWaalsContact C-N 3.31Å; I557-S559 PolarHBondContact O-N 3.1Å; S559-F561 PolarHBondContact O-N 3.39Å; S559-N562 WeakPolarHBondContact O-CB 3.47Å; S559-N562 PolarHBondContact O-N 3.11Å; S559-H563 PolarHBondContact O-CD2 3.33Å; S559-H563 VanDerWaalsContact O-CD2 3.31Å; S559-H563 PolarHBondContact O-N 3.16Å; S559-K814 WeakPolarHBondContact CB-O 3.39Å
560	L	89.8	Confident	88	Confident	39 Å²	39	57 Å²	57	20%	0.204	26%	0.264	C	S	.	.	H	α-helix	trans	-59.3	-46.7	172.8	178	64.1	0	0	0	111.8	I557 L558 N562 H563 I564 I572 F576	I557-L560 WeakPolarHBondContact O-CB 3.32Å; I557-L560 PolarHBondContact O-N 3.24Å; L558-L560 VanDerWaalsContact C-N 3.27Å; L558-L560 PolarHBondContact O-N 3.5Å; L560-N562 VanDerWaalsContact C-N 3.26Å; L560-N562 PolarHBondContact O-N 3.37Å; L560-H563 PolarHBondContact O-N 2.96Å; L560-I564 HydrophobicContact CD1-CD1 3.91Å; L560-I564 HydrophobicContact CD1-CG1 4.11Å; L560-I564 HydrophobicContact CD2-CD1 4.34Å; L560-I564 HydrophobicContact CG-CD1 3.74Å; L560-I564 HydrophobicContact CG-CG1 4.34Å; L560-I564 VanDerWaalsContact O-CG1 3.29Å; L560-I564 WeakPolarHBondContact O-CG1 3.4Å; L560-I564 PolarHBondContact O-N 3.48Å; L560-I572 HydrophobicContact CD1-CG1 4.32Å; L560-I572 HydrophobicContact CD1-CG2 3.76Å; L560-F576 HydrophobicContact CB-CD1 4.36Å; L560-F576 HydrophobicContact CB-CD2 3.83Å; L560-F576 HydrophobicContact CB-CE1 4.17Å; L560-F576 HydrophobicContact CB-CE2 3.62Å; L560-F576 HydrophobicContact CB-CG 4.19Å; L560-F576 HydrophobicContact CB-CZ 3.79Å; L560-F576 HydrophobicContact CD1-CD1 3.83Å; L560-F576 HydrophobicContact CD1-CE1 3.93Å; L560-F576 HydrophobicContact CD1-CG 4.22Å; L560-F576 HydrophobicContact CD1-CZ 4.41Å; L560-F576 HydrophobicContact CD2-CE1 3.79Å; L560-F576 HydrophobicContact CD2-CE2 4.43Å; L560-F576 HydrophobicContact CD2-CZ 3.73Å; L560-F576 HydrophobicContact CG-CD1 4.45Å; L560-F576 HydrophobicContact CG-CE1 4.17Å; L560-F576 HydrophobicContact CG-CE2 4.47Å; L560-F576 HydrophobicContact CG-CZ 4.17Å
561	F	88.6	Confident	87.5	Confident	107 Å²	107	54 Å²	54	47%	0.469	25%	0.245	S	C	.	.	H	α-helix	trans	-65.1	-30.4	178.9	-71.3	-70.1	0	0	0	112.4	R6 I391 I557 L558 S559 Y565	R6-F561 PolarHBondContact NH2-O 2.74Å; I391-F561 HydrophobicContact CD1-CB 3.39Å; I557-F561 HydrophobicContact CG2-CD2 4.36Å; I557-F561 HydrophobicContact CG2-CE2 3.86Å; I557-F561 WeakPolarHBondContact O-CD2 3.3Å; L558-F561 HydrophobicContact CD2-CD2 4.38Å; L558-F561 PolarHBondContact O-N 3.43Å; S559-F561 PolarHBondContact O-N 3.39Å; F561-Y565 WeakPolarHBondContact O-CB 3.46Å; F561-Y565 PolarHBondContact O-N 2.97Å
562	N	87.3	Confident	87.2	Confident	8 Å²	8	54.9 Å²	54.9	4%	0.043	25%	0.25	C	S	.	.	H	α-helix	trans	-66	-50.5	170.4	-84.6	-18.3	0	0	0	111.1	I391 L558 S559 L560 I564 Y565 F566 F815	I391-N562 VanDerWaalsContact CD1-OD1 3.28Å; I391-N562 WeakPolarHBondContact CD1-OD1 3.39Å; I391-N562 WeakPolarHBondContact CG1-OD1 3.43Å; I391-N562 PolarHBondContact N-OD1 3.42Å; I391-N562 VanDerWaalsContact N-OD1 3.1Å; L558-N562 PolarHBondContact O-N 2.79Å; S559-N562 WeakPolarHBondContact O-CB 3.47Å; S559-N562 PolarHBondContact O-N 3.11Å; L560-N562 VanDerWaalsContact C-N 3.26Å; L560-N562 PolarHBondContact O-N 3.37Å; N562-I564 PolarHBondContact O-N 3.1Å; N562-Y565 PolarHBondContact O-N 3.19Å; N562-F566 VanDerWaalsContact O-CD2 3.26Å; N562-F566 WeakPolarHBondContact O-CD2 3.29Å; N562-F566 PolarHBondContact O-N 3.42Å; N562-F566 VanDerWaalsContact O-N 3.12Å; N562-F815 PolarHBondContact ND2-O 3.28Å
563	H	86.6	Confident	86.9	Confident	27 Å²	27	59.1 Å²	59.1	13%	0.125	27%	0.272	C	S	.	.	H	α-helix	trans	-65.3	-37	-178.4	-65.5	-35.1	0	0	0	114.2	S559 L560 Y565 R567 R568 I572	S559-H563 PolarHBondContact O-CD2 3.33Å; S559-H563 VanDerWaalsContact O-CD2 3.31Å; S559-H563 PolarHBondContact O-N 3.16Å; L560-H563 PolarHBondContact O-N 2.96Å; H563-Y565 VanDerWaalsContact C-N 3.31Å; H563-Y565 PolarHBondContact O-N 3.35Å; H563-R567 PolarHBondContact O-N 2.93Å; H563-R568 PolarHBondContact O-N 2.72Å; H563-R568 VanDerWaalsContact O-N 3.07Å; H563-I572 HydrophobicContact CB-CD1 4.27Å; H563-I572 HydrophobicContact CB-CG1 3.59Å
564	I	88.1	Confident	86.5	Confident	90 Å²	90	58 Å²	58	46%	0.462	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-44.2	174.8	-71.4	170.7	0	0	0	110.2	L560 N562 R567 I572	L560-I564 HydrophobicContact CD1-CD1 3.91Å; L560-I564 HydrophobicContact CD1-CG1 4.11Å; L560-I564 HydrophobicContact CD2-CD1 4.34Å; L560-I564 HydrophobicContact CG-CD1 3.74Å; L560-I564 HydrophobicContact CG-CG1 4.34Å; L560-I564 VanDerWaalsContact O-CG1 3.29Å; L560-I564 WeakPolarHBondContact O-CG1 3.4Å; L560-I564 PolarHBondContact O-N 3.48Å; N562-I564 PolarHBondContact O-N 3.1Å; I564-R567 PolarHBondContact O-N 3.48Å; I564-I572 HydrophobicContact CG1-CD1 3.84Å
565	Y	86.3	Confident	86	Confident	77 Å²	77	55.8 Å²	55.8	30%	0.302	26%	0.256	S	S	.	.	H	α-helix	trans	-69.6	-45	-175.8	-175.4	-96.9	0	0	0	113.5	R6 R389 F561 N562 H563 R567	R6-Y565 VanDerWaalsContact CZ-CG 3.44Å; R389-Y565 HydrophobicContact CB-CE1 3.73Å; R389-Y565 PolarHBondContact NE-OH 3.27Å; R389-Y565 PolarHBondContact NH2-OH 2.95Å; F561-Y565 WeakPolarHBondContact O-CB 3.46Å; F561-Y565 PolarHBondContact O-N 2.97Å; N562-Y565 PolarHBondContact O-N 3.19Å; H563-Y565 VanDerWaalsContact C-N 3.31Å; H563-Y565 PolarHBondContact O-N 3.35Å; Y565-R567 PolarHBondContact O-N 3.09Å; Y565-R567 VanDerWaalsContact O-N 3.15Å
566	F	85.6	Confident	86	Confident	81 Å²	81	57 Å²	57	36%	0.355	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	2.5	173.5	-69.2	-68.7	0	0	0	113.3	Y388 N562 R568	Y388-F566 WeakPolarHBondContact O-CZ 3.38Å; N562-F566 VanDerWaalsContact O-CD2 3.26Å; N562-F566 WeakPolarHBondContact O-CD2 3.29Å; N562-F566 PolarHBondContact O-N 3.42Å; N562-F566 VanDerWaalsContact O-N 3.12Å; F566-R568 HydrophobicContact CB-CG 4.14Å; F566-R568 PolarHBondContact O-N 3.17Å
567	R	83.3	Confident	86	Confident	221 Å²	221	60 Å²	60	83%	0.834	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	34.2	-178.9	-60.8	-176	175.8	-179	-0.9	113.7	H563 I564 Y565 T569	H563-R567 PolarHBondContact O-N 2.93Å; I564-R567 PolarHBondContact O-N 3.48Å; Y565-R567 PolarHBondContact O-N 3.09Å; Y565-R567 VanDerWaalsContact O-N 3.15Å; R567-T569 PolarHBondContact O-N 3.45Å
568	R	82.4	Confident	85.9	Confident	146 Å²	146	57.3 Å²	57.3	55%	0.551	26%	0.263	S	S	*	.			trans	-92.1	74	179	-65.6	-177	-176.3	176	0.4	110.9	H563 F566 L570 N571	H563-R568 PolarHBondContact O-N 2.72Å; H563-R568 VanDerWaalsContact O-N 3.07Å; F566-R568 HydrophobicContact CB-CG 4.14Å; F566-R568 PolarHBondContact O-N 3.17Å; R568-L570 PolarHBondContact O-N 3.37Å; R568-N571 HydrophobicContact CB-CB 4.44Å; R568-N571 PolarHBondContact O-N 3.34Å; R568-N571 VanDerWaalsContact O-N 3.13Å
569	T	80.1	Confident	85.9	Confident	92 Å²	92	57.4 Å²	57.4	56%	0.564	26%	0.263	S	S	*	.	H	α-helix	trans	-59.6	-29.3	-176.1	55	0	0	0	0	114.2	R567 I572 I573	R567-T569 PolarHBondContact O-N 3.45Å; T569-I572 PolarHBondContact O-N 3.14Å; T569-I573 PolarHBondContact O-N 3.17Å
570	L	80.1	Confident	86.1	Confident	38 Å²	38	59 Å²	59	20%	0.199	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-43.8	175.4	-75	-176.3	0	0	0	112.7	R568 I572 I573 L574 I661 R665	R568-L570 PolarHBondContact O-N 3.37Å; L570-I572 VanDerWaalsContact C-N 3.29Å; L570-I572 PolarHBondContact O-N 3.42Å; L570-I573 PolarHBondContact O-N 3.24Å; L570-L574 HydrophobicContact CB-CD1 4.49Å; L570-L574 HydrophobicContact CD2-CD1 4.35Å; L570-L574 VanDerWaalsContact O-CB 3.28Å; L570-L574 WeakPolarHBondContact O-CB 3.13Å; L570-L574 VanDerWaalsContact O-CG 3.23Å; L570-L574 WeakPolarHBondContact O-CG 3.43Å; L570-L574 PolarHBondContact O-N 3.16Å; L570-I661 HydrophobicContact CD1-CG2 4.25Å; L570-I661 HydrophobicContact CD2-CG2 3.98Å; L570-R665 VanDerWaalsContact CD1-CZ 3.48Å
571	N	82.5	Confident	86.2	Confident	26 Å²	26	59.2 Å²	59.2	14%	0.139	27%	0.271	C	S	.	.	H	α-helix	trans	-69.1	-31.5	-177.8	-67.7	-4.6	0	0	0	111.2	R568 I573 Q575 F576	R568-N571 HydrophobicContact CB-CB 4.44Å; R568-N571 PolarHBondContact O-N 3.34Å; R568-N571 VanDerWaalsContact O-N 3.13Å; N571-I573 PolarHBondContact O-N 3.32Å; N571-Q575 WeakPolarHBondContact O-CA 3.42Å; N571-Q575 WeakPolarHBondContact O-CB 3.2Å; N571-Q575 PolarHBondContact O-N 3.2Å; N571-F576 PolarHBondContact O-N 3.08Å
572	I	85.8	Confident	86.4	Confident	35 Å²	35	55 Å²	55	18%	0.179	25%	0.253	C	S	.	.	I	π-helix	trans	-60	-49.3	175.6	-59.2	175.5	0	0	0	110.6	L560 H563 I564 T569 L570 I577	L560-I572 HydrophobicContact CD1-CG1 4.32Å; L560-I572 HydrophobicContact CD1-CG2 3.76Å; H563-I572 HydrophobicContact CB-CD1 4.27Å; H563-I572 HydrophobicContact CB-CG1 3.59Å; I564-I572 HydrophobicContact CG1-CD1 3.84Å; T569-I572 PolarHBondContact O-N 3.14Å; L570-I572 VanDerWaalsContact C-N 3.29Å; L570-I572 PolarHBondContact O-N 3.42Å; I572-I577 PolarHBondContact O-N 3.06Å
573	I	85.4	Confident	86.6	Confident	91 Å²	91	54.7 Å²	54.7	47%	0.467	25%	0.252	S	S	.	.	I	π-helix	trans	-76.2	-36.9	-175	-61.4	172.1	0	0	0	111.6	T569 L570 N571	T569-I573 PolarHBondContact O-N 3.17Å; L570-I573 PolarHBondContact O-N 3.24Å; N571-I573 PolarHBondContact O-N 3.32Å
574	L	82.2	Confident	86.8	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.031	27%	0.271	C	S	.	.	I	π-helix	trans	-97.4	-18.8	-168.2	-57.7	179.4	0	0	0	114.4	L570 I657 K658 I661	L570-L574 HydrophobicContact CB-CD1 4.49Å; L570-L574 HydrophobicContact CD2-CD1 4.35Å; L570-L574 VanDerWaalsContact O-CB 3.28Å; L570-L574 WeakPolarHBondContact O-CB 3.13Å; L570-L574 VanDerWaalsContact O-CG 3.23Å; L570-L574 WeakPolarHBondContact O-CG 3.43Å; L570-L574 PolarHBondContact O-N 3.16Å; L574-I657 HydrophobicContact CD1-CG2 4.37Å; L574-I657 HydrophobicContact CD2-CB 3.95Å; L574-I657 HydrophobicContact CD2-CG2 3.33Å; L574-I657 HydrophobicContact CG-CG2 4.46Å; L574-K658 HydrophobicContact CB-CB 4.29Å; L574-K658 HydrophobicContact CD1-CB 3.92Å; L574-K658 HydrophobicContact CD1-CG 4.37Å; L574-I661 HydrophobicContact CD1-CD1 3.84Å; L574-I661 HydrophobicContact CD2-CD1 4.26Å
575	Q	82.8	Confident	86.9	Confident	23 Å²	23	54.7 Å²	54.7	11%	0.107	25%	0.254	C	S	.	.	I	π-helix	trans	-118.4	-61.1	-176.8	-172.2	170.1	-12.9	0	0	110.4	N571 I577 P578 E579 H724	N571-Q575 WeakPolarHBondContact O-CA 3.42Å; N571-Q575 WeakPolarHBondContact O-CB 3.2Å; N571-Q575 PolarHBondContact O-N 3.2Å; Q575-I577 PolarHBondContact O-N 3.33Å; Q575-P578 WeakPolarHBondContact O-CD 3.41Å; Q575-E579 WeakPolarHBondContact CG-OE1 3.5Å; Q575-E579 PolarHBondContact NE2-OE1 3.48Å; Q575-E579 VanDerWaalsContact O-CB 3.29Å; Q575-E579 WeakPolarHBondContact O-CB 3.41Å; Q575-E579 WeakPolarHBondContact O-CG 3.2Å; Q575-E579 PolarHBondContact O-N 2.91Å; Q575-E579 VanDerWaalsContact O-N 3.09Å; Q575-H724 PolarHBondContact NE2-CE1 3.49Å; Q575-H724 PolarHBondContact NE2-NE2 2.96Å
576	F	89.3	Confident	87.1	Confident	25 Å²	25	51.3 Å²	51.3	11%	0.11	24%	0.241	C	C	.	.	I	π-helix	trans	-62.2	-46.4	-175.8	171	-98.5	0	0	0	114.1	V556 L560 N571 E579 M580	V556-F576 HydrophobicContact CG1-CD2 3.95Å; V556-F576 HydrophobicContact CG1-CE2 3.98Å; V556-F576 VanDerWaalsContact O-CE2 3.3Å; V556-F576 WeakPolarHBondContact O-CE2 3.5Å; L560-F576 HydrophobicContact CB-CD1 4.36Å; L560-F576 HydrophobicContact CB-CD2 3.83Å; L560-F576 HydrophobicContact CB-CE1 4.17Å; L560-F576 HydrophobicContact CB-CE2 3.62Å; L560-F576 HydrophobicContact CB-CG 4.19Å; L560-F576 HydrophobicContact CB-CZ 3.79Å; L560-F576 HydrophobicContact CD1-CD1 3.83Å; L560-F576 HydrophobicContact CD1-CE1 3.93Å; L560-F576 HydrophobicContact CD1-CG 4.22Å; L560-F576 HydrophobicContact CD1-CZ 4.41Å; L560-F576 HydrophobicContact CD2-CE1 3.79Å; L560-F576 HydrophobicContact CD2-CE2 4.43Å; L560-F576 HydrophobicContact CD2-CZ 3.73Å; L560-F576 HydrophobicContact CG-CD1 4.45Å; L560-F576 HydrophobicContact CG-CE1 4.17Å; L560-F576 HydrophobicContact CG-CE2 4.47Å; L560-F576 HydrophobicContact CG-CZ 4.17Å; N571-F576 PolarHBondContact O-N 3.08Å; F576-E579 PolarHBondContact O-N 3.38Å; F576-M580 HydrophobicContact CD1-CG 4.46Å; F576-M580 HydrophobicContact CD2-CG 3.91Å; F576-M580 HydrophobicContact CE1-CG 4.02Å; F576-M580 HydrophobicContact CE2-CG 3.39Å; F576-M580 HydrophobicContact CE2-SD 3.94Å; F576-M580 HydrophobicContact CG-CG 4.42Å; F576-M580 HydrophobicContact CZ-CG 3.47Å; F576-M580 VanDerWaalsContact CZ-CG 3.47Å; F576-M580 HydrophobicContact CZ-SD 4.2Å; F576-M580 WeakPolarHBondContact O-CB 3.35Å; F576-M580 WeakPolarHBondContact O-CG 3.28Å; F576-M580 PolarHBondContact O-N 2.93Å
577	I	90.2	Very high	87.3	Confident	62 Å²	62	48 Å²	48	32%	0.318	23%	0.226	S	C	.	.	H	α-helix	trans	-62.2	-51.8	-178.2	-67.3	175.4	0	0	0	111.6	I572 Q575 E579 M580 I581	I572-I577 PolarHBondContact O-N 3.06Å; Q575-I577 PolarHBondContact O-N 3.33Å; I577-E579 VanDerWaalsContact C-N 3.34Å; I577-E579 PolarHBondContact O-N 3.26Å; I577-M580 PolarHBondContact O-N 2.97Å; I577-I581 HydrophobicContact CG2-CD1 3.67Å; I577-I581 HydrophobicContact CG2-CG1 4.43Å; I577-I581 VanDerWaalsContact O-CG1 3.29Å; I577-I581 WeakPolarHBondContact O-CG1 3.46Å; I577-I581 PolarHBondContact O-N 2.87Å
578	P	90.5	Very high	87.7	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.013	20%	0.195	C	C	.	.	H	α-helix	trans	-58.5	-41.8	175.3	-27.9	36.3	0	0	0	113.9	Q575 M580 I581 F582 W653 M654	Q575-P578 WeakPolarHBondContact O-CD 3.41Å; P578-M580 PolarHBondContact O-N 3.17Å; P578-I581 PolarHBondContact O-N 3.34Å; P578-F582 VanDerWaalsContact O-CB 3.32Å; P578-F582 WeakPolarHBondContact O-CB 3.25Å; P578-F582 PolarHBondContact O-N 2.94Å; P578-W653 HydrophobicContact CG-CB 4.34Å; P578-W653 HydrophobicContact CG-CD2 4.1Å; P578-W653 HydrophobicContact CG-CG 3.81Å; P578-M654 HydrophobicContact CB-CB 4.27Å
579	E	90	Very high	88.1	Confident	5 Å²	5	31.7 Å²	31.7	2%	0.023	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-44.7	178.6	-79.4	-179.3	-167.7	0	0	112.4	V556 Q575 F576 I577 F582 I583 M654 H724 Y728	V556-E579 HydrophobicContact CG1-CB 4.37Å; Q575-E579 WeakPolarHBondContact CG-OE1 3.5Å; Q575-E579 PolarHBondContact NE2-OE1 3.48Å; Q575-E579 VanDerWaalsContact O-CB 3.29Å; Q575-E579 WeakPolarHBondContact O-CB 3.41Å; Q575-E579 WeakPolarHBondContact O-CG 3.2Å; Q575-E579 PolarHBondContact O-N 2.91Å; Q575-E579 VanDerWaalsContact O-N 3.09Å; F576-E579 PolarHBondContact O-N 3.38Å; I577-E579 VanDerWaalsContact C-N 3.34Å; I577-E579 PolarHBondContact O-N 3.26Å; E579-F582 PolarHBondContact O-N 3.4Å; E579-I583 PolarHBondContact O-N 3.46Å; E579-I583 VanDerWaalsContact O-N 3.15Å; E579-M654 HydrophobicContact CG-SD 3.95Å; E579-H724 IonicContact OE1-CE1 4Å; E579-H724 PolarHBondContact OE1-CE1 3.32Å; E579-Y728 HydrophobicContact CB-CE1 3.9Å; E579-Y728 HydrophobicContact CB-CE2 4.03Å; E579-Y728 VanDerWaalsContact CB-CZ 3.5Å; E579-Y728 VanDerWaalsContact CB-OH 3.32Å; E579-Y728 WeakPolarHBondContact CB-OH 3.23Å; E579-Y728 HydrophobicContact CG-CD1 4.01Å; E579-Y728 HydrophobicContact CG-CD2 4.03Å; E579-Y728 HydrophobicContact CG-CE1 3.64Å; E579-Y728 HydrophobicContact CG-CE2 3.66Å; E579-Y728 HydrophobicContact CG-CG 4.21Å; E579-Y728 VanDerWaalsContact CG-CZ 3.45Å; E579-Y728 PolarHBondContact O-OH 2.97Å
580	M	91.8	Very high	88.6	Confident	39 Å²	39	28.4 Å²	28.4	19%	0.192	15%	0.149	C	C	.	.	H	α-helix	trans	-67.6	-44.3	177.5	-77.3	-64.2	-63.8	0	0	112.5	V553 V556 I557 F576 I577 P578 F582 L584	V553-M580 HydrophobicContact CG1-CE 4.12Å; V556-M580 HydrophobicContact CB-SD 3.79Å; V556-M580 HydrophobicContact CG1-CG 3.78Å; V556-M580 HydrophobicContact CG1-SD 3.43Å; V556-M580 WeakPolarHBondContact CG1-SD 3.24Å; I557-M580 HydrophobicContact CG1-CE 4.22Å; I557-M580 HydrophobicContact CG1-SD 4.43Å; F576-M580 HydrophobicContact CD1-CG 4.46Å; F576-M580 HydrophobicContact CD2-CG 3.91Å; F576-M580 HydrophobicContact CE1-CG 4.02Å; F576-M580 HydrophobicContact CE2-CG 3.39Å; F576-M580 HydrophobicContact CE2-SD 3.94Å; F576-M580 HydrophobicContact CG-CG 4.42Å; F576-M580 HydrophobicContact CZ-CG 3.47Å; F576-M580 VanDerWaalsContact CZ-CG 3.47Å; F576-M580 HydrophobicContact CZ-SD 4.2Å; F576-M580 WeakPolarHBondContact O-CB 3.35Å; F576-M580 WeakPolarHBondContact O-CG 3.28Å; F576-M580 PolarHBondContact O-N 2.93Å; I577-M580 PolarHBondContact O-N 2.97Å; P578-M580 PolarHBondContact O-N 3.17Å; M580-F582 VanDerWaalsContact C-N 3.3Å; M580-F582 PolarHBondContact O-N 3.34Å; M580-L584 WeakPolarHBondContact O-CB 3.41Å; M580-L584 PolarHBondContact O-N 3.31Å
581	I	92	Very high	89.2	Confident	42 Å²	42	27.5 Å²	27.5	22%	0.215	15%	0.145	C	C	.	.	H	α-helix	trans	-59.5	-45.8	176.3	-69	168.8	0	0	0	109.5	I577 P578 L584 C585 M646	I577-I581 HydrophobicContact CG2-CD1 3.67Å; I577-I581 HydrophobicContact CG2-CG1 4.43Å; I577-I581 VanDerWaalsContact O-CG1 3.29Å; I577-I581 WeakPolarHBondContact O-CG1 3.46Å; I577-I581 PolarHBondContact O-N 2.87Å; P578-I581 PolarHBondContact O-N 3.34Å; I581-L584 PolarHBondContact O-N 2.96Å; I581-C585 WeakPolarHBondContact O-CB 3.46Å; I581-C585 PolarHBondContact O-N 3.04Å; I581-C585 PolarHBondContact O-SG 2.91Å; I581-M646 HydrophobicContact CG2-CE 4.21Å
582	F	92	Very high	89.6	Confident	18 Å²	18	31 Å²	31	8%	0.079	16%	0.16	C	C	.	.	H	α-helix	trans	-59.2	-51.3	-179.5	-176	-97.9	0	0	0	112.7	P578 E579 M580 L586 A647 V651 Y728 C729 C732	P578-F582 VanDerWaalsContact O-CB 3.32Å; P578-F582 WeakPolarHBondContact O-CB 3.25Å; P578-F582 PolarHBondContact O-N 2.94Å; E579-F582 PolarHBondContact O-N 3.4Å; M580-F582 VanDerWaalsContact C-N 3.3Å; M580-F582 PolarHBondContact O-N 3.34Å; F582-L586 HydrophobicContact CD2-CD1 4.35Å; F582-L586 HydrophobicContact CE1-CD1 4.24Å; F582-L586 HydrophobicContact CE2-CD1 3.83Å; F582-L586 HydrophobicContact CZ-CD1 3.77Å; F582-L586 PolarHBondContact O-N 3.1Å; F582-A647 HydrophobicContact CD2-CB 4.14Å; F582-A647 HydrophobicContact CE2-CB 4.49Å; F582-V651 HydrophobicContact CD2-CG2 4.44Å; F582-V651 HydrophobicContact CE2-CG2 4.28Å; F582-Y728 HydrophobicContact CD1-CE1 4.05Å; F582-C729 HydrophobicContact CE1-CB 4.5Å; F582-C729 HydrophobicContact CZ-CB 4.2Å; F582-C732 HydrophobicContact CD1-CB 4.48Å; F582-C732 HydrophobicContact CE1-CB 3.98Å
583	I	91.3	Very high	89.8	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.015	15%	0.151	C	C	.	.	H	α-helix	trans	-65.9	-44.6	179.3	-81.1	-179.7	0	0	0	111.6	V553 V556 E579 F587 G588 Y728 C732	V553-I583 HydrophobicContact CG2-CG2 3.53Å; V556-I583 HydrophobicContact CG2-CD1 4.08Å; E579-I583 PolarHBondContact O-N 3.46Å; E579-I583 VanDerWaalsContact O-N 3.15Å; I583-F587 WeakPolarHBondContact O-CA 3.22Å; I583-F587 WeakPolarHBondContact O-CB 3.42Å; I583-F587 PolarHBondContact O-N 3.47Å; I583-G588 PolarHBondContact O-N 3.23Å; I583-Y728 WeakPolarHBondContact CD1-OH 3.38Å; I583-Y728 WeakPolarHBondContact CG1-OH 3.49Å; I583-C732 HydrophobicContact CG1-CB 4.48Å
584	L	90.9	Very high	90.1	Very high	104 Å²	104	25.4 Å²	25.4	55%	0.545	13%	0.13	S	C	.	.	I	π-helix	trans	-69.2	-40.6	-174.5	-168.9	70.5	0	0	0	111.7	M580 I581 G588 Y589	M580-L584 WeakPolarHBondContact O-CB 3.41Å; M580-L584 PolarHBondContact O-N 3.31Å; I581-L584 PolarHBondContact O-N 2.96Å; L584-G588 CarbonylContact O-C 3.12Å; L584-G588 WeakPolarHBondContact O-CA 3.33Å; L584-G588 PolarHBondContact O-N 2.94Å; L584-Y589 PolarHBondContact O-N 2.93Å; L584-Y589 VanDerWaalsContact O-N 3.11Å
585	C	91.3	Very high	90.5	Very high	13 Å²	13	29 Å²	29	9%	0.088	15%	0.149	C	C	.	.	I	π-helix	trans	-66	-38.9	179.5	-73.1	0	0	0	0	112.9	I581 Y589 F643 A647	I581-C585 WeakPolarHBondContact O-CB 3.46Å; I581-C585 PolarHBondContact O-N 3.04Å; I581-C585 PolarHBondContact O-SG 2.91Å; C585-Y589 VanDerWaalsContact O-CB 3.25Å; C585-Y589 WeakPolarHBondContact O-CB 3.29Å; C585-F643 HydrophobicContact CB-CB 4.1Å; C585-F643 HydrophobicContact CB-CD1 4.18Å; C585-F643 HydrophobicContact CB-CG 4.36Å; C585-A647 HydrophobicContact CB-CB 4.47Å
586	L	89.6	Confident	90.8	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.026	15%	0.154	C	C	.	.	I	π-helix	trans	-88.9	-61.1	-178.8	-61.4	-179	0	0	0	111.9	F582 L590 M619 F620 A647	F582-L586 HydrophobicContact CD2-CD1 4.35Å; F582-L586 HydrophobicContact CE1-CD1 4.24Å; F582-L586 HydrophobicContact CE2-CD1 3.83Å; F582-L586 HydrophobicContact CZ-CD1 3.77Å; F582-L586 PolarHBondContact O-N 3.1Å; L586-L590 PolarHBondContact O-N 3.37Å; L586-M619 HydrophobicContact CD2-CE 4.02Å; L586-F620 HydrophobicContact CD1-CE1 4.06Å; L586-F620 HydrophobicContact CD1-CZ 4.05Å; L586-F620 HydrophobicContact CD2-CE1 3.66Å; L586-F620 HydrophobicContact CD2-CZ 3.71Å; L586-F620 HydrophobicContact CG-CE1 4.47Å; L586-F620 HydrophobicContact CG-CZ 4.32Å; L586-A647 HydrophobicContact CD1-CB 4.24Å; L586-A647 HydrophobicContact CD2-CB 3.94Å; L586-A647 HydrophobicContact CG-CB 3.96Å
587	F	90.2	Very high	90.7	Very high	11 Å²	11	31 Å²	31	5%	0.048	16%	0.158	C	C	.	.	I	π-helix	trans	-89.1	-35.8	-170.7	-64.1	-68.2	0	0	0	112.4	I549 I583 Y589 L590 V591 F616 C732 I733 T736	I549-F587 HydrophobicContact CD1-CB 3.78Å; I549-F587 HydrophobicContact CD1-CD1 4.47Å; I549-F587 HydrophobicContact CG1-CB 3.99Å; I549-F587 HydrophobicContact CG2-CB 4.18Å; I583-F587 WeakPolarHBondContact O-CA 3.22Å; I583-F587 WeakPolarHBondContact O-CB 3.42Å; I583-F587 PolarHBondContact O-N 3.47Å; F587-Y589 PolarHBondContact O-N 3.32Å; F587-L590 WeakPolarHBondContact O-CB 3.37Å; F587-L590 PolarHBondContact O-N 2.96Å; F587-L590 VanDerWaalsContact O-N 3.1Å; F587-V591 PolarHBondContact O-N 3.46Å; F587-F616 HydrophobicContact CD1-CZ 4.4Å; F587-F616 HydrophobicContact CE1-CZ 4.12Å; F587-C732 HydrophobicContact CE2-CB 4.19Å; F587-I733 HydrophobicContact CE2-CG1 4.48Å; F587-I733 HydrophobicContact CZ-CB 4.39Å; F587-I733 HydrophobicContact CZ-CG1 4Å; F587-T736 HydrophobicContact CD1-CG2 3.71Å; F587-T736 HydrophobicContact CE1-CG2 3.82Å; F587-T736 HydrophobicContact CG-CG2 4.46Å
588	G	90.8	Very high	90.6	Very high	18 Å²	18	33.6 Å²	33.6	19%	0.186	16%	0.163	C	C	.	.	I	π-helix	trans	-58.6	-39.9	171	0	0	0	0	0	112	I583 L584 V591 F592	I583-G588 PolarHBondContact O-N 3.23Å; L584-G588 CarbonylContact O-C 3.12Å; L584-G588 WeakPolarHBondContact O-CA 3.33Å; L584-G588 PolarHBondContact O-N 2.94Å; G588-V591 PolarHBondContact O-N 3.46Å; G588-F592 PolarHBondContact O-N 2.96Å
589	Y	91.4	Very high	90.3	Very high	8 Å²	8	38.2 Å²	38.2	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-67.4	-34.4	174	-178.9	-121.8	0	0	0	113.3	L584 C585 F587 F592 M593 M619 Y633 Q640 F643	L584-Y589 PolarHBondContact O-N 2.93Å; L584-Y589 VanDerWaalsContact O-N 3.11Å; C585-Y589 VanDerWaalsContact O-CB 3.25Å; C585-Y589 WeakPolarHBondContact O-CB 3.29Å; F587-Y589 PolarHBondContact O-N 3.32Å; Y589-F592 HydrophobicContact CD2-CB 4.5Å; Y589-F592 AromaticContact CD2-CD1 3.92Å; Y589-F592 HydrophobicContact CD2-CD1 3.92Å; Y589-F592 AromaticContact CE2-CD1 3.83Å; Y589-F592 HydrophobicContact CE2-CD1 3.83Å; Y589-F592 HydrophobicContact CE2-CE1 4.32Å; Y589-F592 WeakPolarHBondContact O-CB 3.48Å; Y589-F592 PolarHBondContact O-N 3.13Å; Y589-M593 HydrophobicContact CD1-CE 3.62Å; Y589-M593 HydrophobicContact CE1-CE 2.98Å; Y589-M593 HydrophobicContact CE1-CG 4.34Å; Y589-M593 HydrophobicContact CE1-SD 4.46Å; Y589-M593 HydrophobicContact CE2-CG 4.35Å; Y589-M593 VanDerWaalsContact CZ-CE 3.5Å; Y589-M593 PolarHBondContact O-N 2.98Å; Y589-M619 HydrophobicContact CD1-SD 3.81Å; Y589-M619 HydrophobicContact CE1-SD 3.95Å; Y589-Y633 PolarHBondContact OH-OH 3.06Å; Y589-Q640 HydrophobicContact CE1-CG 3.65Å; Y589-Q640 WeakPolarHBondContact OH-CG 3.07Å; Y589-Q640 PolarHBondContact OH-NE2 3.25Å; Y589-F643 HydrophobicContact CD1-CD2 4.12Å; Y589-F643 AromaticContact CD2-CD2 4Å; Y589-F643 HydrophobicContact CD2-CD2 4Å; Y589-F643 AromaticContact CD2-CE2 3.65Å; Y589-F643 HydrophobicContact CD2-CE2 3.65Å; Y589-F643 HydrophobicContact CE2-CE2 4.19Å; Y589-F643 AromaticContact CG-CD2 3.82Å; Y589-F643 HydrophobicContact CG-CD2 3.82Å; Y589-F643 AromaticContact CG-CE2 3.91Å; Y589-F643 HydrophobicContact CG-CE2 3.91Å
590	L	90.8	Very high	89.9	Confident	22 Å²	22	41.1 Å²	41.1	12%	0.115	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-43.4	171.5	178.9	64.2	0	0	0	111.8	V545 L586 F587 F592 M593 I594 I612 F616	V545-L590 HydrophobicContact CG1-CD2 3.98Å; L586-L590 PolarHBondContact O-N 3.37Å; F587-L590 WeakPolarHBondContact O-CB 3.37Å; F587-L590 PolarHBondContact O-N 2.96Å; F587-L590 VanDerWaalsContact O-N 3.1Å; L590-F592 VanDerWaalsContact C-N 3.32Å; L590-F592 PolarHBondContact O-N 3.24Å; L590-M593 PolarHBondContact O-N 3.01Å; L590-I594 HydrophobicContact CG-CD1 4.46Å; L590-I594 WeakPolarHBondContact O-CG1 3.17Å; L590-I594 PolarHBondContact O-N 2.95Å; L590-I594 VanDerWaalsContact O-N 3.14Å; L590-I612 HydrophobicContact CD1-CG2 3.7Å; L590-F616 HydrophobicContact CB-CD2 4.33Å; L590-F616 HydrophobicContact CB-CE2 4.14Å; L590-F616 HydrophobicContact CD1-CB 4.46Å; L590-F616 HydrophobicContact CD1-CD2 3.99Å; L590-F616 HydrophobicContact CD1-CE2 4.48Å; L590-F616 HydrophobicContact CD1-CG 4.26Å; L590-F616 HydrophobicContact CD2-CE2 4.33Å; L590-F616 HydrophobicContact CD2-CZ 4.44Å
591	V	91.8	Very high	89.3	Confident	20 Å²	20	41.5 Å²	41.5	12%	0.121	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-43.9	174.4	173	0	0	0	0	110.8	I546 I549 F587 G588 M593 I594 I595	I546-V591 HydrophobicContact CG1-CG1 4.21Å; I546-V591 HydrophobicContact CG1-CG2 4.43Å; I546-V591 HydrophobicContact CG2-CG1 4.35Å; I549-V591 HydrophobicContact CB-CG2 3.92Å; I549-V591 HydrophobicContact CD1-CG2 3.51Å; I549-V591 HydrophobicContact CG1-CG2 4.31Å; I549-V591 HydrophobicContact CG2-CG2 3.93Å; F587-V591 PolarHBondContact O-N 3.46Å; G588-V591 PolarHBondContact O-N 3.46Å; V591-M593 PolarHBondContact O-N 3.43Å; V591-I594 PolarHBondContact O-N 3.14Å; V591-I594 VanDerWaalsContact O-N 3.17Å; V591-I595 HydrophobicContact CG1-CD1 3.83Å; V591-I595 HydrophobicContact CG1-CG1 4.45Å; V591-I595 WeakPolarHBondContact O-CG1 3.34Å; V591-I595 PolarHBondContact O-N 2.89Å
592	F	91.9	Very high	88.4	Confident	100 Å²	100	45.1 Å²	45.1	44%	0.439	24%	0.235	S	C	.	.	H	α-helix	trans	-58.2	-44.9	175.6	173.8	-97.7	0	0	0	112.1	G588 Y589 L590 I594 I595 F596 Y633	G588-F592 PolarHBondContact O-N 2.96Å; Y589-F592 HydrophobicContact CD2-CB 4.5Å; Y589-F592 AromaticContact CD2-CD1 3.92Å; Y589-F592 HydrophobicContact CD2-CD1 3.92Å; Y589-F592 AromaticContact CE2-CD1 3.83Å; Y589-F592 HydrophobicContact CE2-CD1 3.83Å; Y589-F592 HydrophobicContact CE2-CE1 4.32Å; Y589-F592 WeakPolarHBondContact O-CB 3.48Å; Y589-F592 PolarHBondContact O-N 3.13Å; L590-F592 VanDerWaalsContact C-N 3.32Å; L590-F592 PolarHBondContact O-N 3.24Å; F592-I594 VanDerWaalsContact C-N 3.3Å; F592-I594 PolarHBondContact O-N 3.37Å; F592-I595 PolarHBondContact O-N 3.07Å; F592-F596 HydrophobicContact CZ-CD2 4.14Å; F592-F596 WeakPolarHBondContact O-CB 3.41Å; F592-F596 PolarHBondContact O-N 3.05Å; F592-Y633 HydrophobicContact CE1-CE1 4.35Å
593	M	89.5	Confident	87.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-39.1	175.9	-70.3	-165.6	-154.9	0	0	112.8	Y589 L590 V591 K597 I612 H615 L632	Y589-M593 HydrophobicContact CD1-CE 3.62Å; Y589-M593 HydrophobicContact CE1-CE 2.98Å; Y589-M593 HydrophobicContact CE1-CG 4.34Å; Y589-M593 HydrophobicContact CE1-SD 4.46Å; Y589-M593 HydrophobicContact CE2-CG 4.35Å; Y589-M593 VanDerWaalsContact CZ-CE 3.5Å; Y589-M593 PolarHBondContact O-N 2.98Å; L590-M593 PolarHBondContact O-N 3.01Å; V591-M593 PolarHBondContact O-N 3.43Å; M593-K597 VanDerWaalsContact O-CB 3.31Å; M593-K597 WeakPolarHBondContact O-CB 3.33Å; M593-K597 PolarHBondContact O-N 3.48Å; M593-I612 HydrophobicContact CB-CG2 4.23Å; M593-I612 HydrophobicContact SD-CG2 4.12Å; M593-H615 HydrophobicContact SD-CB 4.36Å; M593-L632 HydrophobicContact CB-CD2 4.29Å; M593-L632 HydrophobicContact CG-CD2 4.37Å
594	I	91.2	Very high	86.3	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-50.5	179.7	-66.9	166.3	0	0	0	110.3	K542 V545 I546 L590 V591 F592 K597 W598 I612	K542-I594 HydrophobicContact CB-CG2 4.01Å; K542-I594 HydrophobicContact CD-CG2 4.02Å; K542-I594 HydrophobicContact CG-CD1 4.44Å; K542-I594 HydrophobicContact CG-CG2 4.14Å; V545-I594 HydrophobicContact CG1-CD1 4.44Å; I546-I594 HydrophobicContact CD1-CG2 3.86Å; I546-I594 HydrophobicContact CG1-CD1 4.36Å; L590-I594 HydrophobicContact CG-CD1 4.46Å; L590-I594 WeakPolarHBondContact O-CG1 3.17Å; L590-I594 PolarHBondContact O-N 2.95Å; L590-I594 VanDerWaalsContact O-N 3.14Å; V591-I594 PolarHBondContact O-N 3.14Å; V591-I594 VanDerWaalsContact O-N 3.17Å; F592-I594 VanDerWaalsContact C-N 3.3Å; F592-I594 PolarHBondContact O-N 3.37Å; I594-K597 PolarHBondContact O-N 3.03Å; I594-W598 HydrophobicContact CG2-CD2 4.17Å; I594-W598 HydrophobicContact CG2-CE3 4.16Å; I594-W598 HydrophobicContact CG2-CH2 4.03Å; I594-W598 HydrophobicContact CG2-CZ2 4.04Å; I594-W598 HydrophobicContact CG2-CZ3 4.09Å; I594-W598 PolarHBondContact O-N 3.03Å; I594-W598 VanDerWaalsContact O-N 3.1Å; I594-I612 HydrophobicContact CB-CD1 4.44Å; I594-I612 HydrophobicContact CG1-CD1 3.88Å
595	I	90.9	Very high	85.5	Confident	82 Å²	82	52.2 Å²	52.2	42%	0.421	27%	0.273	S	S	.	.	H	α-helix	trans	-64.5	-44.4	-179.4	-64.1	172.7	0	0	0	110.1	V591 F592 K597 W598 C599	V591-I595 HydrophobicContact CG1-CD1 3.83Å; V591-I595 HydrophobicContact CG1-CG1 4.45Å; V591-I595 WeakPolarHBondContact O-CG1 3.34Å; V591-I595 PolarHBondContact O-N 2.89Å; F592-I595 PolarHBondContact O-N 3.07Å; I595-K597 VanDerWaalsContact C-N 3.31Å; I595-K597 PolarHBondContact O-N 3.4Å; I595-W598 PolarHBondContact O-N 3.2Å; I595-W598 VanDerWaalsContact O-N 3.1Å; I595-C599 PolarHBondContact O-N 3.4Å; I595-C599 VanDerWaalsContact O-N 3.1Å; I595-C599 PolarHBondContact O-SG 3.47Å; I595-C599 VanDerWaalsContact O-SG 3.42Å
596	F	89.4	Confident	84.5	Confident	50 Å²	50	54.9 Å²	54.9	22%	0.219	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-42.9	177.1	-173.7	-87.8	0	0	0	111.8	F592 W598 C599 C600 L632	F592-F596 HydrophobicContact CZ-CD2 4.14Å; F592-F596 WeakPolarHBondContact O-CB 3.41Å; F592-F596 PolarHBondContact O-N 3.05Å; F596-W598 VanDerWaalsContact C-N 3.29Å; F596-W598 PolarHBondContact O-N 2.92Å; F596-C599 PolarHBondContact O-N 3.32Å; F596-C600 HydrophobicContact CD1-CB 4.45Å; F596-C600 HydrophobicContact CE1-CB 4.03Å; F596-C600 HydrophobicContact CZ-CB 4.27Å; F596-C600 VanDerWaalsContact CZ-SG 3.51Å; F596-C600 PolarHBondContact O-N 2.97Å; F596-L632 HydrophobicContact CD1-CB 4.27Å; F596-L632 HydrophobicContact CD1-CD2 3.77Å; F596-L632 HydrophobicContact CD1-CG 4.2Å; F596-L632 HydrophobicContact CE1-CB 4.11Å; F596-L632 HydrophobicContact CE1-CD2 4.44Å; F596-L632 HydrophobicContact CE1-CG 4.43Å; F596-L632 WeakPolarHBondContact CE1-O 3.35Å
597	K	87.9	Confident	83.6	Confident	41 Å²	41	63.2 Å²	63.2	18%	0.178	33%	0.331	C	S	.	.	H	α-helix	trans	-61.9	-37.5	176.2	-176.6	172.9	-177.4	170.2	0	112	M593 I594 I595 C599 F601 P610 I612	M593-K597 VanDerWaalsContact O-CB 3.31Å; M593-K597 WeakPolarHBondContact O-CB 3.33Å; M593-K597 PolarHBondContact O-N 3.48Å; I594-K597 PolarHBondContact O-N 3.03Å; I595-K597 VanDerWaalsContact C-N 3.31Å; I595-K597 PolarHBondContact O-N 3.4Å; K597-C599 VanDerWaalsContact C-N 3.33Å; K597-F601 HydrophobicContact CB-CD2 4.34Å; K597-F601 HydrophobicContact CG-CD2 3.78Å; K597-F601 HydrophobicContact CG-CE2 4.22Å; K597-P610 PolarHBondContact NZ-O 3.34Å; K597-I612 HydrophobicContact CB-CD1 4.24Å; K597-I612 HydrophobicContact CD-CD1 3.74Å; K597-I612 HydrophobicContact CD-CG1 3.85Å
598	W	87.3	Confident	82.7	Confident	116 Å²	116	69.1 Å²	69.1	44%	0.439	36%	0.358	S	S	.	.	H	α-helix	trans	-68.9	-28.2	176.7	-74.1	-28.4	0	0	0	113.5	Y539 K542 I546 I594 I595 F596	Y539-W598 HydrophobicContact CD2-CZ2 4.4Å; K542-W598 HydrophobicContact CB-CH2 4.21Å; K542-W598 HydrophobicContact CB-CZ2 3.84Å; K542-W598 HydrophobicContact CD-CZ2 3.9Å; I546-W598 HydrophobicContact CD1-CH2 3.81Å; I546-W598 HydrophobicContact CD1-CZ3 3.67Å; I594-W598 HydrophobicContact CG2-CD2 4.17Å; I594-W598 HydrophobicContact CG2-CE3 4.16Å; I594-W598 HydrophobicContact CG2-CH2 4.03Å; I594-W598 HydrophobicContact CG2-CZ2 4.04Å; I594-W598 HydrophobicContact CG2-CZ3 4.09Å; I594-W598 PolarHBondContact O-N 3.03Å; I594-W598 VanDerWaalsContact O-N 3.1Å; I595-W598 PolarHBondContact O-N 3.2Å; I595-W598 VanDerWaalsContact O-N 3.1Å; F596-W598 VanDerWaalsContact C-N 3.29Å; F596-W598 PolarHBondContact O-N 2.92Å
599	C	85.4	Confident	82.2	Confident	98 Å²	98	70.2 Å²	70.2	66%	0.662	37%	0.365	S	S	*	.	H	α-helix	trans	-89.4	-30	-178.5	-64.1	0	0	0	0	114.7	I595 F596 K597	I595-C599 PolarHBondContact O-N 3.4Å; I595-C599 VanDerWaalsContact O-N 3.1Å; I595-C599 PolarHBondContact O-SG 3.47Å; I595-C599 VanDerWaalsContact O-SG 3.42Å; F596-C599 PolarHBondContact O-N 3.32Å; K597-C599 VanDerWaalsContact C-N 3.33Å
600	C	80.1	Confident	81.7	Confident	66 Å²	66	70 Å²	70	45%	0.446	37%	0.365	S	S	.	.	H	α-helix	trans	-103.4	-19.6	-168.6	-71.1	0	0	0	0	115.6	F596	F596-C600 HydrophobicContact CD1-CB 4.45Å; F596-C600 HydrophobicContact CE1-CB 4.03Å; F596-C600 HydrophobicContact CZ-CB 4.27Å; F596-C600 VanDerWaalsContact CZ-SG 3.51Å; F596-C600 PolarHBondContact O-N 2.97Å
601	F	79.5	Confident	81.4	Confident	48 Å²	48	71.3 Å²	71.3	21%	0.211	38%	0.376	C	S	.	.			trans	-99.8	103	-176	-71.2	-87.3	0	0	0	111.6	K597 V605 A609 P610 L632	K597-F601 HydrophobicContact CB-CD2 4.34Å; K597-F601 HydrophobicContact CG-CD2 3.78Å; K597-F601 HydrophobicContact CG-CE2 4.22Å; F601-V605 HydrophobicContact CD1-CG1 4.14Å; F601-V605 HydrophobicContact CE1-CG1 4.36Å; F601-A609 HydrophobicContact CD1-CB 4.04Å; F601-A609 HydrophobicContact CE1-CB 4.42Å; F601-P610 VanDerWaalsContact CE1-CD 3.5Å; F601-P610 HydrophobicContact CE1-CG 4.48Å; F601-P610 HydrophobicContact CE2-CG 4.43Å; F601-P610 HydrophobicContact CZ-CG 3.83Å; F601-L632 HydrophobicContact CE2-CG 4.41Å
602	D	72.4	Confident	81.2	Confident	117 Å²	117	71.1 Å²	71.1	63%	0.626	37%	0.374	S	S	*	.			trans	-90.9	170.2	172.2	-75.3	-33.1	0	0	0	112.6	H604 V605 S606	D602-H604 PolarHBondContact O-N 3.06Å; D602-H604 VanDerWaalsContact O-N 3.13Å; D602-V605 PolarHBondContact O-N 3Å; D602-S606 PolarHBondContact O-N 3.41Å
603	V	70.5	Confident	80.9	Confident	48 Å²	48	72 Å²	72	29%	0.291	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-48.8	-41.6	-178.5	175.2	0	0	0	0	113	P507 A508 V605 S606	P507-V603 HydrophobicContact CB-CG1 3.93Å; P507-V603 HydrophobicContact CB-CG2 3.83Å; P507-V603 HydrophobicContact CG-CG1 3.7Å; P507-V603 HydrophobicContact CG-CG2 4.14Å; A508-V603 HydrophobicContact CB-CG1 3.92Å; V603-V605 VanDerWaalsContact C-N 3.3Å; V603-V605 PolarHBondContact O-N 3.04Å; V603-S606 WeakPolarHBondContact O-CB 3.35Å; V603-S606 PolarHBondContact O-N 3.04Å; V603-S606 PolarHBondContact O-OG 2.98Å
604	H	70.7	Confident	80.7	Confident	155 Å²	155	75 Å²	75	72%	0.718	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-72.5	-19.3	-177.6	-58.6	-62.6	0	0	0	114.2	D602	D602-H604 PolarHBondContact O-N 3.06Å; D602-H604 VanDerWaalsContact O-N 3.13Å
605	V	73.3	Confident	80.4	Confident	71 Å²	71	75.4 Å²	75.4	43%	0.43	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-106.7	0.6	-178.8	-169.7	0	0	0	0	111.2	F601 D602 V603 Q607 H608	F601-V605 HydrophobicContact CD1-CG1 4.14Å; F601-V605 HydrophobicContact CE1-CG1 4.36Å; D602-V605 PolarHBondContact O-N 3Å; V603-V605 VanDerWaalsContact C-N 3.3Å; V603-V605 PolarHBondContact O-N 3.04Å; V605-Q607 VanDerWaalsContact C-N 3.28Å; V605-Q607 PolarHBondContact O-N 3.46Å; V605-H608 PolarHBondContact O-N 3.3Å; V605-H608 VanDerWaalsContact O-N 3.12Å
606	S	69.8	Low	80.2	Confident	70 Å²	70	73.1 Å²	73.1	49%	0.49	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-58.7	-31.8	-173.2	62	0	0	0	0	114.6	D602 V603 H608 A609	D602-S606 PolarHBondContact O-N 3.41Å; V603-S606 WeakPolarHBondContact O-CB 3.35Å; V603-S606 PolarHBondContact O-N 3.04Å; V603-S606 PolarHBondContact O-OG 2.98Å; S606-H608 PolarHBondContact O-N 3.44Å; S606-A609 VanDerWaalsContact O-CB 3.28Å; S606-A609 WeakPolarHBondContact O-CB 3.43Å; S606-A609 PolarHBondContact O-N 3.41Å
607	Q	71.9	Confident	80.2	Confident	180 Å²	180	75.1 Å²	75.1	84%	0.841	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-63.9	-27.5	178.8	-72.8	-174.4	-10.2	0	0	113.4	V605	V605-Q607 VanDerWaalsContact C-N 3.28Å; V605-Q607 PolarHBondContact O-N 3.46Å
608	H	71.3	Confident	80.1	Confident	135 Å²	135	74.3 Å²	74.3	63%	0.625	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-101.8	13.8	179.3	-61.8	-59.1	0	0	0	112.8	V605 S606 P610	V605-H608 PolarHBondContact O-N 3.3Å; V605-H608 VanDerWaalsContact O-N 3.12Å; S606-H608 PolarHBondContact O-N 3.44Å; H608-P610 VanDerWaalsContact O-CD 3.24Å; H608-P610 WeakPolarHBondContact O-CD 3.32Å
609	A	79	Confident	80	Confident	40 Å²	40	68.8 Å²	68.8	33%	0.331	38%	0.376	S	S	.	.			trans	-69.1	115.5	-175.2	0	0	0	0	0	111.8	F601 S606	F601-A609 HydrophobicContact CD1-CB 4.04Å; F601-A609 HydrophobicContact CE1-CB 4.42Å; S606-A609 VanDerWaalsContact O-CB 3.28Å; S606-A609 WeakPolarHBondContact O-CB 3.43Å; S606-A609 PolarHBondContact O-N 3.41Å
610	P	81.6	Confident	80	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.032	36%	0.363	C	S	.	.			trans	-72.9	154.7	-173.8	25	-30.5	0	0	0	113.4	K597 F601 H608 H615 A630 L632	K597-P610 PolarHBondContact NZ-O 3.34Å; F601-P610 VanDerWaalsContact CE1-CD 3.5Å; F601-P610 HydrophobicContact CE1-CG 4.48Å; F601-P610 HydrophobicContact CE2-CG 4.43Å; F601-P610 HydrophobicContact CZ-CG 3.83Å; H608-P610 VanDerWaalsContact O-CD 3.24Å; H608-P610 WeakPolarHBondContact O-CD 3.32Å; P610-H615 WeakPolarHBondContact CB-CE1 3.49Å; P610-A630 WeakPolarHBondContact CB-O 3.45Å; P610-L632 HydrophobicContact CB-CD1 4.14Å; P610-L632 HydrophobicContact CG-CD1 3.37Å; P610-L632 HydrophobicContact CG-CG 4.27Å
611	S	85.1	Confident	80.3	Confident	48 Å²	48	71 Å²	71	34%	0.336	37%	0.371	S	S	.	.			trans	-81.5	121.3	172.7	-178.3	0	0	0	0	111.4	L613 I614 H615	S611-L613 VanDerWaalsContact C-N 3.3Å; S611-L613 PolarHBondContact O-N 3Å; S611-I614 PolarHBondContact O-N 3.08Å; S611-H615 PolarHBondContact O-N 3.48Å; S611-H615 PolarHBondContact O-ND1 3.07Å
612	I	85.7	Confident	80.4	Confident	17 Å²	17	73.9 Å²	73.9	9%	0.087	38%	0.384	C	S	.	.	H	α-helix	trans	-63.4	-38.4	179.3	-58.8	175.5	0	0	0	110.6	L590 M593 I594 K597 I614 H615 F616	L590-I612 HydrophobicContact CD1-CG2 3.7Å; M593-I612 HydrophobicContact CB-CG2 4.23Å; M593-I612 HydrophobicContact SD-CG2 4.12Å; I594-I612 HydrophobicContact CB-CD1 4.44Å; I594-I612 HydrophobicContact CG1-CD1 3.88Å; K597-I612 HydrophobicContact CB-CD1 4.24Å; K597-I612 HydrophobicContact CD-CD1 3.74Å; K597-I612 HydrophobicContact CD-CG1 3.85Å; I612-I614 PolarHBondContact O-N 3.24Å; I612-H615 PolarHBondContact O-N 3.4Å; I612-F616 WeakPolarHBondContact O-CB 3.27Å; I612-F616 PolarHBondContact O-N 3.25Å
613	L	85.9	Confident	80.8	Confident	117 Å²	117	71.4 Å²	71.4	61%	0.613	37%	0.371	S	S	*	.	H	α-helix	trans	-63.1	-44.1	-178.3	-175.4	68.4	0	0	0	111.6	S611 F616 I617	S611-L613 VanDerWaalsContact C-N 3.3Å; S611-L613 PolarHBondContact O-N 3Å; L613-F616 PolarHBondContact O-N 2.92Å; L613-I617 HydrophobicContact CG-CD1 4.11Å; L613-I617 WeakPolarHBondContact O-CG1 3.4Å; L613-I617 PolarHBondContact O-N 3.15Å
614	I	86.3	Confident	80.9	Confident	63 Å²	63	72.2 Å²	72.2	32%	0.323	37%	0.369	S	S	.	.	H	α-helix	trans	-66.5	-42.5	179.3	-60.5	173.5	0	0	0	110.1	S611 I612 F616 I617 N618	S611-I614 PolarHBondContact O-N 3.08Å; I612-I614 PolarHBondContact O-N 3.24Å; I614-F616 VanDerWaalsContact C-N 3.27Å; I614-F616 PolarHBondContact O-N 3.49Å; I614-I617 PolarHBondContact O-N 3.48Å; I614-N618 VanDerWaalsContact O-CB 3.26Å; I614-N618 WeakPolarHBondContact O-CB 3.5Å; I614-N618 VanDerWaalsContact O-CG 3.25Å; I614-N618 PolarHBondContact O-N 3.21Å
615	H	85.1	Confident	80.5	Confident	16 Å²	16	69.9 Å²	69.9	7%	0.074	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-36	174.8	-76.3	78.7	0	0	0	112.7	M593 P610 S611 I612 M619 Q636	M593-H615 HydrophobicContact SD-CB 4.36Å; P610-H615 WeakPolarHBondContact CB-CE1 3.49Å; S611-H615 PolarHBondContact O-N 3.48Å; S611-H615 PolarHBondContact O-ND1 3.07Å; I612-H615 PolarHBondContact O-N 3.4Å; H615-M619 WeakPolarHBondContact O-CB 3.2Å; H615-M619 PolarHBondContact O-N 3Å; H615-Q636 PolarHBondContact CD2-NE2 3.3Å; H615-Q636 VanDerWaalsContact CD2-NE2 3.29Å
616	F	87.1	Confident	80.1	Confident	35 Å²	35	69.8 Å²	69.8	15%	0.154	37%	0.367	C	S	.	.	H	α-helix	trans	-71.1	-39	176.6	-171.8	-107.9	0	0	0	112.3	F587 L590 I612 L613 I614 M619 F620	F587-F616 HydrophobicContact CD1-CZ 4.4Å; F587-F616 HydrophobicContact CE1-CZ 4.12Å; L590-F616 HydrophobicContact CB-CD2 4.33Å; L590-F616 HydrophobicContact CB-CE2 4.14Å; L590-F616 HydrophobicContact CD1-CB 4.46Å; L590-F616 HydrophobicContact CD1-CD2 3.99Å; L590-F616 HydrophobicContact CD1-CE2 4.48Å; L590-F616 HydrophobicContact CD1-CG 4.26Å; L590-F616 HydrophobicContact CD2-CE2 4.33Å; L590-F616 HydrophobicContact CD2-CZ 4.44Å; I612-F616 WeakPolarHBondContact O-CB 3.27Å; I612-F616 PolarHBondContact O-N 3.25Å; L613-F616 PolarHBondContact O-N 2.92Å; I614-F616 VanDerWaalsContact C-N 3.27Å; I614-F616 PolarHBondContact O-N 3.49Å; F616-M619 HydrophobicContact CD2-CE 3.75Å; F616-M619 HydrophobicContact CE2-CE 3.65Å; F616-M619 WeakPolarHBondContact O-CB 3.21Å; F616-F620 HydrophobicContact CD1-CE2 4.22Å; F616-F620 HydrophobicContact CD2-CE2 4.45Å; F616-F620 AromaticContact CE1-CE2 3.7Å; F616-F620 HydrophobicContact CE1-CE2 3.7Å; F616-F620 AromaticContact CE2-CE2 3.96Å; F616-F620 HydrophobicContact CE2-CE2 3.96Å; F616-F620 AromaticContact CZ-CE2 3.56Å; F616-F620 HydrophobicContact CZ-CE2 3.56Å; F616-F620 HydrophobicContact CZ-CZ 4.14Å; F616-F620 VanDerWaalsContact O-CD2 3.29Å; F616-F620 WeakPolarHBondContact O-CD2 3.23Å
617	I	87.7	Confident	79.7	Confident	92 Å²	92	72.6 Å²	72.6	47%	0.472	39%	0.387	S	S	.	.	H	α-helix	trans	-66.6	-47.6	174.1	-67.2	166.6	0	0	0	110.6	L613 I614 M619 F620 L621	L613-I617 HydrophobicContact CG-CD1 4.11Å; L613-I617 WeakPolarHBondContact O-CG1 3.4Å; L613-I617 PolarHBondContact O-N 3.15Å; I614-I617 PolarHBondContact O-N 3.48Å; I617-M619 PolarHBondContact O-N 2.92Å; I617-F620 PolarHBondContact O-N 3.49Å; I617-L621 PolarHBondContact O-N 3.48Å; I617-L621 VanDerWaalsContact O-N 3.08Å
618	N	85.9	Confident	79.3	Confident	24 Å²	24	68.2 Å²	68.2	13%	0.128	38%	0.376	C	S	.	.	H	α-helix	trans	-63	-29.9	-179.9	-74.6	-3.8	0	0	0	112.4	I614 F620 L621 F622 N623	I614-N618 VanDerWaalsContact O-CB 3.26Å; I614-N618 WeakPolarHBondContact O-CB 3.5Å; I614-N618 VanDerWaalsContact O-CG 3.25Å; I614-N618 PolarHBondContact O-N 3.21Å; N618-F620 VanDerWaalsContact C-N 3.33Å; N618-F620 PolarHBondContact O-N 3.27Å; N618-L621 PolarHBondContact O-N 3.48Å; N618-F622 PolarHBondContact O-N 3.09Å; N618-N623 VanDerWaalsContact CB-O 3.31Å; N618-N623 WeakPolarHBondContact CB-O 3.39Å; N618-N623 PolarHBondContact O-N 3.35Å
619	M	86.2	Confident	79.1	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-57.9	-42.7	171.9	-179.8	-176.8	79.1	0	0	111.8	L586 Y589 H615 F616 I617 Q640 V644	L586-M619 HydrophobicContact CD2-CE 4.02Å; Y589-M619 HydrophobicContact CD1-SD 3.81Å; Y589-M619 HydrophobicContact CE1-SD 3.95Å; H615-M619 WeakPolarHBondContact O-CB 3.2Å; H615-M619 PolarHBondContact O-N 3Å; F616-M619 HydrophobicContact CD2-CE 3.75Å; F616-M619 HydrophobicContact CE2-CE 3.65Å; F616-M619 WeakPolarHBondContact O-CB 3.21Å; I617-M619 PolarHBondContact O-N 2.92Å; M619-Q640 HydrophobicContact CG-CB 4.2Å; M619-Q640 HydrophobicContact CG-CG 4.4Å; M619-V644 HydrophobicContact CG-CG2 3.52Å; M619-V644 HydrophobicContact SD-CG2 4.29Å
620	F	85.4	Confident	78.9	Confident	92 Å²	92	63.5 Å²	63.5	40%	0.404	36%	0.356	S	S	.	.	H	α-helix	trans	-79.3	-31.1	177.8	-71.1	-74.2	0	0	0	113.6	L586 F616 I617 N618 F622	L586-F620 HydrophobicContact CD1-CE1 4.06Å; L586-F620 HydrophobicContact CD1-CZ 4.05Å; L586-F620 HydrophobicContact CD2-CE1 3.66Å; L586-F620 HydrophobicContact CD2-CZ 3.71Å; L586-F620 HydrophobicContact CG-CE1 4.47Å; L586-F620 HydrophobicContact CG-CZ 4.32Å; F616-F620 HydrophobicContact CD1-CE2 4.22Å; F616-F620 HydrophobicContact CD2-CE2 4.45Å; F616-F620 AromaticContact CE1-CE2 3.7Å; F616-F620 HydrophobicContact CE1-CE2 3.7Å; F616-F620 AromaticContact CE2-CE2 3.96Å; F616-F620 HydrophobicContact CE2-CE2 3.96Å; F616-F620 AromaticContact CZ-CE2 3.56Å; F616-F620 HydrophobicContact CZ-CE2 3.56Å; F616-F620 HydrophobicContact CZ-CZ 4.14Å; F616-F620 VanDerWaalsContact O-CD2 3.29Å; F616-F620 WeakPolarHBondContact O-CD2 3.23Å; I617-F620 PolarHBondContact O-N 3.49Å; N618-F620 VanDerWaalsContact C-N 3.33Å; N618-F620 PolarHBondContact O-N 3.27Å; F620-F622 VanDerWaalsContact C-N 3.32Å
621	L	85.6	Confident	78.6	Confident	117 Å²	117	67.9 Å²	67.9	61%	0.613	39%	0.385	S	S	*	.	H	α-helix	trans	-83.7	-6.8	-178.5	-161.4	66.2	0	0	0	113.2	I617 N618 N623	I617-L621 PolarHBondContact O-N 3.48Å; I617-L621 VanDerWaalsContact O-N 3.08Å; N618-L621 PolarHBondContact O-N 3.48Å; L621-N623 HydrophobicContact CB-CB 4.39Å; L621-N623 HydrophobicContact CD2-CB 4.19Å; L621-N623 HydrophobicContact CG-CB 4.32Å; L621-N623 PolarHBondContact O-N 3.23Å
622	F	82	Confident	78.2	Confident	109 Å²	109	66.4 Å²	66.4	48%	0.478	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	31	-171.8	-62.7	-74.8	0	0	0	113.7	N618 F620 Y624 V644	N618-F622 PolarHBondContact O-N 3.09Å; F620-F622 VanDerWaalsContact C-N 3.32Å; F622-Y624 HydrophobicContact CB-CE2 4.37Å; F622-Y624 HydrophobicContact CD1-CE2 4.28Å; F622-V644 HydrophobicContact CE1-CB 4.2Å; F622-V644 HydrophobicContact CE1-CG1 4.09Å; F622-V644 HydrophobicContact CE2-CG1 4.13Å; F622-V644 HydrophobicContact CZ-CB 4.03Å; F622-V644 HydrophobicContact CZ-CG1 3.44Å; F622-V644 VanDerWaalsContact CZ-CG1 3.44Å
623	N	80.4	Confident	78	Confident	65 Å²	65	68 Å²	68	35%	0.348	38%	0.378	S	S	.	.			trans	-104.3	99.9	-179.3	-173.2	5.1	0	0	0	110.5	N618 L621 S625	N618-N623 VanDerWaalsContact CB-O 3.31Å; N618-N623 WeakPolarHBondContact CB-O 3.39Å; N618-N623 PolarHBondContact O-N 3.35Å; L621-N623 HydrophobicContact CB-CB 4.39Å; L621-N623 HydrophobicContact CD2-CB 4.19Å; L621-N623 HydrophobicContact CG-CB 4.32Å; L621-N623 PolarHBondContact O-N 3.23Å; N623-S625 PolarHBondContact OD1-OG 3.28Å; N623-S625 VanDerWaalsContact OD1-OG 3.09Å
624	Y	73	Confident	77.8	Confident	66 Å²	66	71.4 Å²	71.4	26%	0.259	39%	0.388	S	S	.	.			trans	-107.3	5.7	-175.3	-57.1	-72.6	0	0	0	114	F622 D626 Q637 Q640	F622-Y624 HydrophobicContact CB-CE2 4.37Å; F622-Y624 HydrophobicContact CD1-CE2 4.28Å; Y624-D626 VanDerWaalsContact C-N 3.35Å; Y624-D626 PolarHBondContact O-N 3.02Å; Y624-Q637 HydrophobicContact CD1-CG 4.13Å; Y624-Q637 HydrophobicContact CD2-CG 3.81Å; Y624-Q637 HydrophobicContact CE1-CG 4.31Å; Y624-Q637 HydrophobicContact CE2-CG 3.97Å; Y624-Q637 HydrophobicContact CG-CG 3.88Å; Y624-Q640 HydrophobicContact CE1-CB 4.41Å
625	S	62.2	Low	77.7	Confident	105 Å²	105	74.7 Å²	74.7	73%	0.734	40%	0.402	S	S	*	.			trans	-91.8	18.7	-169.7	59.8	0	0	0	0	114.9	N623 S627	N623-S625 PolarHBondContact OD1-OG 3.28Å; N623-S625 VanDerWaalsContact OD1-OG 3.09Å; S625-S627 PolarHBondContact O-N 2.83Å
626	D	65	Low	77.6	Confident	69 Å²	69	74.4 Å²	74.4	37%	0.369	40%	0.4	S	S	.	.			trans	-86.8	103.5	-174	-159.1	-2.9	0	0	0	111.2	Y624 S628 N629	Y624-D626 VanDerWaalsContact C-N 3.35Å; Y624-D626 PolarHBondContact O-N 3.02Å; D626-S628 VanDerWaalsContact CG-OG 3.3Å; D626-S628 PolarHBondContact O-N 3.25Å; D626-S628 VanDerWaalsContact O-N 3.12Å; D626-S628 PolarHBondContact OD1-OG 2.67Å; D626-S628 PolarHBondContact OD2-OG 3.01Å; D626-N629 PolarHBondContact O-N 2.94Å; D626-N629 PolarHBondContact OD2-ND2 3.37Å
627	S	61.8	Low	77.5	Confident	130 Å²	130	78.2 Å²	78.2	91%	0.909	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.2	-176.4	58.3	0	0	0	0	114.3	S625	S625-S627 PolarHBondContact O-N 2.83Å
628	S	62.5	Low	77.5	Confident	87 Å²	87	80 Å²	80	61%	0.608	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-18	179.6	65.4	0	0	0	0	113.6	D626	D626-S628 VanDerWaalsContact CG-OG 3.3Å; D626-S628 PolarHBondContact O-N 3.25Å; D626-S628 VanDerWaalsContact O-N 3.12Å; D626-S628 PolarHBondContact OD1-OG 2.67Å; D626-S628 PolarHBondContact OD2-OG 3.01Å
629	N	68.4	Low	77.6	Confident	32 Å²	32	81 Å²	81	17%	0.171	43%	0.432	C	S	.	.	S	Bend	trans	-117.1	110.1	-172.9	-83	-56.9	0	0	0	111.2	D626	D626-N629 PolarHBondContact O-N 2.94Å; D626-N629 PolarHBondContact OD2-ND2 3.37Å
630	A	73.1	Confident	77.7	Confident	44 Å²	44	81.2 Å²	81.2	36%	0.364	43%	0.433	S	S	.	.			trans	-70.8	141.8	176.2	0	0	0	0	0	111.6	P610	P610-A630 WeakPolarHBondContact CB-O 3.45Å
631	P	76.1	Confident	77.9	Confident	98 Å²	98	78.8 Å²	78.8	64%	0.636	43%	0.427	S	S	*	.			trans	-65.7	141.2	175.4	27.1	-33.5	0	0	0	111.4
632	L	76.9	Confident	78.2	Confident	16 Å²	16	79 Å²	79	8%	0.084	42%	0.423	C	S	.	.	S	Bend	trans	-64.2	-43.4	176.9	-98.7	75.6	0	0	0	112.1	M593 F596 F601 P610	M593-L632 HydrophobicContact CB-CD2 4.29Å; M593-L632 HydrophobicContact CG-CD2 4.37Å; F596-L632 HydrophobicContact CD1-CB 4.27Å; F596-L632 HydrophobicContact CD1-CD2 3.77Å; F596-L632 HydrophobicContact CD1-CG 4.2Å; F596-L632 HydrophobicContact CE1-CB 4.11Å; F596-L632 HydrophobicContact CE1-CD2 4.44Å; F596-L632 HydrophobicContact CE1-CG 4.43Å; F596-L632 WeakPolarHBondContact CE1-O 3.35Å; F601-L632 HydrophobicContact CE2-CG 4.41Å; P610-L632 HydrophobicContact CB-CD1 4.14Å; P610-L632 HydrophobicContact CG-CD1 3.37Å; P610-L632 HydrophobicContact CG-CG 4.27Å
633	Y	82	Confident	78.6	Confident	51 Å²	51	76.3 Å²	76.3	20%	0.2	41%	0.412	C	S	.	.	S	Bend	trans	-148.8	162	-175.6	64	-89.4	0	0	0	111.7	Y589 F592 H635 Q636 V639	Y589-Y633 PolarHBondContact OH-OH 3.06Å; F592-Y633 HydrophobicContact CE1-CE1 4.35Å; Y633-H635 PolarHBondContact O-N 3.28Å; Y633-Q636 HydrophobicContact CD1-CB 4.38Å; Y633-Q636 HydrophobicContact CD2-CB 4.39Å; Y633-Q636 HydrophobicContact CE1-CB 4.09Å; Y633-Q636 HydrophobicContact CE1-CG 3.94Å; Y633-Q636 HydrophobicContact CE2-CB 4.1Å; Y633-Q636 WeakPolarHBondContact O-CB 3.39Å; Y633-Q636 PolarHBondContact O-N 3.47Å; Y633-V639 HydrophobicContact CE2-CG2 4.15Å; Y633-V639 VanDerWaalsContact OH-CB 3.29Å; Y633-V639 WeakPolarHBondContact OH-CB 3.49Å; Y633-V639 VanDerWaalsContact OH-CG1 3.3Å; Y633-V639 WeakPolarHBondContact OH-CG1 3.44Å
634	K	80.5	Confident	79.1	Confident	189 Å²	189	73.8 Å²	73.8	82%	0.822	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	131.8	-179.9	-62.2	-178.8	179.9	179.7	0	110.2
635	H	84.3	Confident	79.9	Confident	131 Å²	131	74.2 Å²	74.2	61%	0.606	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	27.3	-177.3	-47.6	89.9	0	0	0	116	Y633 Q637 E638 V639	Y633-H635 PolarHBondContact O-N 3.28Å; H635-Q637 VanDerWaalsContact C-N 3.3Å; H635-Q637 PolarHBondContact O-N 3.28Å; H635-E638 IonicContact CD2-OE1 2.76Å; H635-E638 IonicContact CD2-OE2 3.94Å; H635-E638 PolarHBondContact O-N 2.8Å; H635-V639 PolarHBondContact O-N 2.91Å
636	Q	84.3	Confident	81.3	Confident	10 Å²	10	72 Å²	72	5%	0.047	39%	0.387	C	S	.	.	H	α-helix	trans	-57.7	-37.2	177.4	178.9	175.3	-6.5	0	0	114.1	H615 Y633 E638 V639 Q640	H615-Q636 PolarHBondContact CD2-NE2 3.3Å; H615-Q636 VanDerWaalsContact CD2-NE2 3.29Å; Y633-Q636 HydrophobicContact CD1-CB 4.38Å; Y633-Q636 HydrophobicContact CD2-CB 4.39Å; Y633-Q636 HydrophobicContact CE1-CB 4.09Å; Y633-Q636 HydrophobicContact CE1-CG 3.94Å; Y633-Q636 HydrophobicContact CE2-CB 4.1Å; Y633-Q636 WeakPolarHBondContact O-CB 3.39Å; Y633-Q636 PolarHBondContact O-N 3.47Å; Q636-E638 PolarHBondContact O-N 3.12Å; Q636-V639 PolarHBondContact O-N 3.32Å; Q636-Q640 HydrophobicContact CG-CG 4.13Å; Q636-Q640 WeakPolarHBondContact O-CB 3.25Å; Q636-Q640 VanDerWaalsContact O-CG 3.31Å; Q636-Q640 WeakPolarHBondContact O-CG 3.48Å; Q636-Q640 PolarHBondContact O-N 2.95Å
637	Q	84.2	Confident	82.4	Confident	116 Å²	116	68.9 Å²	68.9	54%	0.542	37%	0.371	S	S	.	.	H	α-helix	trans	-62.8	-41	-178.1	-176.3	179.1	-2.3	0	0	112.5	Y624 H635 S641	Y624-Q637 HydrophobicContact CD1-CG 4.13Å; Y624-Q637 HydrophobicContact CD2-CG 3.81Å; Y624-Q637 HydrophobicContact CE1-CG 4.31Å; Y624-Q637 HydrophobicContact CE2-CG 3.97Å; Y624-Q637 HydrophobicContact CG-CG 3.88Å; H635-Q637 VanDerWaalsContact C-N 3.3Å; H635-Q637 PolarHBondContact O-N 3.28Å; Q637-S641 WeakPolarHBondContact O-CB 3.45Å; Q637-S641 PolarHBondContact O-N 2.97Å; Q637-S641 PolarHBondContact O-OG 3.27Å
638	E	87.2	Confident	83.8	Confident	128 Å²	128	68.7 Å²	68.7	60%	0.598	36%	0.359	S	S	*	.	H	α-helix	trans	-66.6	-42.4	179.6	-65.4	177.6	-175.7	0	0	111.1	H635 Q636 S641 F642	H635-E638 IonicContact CD2-OE1 2.76Å; H635-E638 IonicContact CD2-OE2 3.94Å; H635-E638 PolarHBondContact O-N 2.8Å; Q636-E638 PolarHBondContact O-N 3.12Å; E638-S641 PolarHBondContact O-OG 3.43Å; E638-F642 WeakPolarHBondContact O-CB 3.31Å; E638-F642 PolarHBondContact O-N 3.32Å
639	V	89.1	Confident	85.1	Confident	47 Å²	47	68.7 Å²	68.7	29%	0.285	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-43.1	178.3	177.7	0	0	0	0	111.4	Y633 H635 Q636 F642 F643	Y633-V639 HydrophobicContact CE2-CG2 4.15Å; Y633-V639 VanDerWaalsContact OH-CB 3.29Å; Y633-V639 WeakPolarHBondContact OH-CB 3.49Å; Y633-V639 VanDerWaalsContact OH-CG1 3.3Å; Y633-V639 WeakPolarHBondContact OH-CG1 3.44Å; H635-V639 PolarHBondContact O-N 2.91Å; Q636-V639 PolarHBondContact O-N 3.32Å; V639-F642 PolarHBondContact O-N 3.16Å; V639-F643 HydrophobicContact CG1-CD2 3.8Å; V639-F643 HydrophobicContact CG1-CE2 3.38Å; V639-F643 HydrophobicContact CG1-CZ 4.02Å; V639-F643 WeakPolarHBondContact O-CD2 3.41Å; V639-F643 PolarHBondContact O-N 3.47Å
640	Q	88.4	Confident	86	Confident	3 Å²	3	67.4 Å²	67.4	1%	0.014	35%	0.345	C	S	.	.	H	α-helix	trans	-64.2	-46.5	179.2	-76	-171	-14.6	0	0	112.3	Y589 M619 Y624 Q636 F642 F643 V644	Y589-Q640 HydrophobicContact CE1-CG 3.65Å; Y589-Q640 WeakPolarHBondContact OH-CG 3.07Å; Y589-Q640 PolarHBondContact OH-NE2 3.25Å; M619-Q640 HydrophobicContact CG-CB 4.2Å; M619-Q640 HydrophobicContact CG-CG 4.4Å; Y624-Q640 HydrophobicContact CE1-CB 4.41Å; Q636-Q640 HydrophobicContact CG-CG 4.13Å; Q636-Q640 WeakPolarHBondContact O-CB 3.25Å; Q636-Q640 VanDerWaalsContact O-CG 3.31Å; Q636-Q640 WeakPolarHBondContact O-CG 3.48Å; Q636-Q640 PolarHBondContact O-N 2.95Å; Q640-F642 VanDerWaalsContact C-N 3.34Å; Q640-F642 PolarHBondContact O-N 3.12Å; Q640-F643 PolarHBondContact O-N 3.42Å; Q640-V644 WeakPolarHBondContact O-CG2 3.41Å; Q640-V644 PolarHBondContact O-N 3.34Å; Q640-V644 VanDerWaalsContact O-N 3.14Å
641	S	88.3	Confident	86.8	Confident	41 Å²	41	67.7 Å²	67.7	29%	0.287	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-41	176.4	53.9	0	0	0	0	111.7	Q637 E638 V644 V645	Q637-S641 WeakPolarHBondContact O-CB 3.45Å; Q637-S641 PolarHBondContact O-N 2.97Å; Q637-S641 PolarHBondContact O-OG 3.27Å; E638-S641 PolarHBondContact O-OG 3.43Å; S641-V644 PolarHBondContact O-N 2.9Å; S641-V645 VanDerWaalsContact O-CG2 3.27Å; S641-V645 WeakPolarHBondContact O-CG2 3.47Å; S641-V645 PolarHBondContact O-N 3.26Å
642	F	91.5	Very high	87.4	Confident	121 Å²	121	66 Å²	66	53%	0.531	33%	0.331	S	S	.	.	H	α-helix	trans	-59.1	-47.6	175	177.2	-100.6	0	0	0	112.9	E638 V639 Q640 V644 V645 M646	E638-F642 WeakPolarHBondContact O-CB 3.31Å; E638-F642 PolarHBondContact O-N 3.32Å; V639-F642 PolarHBondContact O-N 3.16Å; Q640-F642 VanDerWaalsContact C-N 3.34Å; Q640-F642 PolarHBondContact O-N 3.12Å; F642-V644 PolarHBondContact O-N 2.99Å; F642-V645 PolarHBondContact O-N 3.27Å; F642-M646 HydrophobicContact CD1-CG 4.35Å; F642-M646 HydrophobicContact CD2-CG 4.43Å; F642-M646 HydrophobicContact CE1-CG 3.9Å; F642-M646 HydrophobicContact CE2-CG 3.98Å; F642-M646 HydrophobicContact CE2-SD 4.4Å; F642-M646 HydrophobicContact CZ-CG 3.69Å; F642-M646 HydrophobicContact CZ-SD 4.22Å; F642-M646 WeakPolarHBondContact O-CB 3.4Å; F642-M646 WeakPolarHBondContact O-CG 3.35Å; F642-M646 PolarHBondContact O-N 2.86Å
643	F	91.4	Very high	87.9	Confident	53 Å²	53	69.3 Å²	69.3	23%	0.232	34%	0.343	C	S	.	.	H	α-helix	trans	-65.4	-37.9	-179.7	-73.4	-35.4	0	0	0	113.4	C585 Y589 V639 Q640 M646 A647	C585-F643 HydrophobicContact CB-CB 4.1Å; C585-F643 HydrophobicContact CB-CD1 4.18Å; C585-F643 HydrophobicContact CB-CG 4.36Å; Y589-F643 HydrophobicContact CD1-CD2 4.12Å; Y589-F643 AromaticContact CD2-CD2 4Å; Y589-F643 HydrophobicContact CD2-CD2 4Å; Y589-F643 AromaticContact CD2-CE2 3.65Å; Y589-F643 HydrophobicContact CD2-CE2 3.65Å; Y589-F643 HydrophobicContact CE2-CE2 4.19Å; Y589-F643 AromaticContact CG-CD2 3.82Å; Y589-F643 HydrophobicContact CG-CD2 3.82Å; Y589-F643 AromaticContact CG-CE2 3.91Å; Y589-F643 HydrophobicContact CG-CE2 3.91Å; V639-F643 HydrophobicContact CG1-CD2 3.8Å; V639-F643 HydrophobicContact CG1-CE2 3.38Å; V639-F643 HydrophobicContact CG1-CZ 4.02Å; V639-F643 WeakPolarHBondContact O-CD2 3.41Å; V639-F643 PolarHBondContact O-N 3.47Å; Q640-F643 PolarHBondContact O-N 3.42Å; F643-M646 PolarHBondContact O-N 2.97Å; F643-A647 WeakPolarHBondContact O-CB 3.31Å; F643-A647 PolarHBondContact O-N 3.14Å
644	V	89.8	Confident	88	Confident	13 Å²	13	67.1 Å²	67.1	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-67.9	-41.5	176.8	177.9	0	0	0	0	111.1	M619 F622 Q640 S641 F642 A647 L648	M619-V644 HydrophobicContact CG-CG2 3.52Å; M619-V644 HydrophobicContact SD-CG2 4.29Å; F622-V644 HydrophobicContact CE1-CB 4.2Å; F622-V644 HydrophobicContact CE1-CG1 4.09Å; F622-V644 HydrophobicContact CE2-CG1 4.13Å; F622-V644 HydrophobicContact CZ-CB 4.03Å; F622-V644 HydrophobicContact CZ-CG1 3.44Å; F622-V644 VanDerWaalsContact CZ-CG1 3.44Å; Q640-V644 WeakPolarHBondContact O-CG2 3.41Å; Q640-V644 PolarHBondContact O-N 3.34Å; Q640-V644 VanDerWaalsContact O-N 3.14Å; S641-V644 PolarHBondContact O-N 2.9Å; F642-V644 PolarHBondContact O-N 2.99Å; V644-A647 PolarHBondContact O-N 3.28Å; V644-L648 WeakPolarHBondContact O-CB 3.43Å; V644-L648 PolarHBondContact O-N 2.92Å
645	V	91.3	Very high	88.2	Confident	75 Å²	75	60 Å²	60	46%	0.455	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-43.5	176.1	171.8	0	0	0	0	110.9	S641 F642 A647 L648 I649	S641-V645 VanDerWaalsContact O-CG2 3.27Å; S641-V645 WeakPolarHBondContact O-CG2 3.47Å; S641-V645 PolarHBondContact O-N 3.26Å; F642-V645 PolarHBondContact O-N 3.27Å; V645-A647 PolarHBondContact O-N 2.97Å; V645-L648 PolarHBondContact O-N 3.32Å; V645-I649 HydrophobicContact CG1-CD1 3.85Å; V645-I649 WeakPolarHBondContact O-CG1 3.48Å; V645-I649 PolarHBondContact O-N 3.38Å
646	M	91.1	Very high	88	Confident	57 Å²	57	57.5 Å²	57.5	28%	0.281	30%	0.295	S	S	.	.	H	α-helix	trans	-61.8	-41.6	175.4	-76.4	-61.6	-62.2	0	0	112.7	I581 F642 F643 L648 I649 S650	I581-M646 HydrophobicContact CG2-CE 4.21Å; F642-M646 HydrophobicContact CD1-CG 4.35Å; F642-M646 HydrophobicContact CD2-CG 4.43Å; F642-M646 HydrophobicContact CE1-CG 3.9Å; F642-M646 HydrophobicContact CE2-CG 3.98Å; F642-M646 HydrophobicContact CE2-SD 4.4Å; F642-M646 HydrophobicContact CZ-CG 3.69Å; F642-M646 HydrophobicContact CZ-SD 4.22Å; F642-M646 WeakPolarHBondContact O-CB 3.4Å; F642-M646 WeakPolarHBondContact O-CG 3.35Å; F642-M646 PolarHBondContact O-N 2.86Å; F643-M646 PolarHBondContact O-N 2.97Å; M646-L648 VanDerWaalsContact C-N 3.32Å; M646-L648 PolarHBondContact O-N 3.36Å; M646-I649 PolarHBondContact O-N 2.91Å; M646-S650 PolarHBondContact O-N 2.87Å
647	A	89.1	Confident	87.7	Confident	5 Å²	5	60 Å²	60	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-67.3	-31.4	175.5	0	0	0	0	0	112.6	F582 C585 L586 F643 V644 V645 S650	F582-A647 HydrophobicContact CD2-CB 4.14Å; F582-A647 HydrophobicContact CE2-CB 4.49Å; C585-A647 HydrophobicContact CB-CB 4.47Å; L586-A647 HydrophobicContact CD1-CB 4.24Å; L586-A647 HydrophobicContact CD2-CB 3.94Å; L586-A647 HydrophobicContact CG-CB 3.96Å; F643-A647 WeakPolarHBondContact O-CB 3.31Å; F643-A647 PolarHBondContact O-N 3.14Å; V644-A647 PolarHBondContact O-N 3.28Å; V645-A647 PolarHBondContact O-N 2.97Å; A647-S650 PolarHBondContact O-OG 2.86Å
648	L	89.7	Confident	87.4	Confident	125 Å²	125	56 Å²	56	65%	0.654	29%	0.29	S	S	*	.	H	α-helix	trans	-74.1	-35.6	176.5	-166.6	123.1	0	0	0	111.9	V644 V645 M646 S650 P652	V644-L648 WeakPolarHBondContact O-CB 3.43Å; V644-L648 PolarHBondContact O-N 2.92Å; V645-L648 PolarHBondContact O-N 3.32Å; M646-L648 VanDerWaalsContact C-N 3.32Å; M646-L648 PolarHBondContact O-N 3.36Å; L648-S650 VanDerWaalsContact C-N 3.35Å; L648-P652 WeakPolarHBondContact O-CD 3.36Å
649	I	90.9	Very high	87	Confident	87 Å²	87	50 Å²	50	45%	0.446	26%	0.261	S	S	.	.	H	α-helix	trans	-69.1	-32	176.7	-69.7	167.4	0	0	0	111.9	V645 M646 V651 P652 W653	V645-I649 HydrophobicContact CG1-CD1 3.85Å; V645-I649 WeakPolarHBondContact O-CG1 3.48Å; V645-I649 PolarHBondContact O-N 3.38Å; M646-I649 PolarHBondContact O-N 2.91Å; I649-V651 VanDerWaalsContact C-N 3.26Å; I649-V651 PolarHBondContact O-N 3.46Å; I649-P652 WeakPolarHBondContact O-CD 3.31Å; I649-W653 PolarHBondContact O-N 3.46Å
650	S	87.4	Confident	86.6	Confident	5 Å²	5	52.9 Å²	52.9	4%	0.035	27%	0.27	C	S	.	.	H	α-helix	trans	-67	-25.7	-179.3	68.7	0	0	0	0	113.2	M646 A647 L648 W653 M654	M646-S650 PolarHBondContact O-N 2.87Å; A647-S650 PolarHBondContact O-OG 2.86Å; L648-S650 VanDerWaalsContact C-N 3.35Å; S650-W653 WeakPolarHBondContact O-CB 3.41Å; S650-W653 PolarHBondContact O-N 2.97Å; S650-M654 PolarHBondContact O-N 3.35Å; S650-M654 VanDerWaalsContact O-N 3.1Å
651	V	88.5	Confident	86.2	Confident	50 Å²	50	55.4 Å²	55.4	30%	0.303	28%	0.283	S	S	.	.	H	α-helix	trans	-68.3	-54.6	179.5	177.5	0	0	0	0	112.1	F582 I649 W653 M654 L655 T725	F582-V651 HydrophobicContact CD2-CG2 4.44Å; F582-V651 HydrophobicContact CE2-CG2 4.28Å; I649-V651 VanDerWaalsContact C-N 3.26Å; I649-V651 PolarHBondContact O-N 3.46Å; V651-W653 VanDerWaalsContact C-N 3.26Å; V651-W653 PolarHBondContact O-N 3.01Å; V651-M654 PolarHBondContact O-N 3.01Å; V651-L655 PolarHBondContact O-N 2.98Å; V651-L655 VanDerWaalsContact O-N 3.17Å; V651-T725 HydrophobicContact CG1-CG2 4.24Å
652	P	88.6	Confident	85.7	Confident	64 Å²	64	56.1 Å²	56.1	42%	0.416	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-33.2	172.3	-25	34.4	0	0	0	113.7	L648 I649 L655 L656	L648-P652 WeakPolarHBondContact O-CD 3.36Å; I649-P652 WeakPolarHBondContact O-CD 3.31Å; P652-L655 PolarHBondContact O-N 3.35Å; P652-L656 HydrophobicContact CB-CD1 4.5Å; P652-L656 WeakPolarHBondContact O-CB 3.41Å; P652-L656 PolarHBondContact O-N 2.84Å
653	W	88.6	Confident	85.1	Confident	85 Å²	85	56.7 Å²	56.7	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-57.6	-50.3	176.6	-170.8	-35.2	0	0	0	110.6	P578 I649 S650 V651 I657	P578-W653 HydrophobicContact CG-CB 4.34Å; P578-W653 HydrophobicContact CG-CD2 4.1Å; P578-W653 HydrophobicContact CG-CG 3.81Å; I649-W653 PolarHBondContact O-N 3.46Å; S650-W653 WeakPolarHBondContact O-CB 3.41Å; S650-W653 PolarHBondContact O-N 2.97Å; V651-W653 VanDerWaalsContact C-N 3.26Å; V651-W653 PolarHBondContact O-N 3.01Å; W653-I657 HydrophobicContact CB-CD1 4.25Å; W653-I657 VanDerWaalsContact CD1-CD1 3.44Å; W653-I657 HydrophobicContact CD2-CD1 4.41Å; W653-I657 HydrophobicContact CG-CD1 3.75Å; W653-I657 WeakPolarHBondContact O-CB 3.46Å; W653-I657 VanDerWaalsContact O-CG1 3.29Å; W653-I657 WeakPolarHBondContact O-CG1 3.49Å; W653-I657 PolarHBondContact O-N 3.39Å
654	M	83.4	Confident	84.6	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.02	30%	0.295	C	S	.	.	H	α-helix	trans	-69.5	-36.7	-178.2	-175.4	168.7	53.7	0	0	113	P578 E579 S650 V651 Q721 T725 Y728	P578-M654 HydrophobicContact CB-CB 4.27Å; E579-M654 HydrophobicContact CG-SD 3.95Å; S650-M654 PolarHBondContact O-N 3.35Å; S650-M654 VanDerWaalsContact O-N 3.1Å; V651-M654 PolarHBondContact O-N 3.01Å; M654-Q721 PolarHBondContact O-NE2 3.39Å; M654-Q721 VanDerWaalsContact O-NE2 3.08Å; M654-T725 HydrophobicContact CE-CG2 3.45Å; M654-T725 VanDerWaalsContact CE-CG2 3.45Å; M654-Y728 HydrophobicContact CE-CD1 4.25Å
655	L	84.3	Confident	84.1	Confident	40 Å²	40	63.2 Å²	63.2	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-76.7	-49	-174.8	-168.7	153.6	0	0	0	112.5	V651 P652 P659 F718 T725	V651-L655 PolarHBondContact O-N 2.98Å; V651-L655 VanDerWaalsContact O-N 3.17Å; P652-L655 PolarHBondContact O-N 3.35Å; L655-P659 VanDerWaalsContact O-CD 3.28Å; L655-P659 WeakPolarHBondContact O-CD 3.37Å; L655-F718 HydrophobicContact CD2-CE2 3.83Å; L655-F718 HydrophobicContact CD2-CZ 3.93Å; L655-T725 HydrophobicContact CB-CG2 4.1Å; L655-T725 HydrophobicContact CD1-CG2 4.31Å
656	L	80.6	Confident	83.5	Confident	78 Å²	78	62.7 Å²	62.7	41%	0.408	31%	0.309	S	S	.	.	H	α-helix	trans	-91	-35.8	-168.4	-64.9	172	0	0	0	112.9	P652 K658 F660 F718	P652-L656 HydrophobicContact CB-CD1 4.5Å; P652-L656 WeakPolarHBondContact O-CB 3.41Å; P652-L656 PolarHBondContact O-N 2.84Å; L656-K658 PolarHBondContact O-N 3.01Å; L656-F660 HydrophobicContact CD2-CE2 4.2Å; L656-F660 WeakPolarHBondContact O-CD2 3.38Å; L656-F660 PolarHBondContact O-N 2.98Å; L656-F718 HydrophobicContact CD2-CE2 4.33Å
657	I	77.8	Confident	82.9	Confident	63 Å²	63	68.4 Å²	68.4	32%	0.323	33%	0.328	S	S	.	.	H	α-helix	trans	-73	-37.1	-164.5	-56.7	-173.7	0	0	0	111.8	L574 W653 I661	L574-I657 HydrophobicContact CD1-CG2 4.37Å; L574-I657 HydrophobicContact CD2-CB 3.95Å; L574-I657 HydrophobicContact CD2-CG2 3.33Å; L574-I657 HydrophobicContact CG-CG2 4.46Å; W653-I657 HydrophobicContact CB-CD1 4.25Å; W653-I657 VanDerWaalsContact CD1-CD1 3.44Å; W653-I657 HydrophobicContact CD2-CD1 4.41Å; W653-I657 HydrophobicContact CG-CD1 3.75Å; W653-I657 WeakPolarHBondContact O-CB 3.46Å; W653-I657 VanDerWaalsContact O-CG1 3.29Å; W653-I657 WeakPolarHBondContact O-CG1 3.49Å; W653-I657 PolarHBondContact O-N 3.39Å; I657-I661 HydrophobicContact CG2-CD1 3.51Å; I657-I661 HydrophobicContact CG2-CG1 4.22Å; I657-I661 WeakPolarHBondContact O-CB 3.48Å; I657-I661 VanDerWaalsContact O-CG1 3.25Å; I657-I661 WeakPolarHBondContact O-CG1 3.34Å; I657-I661 PolarHBondContact O-N 3.11Å
658	K	78.1	Confident	82.5	Confident	33 Å²	33	74.8 Å²	74.8	14%	0.143	36%	0.355	C	S	.	.	H	α-helix	trans	-67.8	-52	-177.1	-178.8	175.7	169.6	-161.5	0	113.6	L574 L656 F660 I661 L662	L574-K658 HydrophobicContact CB-CB 4.29Å; L574-K658 HydrophobicContact CD1-CB 3.92Å; L574-K658 HydrophobicContact CD1-CG 4.37Å; L656-K658 PolarHBondContact O-N 3.01Å; K658-F660 VanDerWaalsContact C-N 3.33Å; K658-F660 PolarHBondContact O-N 3.46Å; K658-I661 PolarHBondContact O-N 3.36Å; K658-L662 HydrophobicContact CG-CD1 4.05Å; K658-L662 PolarHBondContact O-N 3.04Å; K658-L662 VanDerWaalsContact O-N 3.07Å
659	P	80.1	Confident	81.8	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-38.9	178.4	-23.2	34.9	0	0	0	112.8	L655 L662 R663 F714 F718 Q721	L655-P659 VanDerWaalsContact O-CD 3.28Å; L655-P659 WeakPolarHBondContact O-CD 3.37Å; P659-L662 PolarHBondContact O-N 3.31Å; P659-R663 WeakPolarHBondContact O-CB 3.45Å; P659-R663 PolarHBondContact O-N 3.1Å; P659-F714 HydrophobicContact CB-CE2 3.91Å; P659-F714 HydrophobicContact CB-CZ 4.36Å; P659-F718 HydrophobicContact CB-CD2 4.22Å; P659-F718 HydrophobicContact CG-CD2 4.11Å; P659-Q721 HydrophobicContact CG-CB 4.18Å; P659-Q721 HydrophobicContact CG-CG 4.15Å
660	F	79.7	Confident	81.1	Confident	109 Å²	109	73.5 Å²	73.5	48%	0.478	35%	0.351	S	S	.	.	H	α-helix	trans	-69.8	-37.5	-179.5	-83.7	-91.4	0	0	0	112.9	L656 K658 R663 A664	L656-F660 HydrophobicContact CD2-CE2 4.2Å; L656-F660 WeakPolarHBondContact O-CD2 3.38Å; L656-F660 PolarHBondContact O-N 2.98Å; K658-F660 VanDerWaalsContact C-N 3.33Å; K658-F660 PolarHBondContact O-N 3.46Å; F660-R663 PolarHBondContact O-N 3.05Å; F660-A664 WeakPolarHBondContact O-CB 3.47Å; F660-A664 PolarHBondContact O-N 3.46Å
661	I	79.8	Confident	80.5	Confident	56 Å²	56	77.4 Å²	77.4	29%	0.287	37%	0.371	S	S	.	.	H	α-helix	trans	-66.2	-41.5	173.3	-72.3	174.8	0	0	0	111.1	L570 L574 I657 K658 A664 R665	L570-I661 HydrophobicContact CD1-CG2 4.25Å; L570-I661 HydrophobicContact CD2-CG2 3.98Å; L574-I661 HydrophobicContact CD1-CD1 3.84Å; L574-I661 HydrophobicContact CD2-CD1 4.26Å; I657-I661 HydrophobicContact CG2-CD1 3.51Å; I657-I661 HydrophobicContact CG2-CG1 4.22Å; I657-I661 WeakPolarHBondContact O-CB 3.48Å; I657-I661 VanDerWaalsContact O-CG1 3.25Å; I657-I661 WeakPolarHBondContact O-CG1 3.34Å; I657-I661 PolarHBondContact O-N 3.11Å; K658-I661 PolarHBondContact O-N 3.36Å; I661-A664 PolarHBondContact O-N 3.19Å; I661-R665 PolarHBondContact O-N 3.27Å
662	L	78.1	Confident	79.6	Confident	56 Å²	56	80.3 Å²	80.3	29%	0.293	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-45	175.4	-90.1	150	0	0	0	111.5	K658 P659 A664 R665 H666 F712 I717	K658-L662 HydrophobicContact CG-CD1 4.05Å; K658-L662 PolarHBondContact O-N 3.04Å; K658-L662 VanDerWaalsContact O-N 3.07Å; P659-L662 PolarHBondContact O-N 3.31Å; L662-A664 PolarHBondContact O-N 3.06Å; L662-R665 PolarHBondContact O-N 2.92Å; L662-H666 WeakPolarHBondContact O-CB 3.14Å; L662-H666 PolarHBondContact O-N 3.14Å; L662-F712 HydrophobicContact CB-CE2 4.32Å; L662-F712 HydrophobicContact CB-CZ 4.13Å; L662-F712 HydrophobicContact CD2-CE2 4.34Å; L662-I717 HydrophobicContact CD1-CG2 4.37Å
663	R	80.1	Confident	78.7	Confident	133 Å²	133	79.9 Å²	79.9	50%	0.502	38%	0.383	S	S	.	.	H	α-helix	trans	-60.6	-43.1	174.7	-175	178	177	-177.6	0.3	112.5	P659 F660 H666 R667 F714	P659-R663 WeakPolarHBondContact O-CB 3.45Å; P659-R663 PolarHBondContact O-N 3.1Å; F660-R663 PolarHBondContact O-N 3.05Å; R663-H666 PolarHBondContact O-N 3.28Å; R663-R667 WeakPolarHBondContact O-CB 3.26Å; R663-R667 PolarHBondContact O-N 3.06Å; R663-F714 HydrophobicContact CB-CD2 3.85Å; R663-F714 HydrophobicContact CB-CE2 3.84Å; R663-F714 HydrophobicContact CG-CD2 4.16Å; R663-F714 HydrophobicContact CG-CE2 4.31Å
664	A	80.4	Confident	77.6	Confident	61 Å²	61	78.2 Å²	78.2	50%	0.504	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.6	0	0	0	0	0	112	F660 I661 L662 K668	F660-A664 WeakPolarHBondContact O-CB 3.47Å; F660-A664 PolarHBondContact O-N 3.46Å; I661-A664 PolarHBondContact O-N 3.19Å; L662-A664 PolarHBondContact O-N 3.06Å; A664-K668 WeakPolarHBondContact O-CB 3.3Å; A664-K668 PolarHBondContact O-N 3.34Å
665	R	79.2	Confident	76.6	Confident	142 Å²	142	86 Å²	86	54%	0.536	41%	0.414	S	S	.	.	H	α-helix	trans	-66.4	-44	174.2	-77	-174.6	-179.7	-171.2	0.8	112.3	L570 I661 L662 K668 S669	L570-R665 VanDerWaalsContact CD1-CZ 3.48Å; I661-R665 PolarHBondContact O-N 3.27Å; L662-R665 PolarHBondContact O-N 2.92Å; R665-K668 PolarHBondContact O-N 3Å; R665-S669 WeakPolarHBondContact O-CB 3.12Å; R665-S669 PolarHBondContact O-N 3.16Å
666	H	77.6	Confident	75.6	Confident	64 Å²	64	89.7 Å²	89.7	30%	0.296	43%	0.432	S	S	.	.	H	α-helix	trans	-62.3	-45.3	178.3	-171.1	74.5	0	0	0	111.3	L662 R663 K668 S669 Q670 F712	L662-H666 WeakPolarHBondContact O-CB 3.14Å; L662-H666 PolarHBondContact O-N 3.14Å; R663-H666 PolarHBondContact O-N 3.28Å; H666-K668 VanDerWaalsContact C-N 3.31Å; H666-K668 PolarHBondContact O-N 3.11Å; H666-S669 WeakPolarHBondContact O-CB 3.23Å; H666-S669 PolarHBondContact O-N 3.45Å; H666-S669 VanDerWaalsContact O-N 3.16Å; H666-Q670 PolarHBondContact NE2-NE2 3.36Å; H666-Q670 PolarHBondContact O-N 2.93Å; H666-F712 HydrophobicContact CB-CD1 4.06Å; H666-F712 HydrophobicContact CB-CE1 3.88Å; H666-F712 HydrophobicContact CB-CZ 4.15Å; H666-F712 AromaticContact CD2-CD1 3.59Å; H666-F712 AromaticContact CE1-CG 4Å; H666-F712 AromaticContact CG-CD1 3.61Å; H666-F712 AromaticContact CG-CE1 3.97Å; H666-F712 AromaticContact CG-CG 3.92Å; H666-F712 AromaticContact ND1-CG 3.83Å; H666-F712 AromaticContact NE2-CD1 3.98Å
667	R	78.9	Confident	74.5	Confident	177 Å²	177	92.8 Å²	92.8	67%	0.668	45%	0.445	S	S	*	.	H	α-helix	trans	-59.8	-40.4	174.4	-171.2	178.9	179.2	-168.1	-0	112.1	R663 L671	R663-R667 WeakPolarHBondContact O-CB 3.26Å; R663-R667 PolarHBondContact O-N 3.06Å; R667-L671 HydrophobicContact CG-CD1 4.12Å; R667-L671 WeakPolarHBondContact O-CB 2.87Å; R667-L671 WeakPolarHBondContact O-CD1 3.36Å; R667-L671 WeakPolarHBondContact O-CG 3.46Å; R667-L671 PolarHBondContact O-N 3.42Å
668	K	80.1	Confident	73.4	Confident	138 Å²	138	95.6 Å²	95.6	60%	0.6	46%	0.456	S	S	*	.	H	α-helix	trans	-67.5	-38.4	176.2	-169.1	176.7	179.7	-180	0	112.3	A664 R665 H666 L671 Q672	A664-K668 WeakPolarHBondContact O-CB 3.3Å; A664-K668 PolarHBondContact O-N 3.34Å; R665-K668 PolarHBondContact O-N 3Å; H666-K668 VanDerWaalsContact C-N 3.31Å; H666-K668 PolarHBondContact O-N 3.11Å; K668-L671 PolarHBondContact O-N 3.26Å; K668-Q672 PolarHBondContact O-N 3.35Å
669	S	76.2	Confident	72.3	Confident	70 Å²	70	98.5 Å²	98.5	49%	0.49	47%	0.474	S	S	.	.	H	α-helix	trans	-66.9	-41.5	175.5	-169.9	0	0	0	0	111.8	R665 H666 Q672 A673	R665-S669 WeakPolarHBondContact O-CB 3.12Å; R665-S669 PolarHBondContact O-N 3.16Å; H666-S669 WeakPolarHBondContact O-CB 3.23Å; H666-S669 PolarHBondContact O-N 3.45Å; H666-S669 VanDerWaalsContact O-N 3.16Å; S669-Q672 PolarHBondContact O-N 3.48Å; S669-A673 WeakPolarHBondContact O-CB 3.3Å; S669-A673 PolarHBondContact O-N 3.39Å
670	Q	75.8	Confident	71.1	Confident	115 Å²	115	100.9 Å²	100.9	54%	0.537	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-40.6	172.9	-78.5	-176.1	-21.4	0	0	111.7	H666 Q672 A673 S674	H666-Q670 PolarHBondContact NE2-NE2 3.36Å; H666-Q670 PolarHBondContact O-N 2.93Å; Q670-Q672 VanDerWaalsContact C-N 3.31Å; Q670-Q672 PolarHBondContact O-N 2.95Å; Q670-A673 PolarHBondContact O-N 3.35Å; Q670-S674 WeakPolarHBondContact O-CB 3.48Å; Q670-S674 PolarHBondContact O-N 3.24Å; Q670-S674 PolarHBondContact O-OG 2.92Å
671	L	73.8	Confident	69.9	Low	88 Å²	88	99.4 Å²	99.4	46%	0.461	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-32.3	173.2	-83.8	155.9	0	0	0	112.8	R667 K668 S674 R675	R667-L671 HydrophobicContact CG-CD1 4.12Å; R667-L671 WeakPolarHBondContact O-CB 2.87Å; R667-L671 WeakPolarHBondContact O-CD1 3.36Å; R667-L671 WeakPolarHBondContact O-CG 3.46Å; R667-L671 PolarHBondContact O-N 3.42Å; K668-L671 PolarHBondContact O-N 3.26Å; L671-S674 VanDerWaalsContact CA-OG 3.25Å; L671-S674 WeakPolarHBondContact CA-OG 3.39Å; L671-S674 PolarHBondContact O-OG 3.12Å; L671-S674 VanDerWaalsContact O-OG 3.07Å; L671-R675 WeakPolarHBondContact O-CB 3.34Å; L671-R675 VanDerWaalsContact O-CG 3.28Å; L671-R675 WeakPolarHBondContact O-CG 3.4Å; L671-R675 PolarHBondContact O-N 3.23Å
672	Q	70.9	Confident	68.5	Low	111 Å²	111	103.3 Å²	103.3	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-77.7	-39.2	174	-79.9	-179	-47.5	0	0	112.5	K668 S669 Q670 R675 I676	K668-Q672 PolarHBondContact O-N 3.35Å; S669-Q672 PolarHBondContact O-N 3.48Å; Q670-Q672 VanDerWaalsContact C-N 3.31Å; Q670-Q672 PolarHBondContact O-N 2.95Å; Q672-R675 PolarHBondContact O-N 3.34Å; Q672-I676 VanDerWaalsContact O-CG1 3.25Å; Q672-I676 WeakPolarHBondContact O-CG1 3.35Å; Q672-I676 PolarHBondContact O-N 3.3Å
673	A	68.4	Low	67	Low	55 Å²	55	107.2 Å²	107.2	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-64.8	-41.4	175.5	0	0	0	0	0	111.6	S669 Q670 I676 Q677	S669-A673 WeakPolarHBondContact O-CB 3.3Å; S669-A673 PolarHBondContact O-N 3.39Å; Q670-A673 PolarHBondContact O-N 3.35Å; A673-I676 PolarHBondContact O-N 3.28Å; A673-Q677 WeakPolarHBondContact O-CB 3.32Å; A673-Q677 PolarHBondContact O-N 3.45Å
674	S	66.7	Low	65.6	Low	49 Å²	49	107.2 Å²	107.2	34%	0.343	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-41.5	172.6	44.7	0	0	0	0	112.3	Q670 L671 Q677 E678	Q670-S674 WeakPolarHBondContact O-CB 3.48Å; Q670-S674 PolarHBondContact O-N 3.24Å; Q670-S674 PolarHBondContact O-OG 2.92Å; L671-S674 VanDerWaalsContact CA-OG 3.25Å; L671-S674 WeakPolarHBondContact CA-OG 3.39Å; L671-S674 PolarHBondContact O-OG 3.12Å; L671-S674 VanDerWaalsContact O-OG 3.07Å; S674-Q677 PolarHBondContact O-N 3.5Å; S674-E678 WeakPolarHBondContact O-CG 3.48Å; S674-E678 PolarHBondContact O-N 3.41Å
675	R	61.8	Low	63.9	Low	168 Å²	168	112.4 Å²	112.4	63%	0.634	55%	0.554	S	S	*	*	H	α-helix	trans	-63.3	-39.6	173.2	-79.4	179.5	-177.7	-168.3	-1	113.9	L671 Q672 Q677 E678 D679	L671-R675 WeakPolarHBondContact O-CB 3.34Å; L671-R675 VanDerWaalsContact O-CG 3.28Å; L671-R675 WeakPolarHBondContact O-CG 3.4Å; L671-R675 PolarHBondContact O-N 3.23Å; Q672-R675 PolarHBondContact O-N 3.34Å; R675-Q677 VanDerWaalsContact C-N 3.27Å; R675-Q677 PolarHBondContact O-N 3.48Å; R675-E678 PolarHBondContact O-N 3.45Å; R675-D679 WeakPolarHBondContact O-CB 3.36Å; R675-D679 PolarHBondContact O-N 3.4Å
676	I	63.9	Low	62.1	Low	117 Å²	117	108.8 Å²	108.8	60%	0.6	56%	0.561	S	S	*	*	H	α-helix	trans	-67.3	-33.6	175.9	-67.9	163.7	0	0	0	110.5	Q672 A673 A680	Q672-I676 VanDerWaalsContact O-CG1 3.25Å; Q672-I676 WeakPolarHBondContact O-CG1 3.35Å; Q672-I676 PolarHBondContact O-N 3.3Å; A673-I676 PolarHBondContact O-N 3.28Å; I676-A680 VanDerWaalsContact O-CB 3.28Å; I676-A680 WeakPolarHBondContact O-CB 3.43Å; I676-A680 PolarHBondContact O-N 3.35Å
677	Q	57	Low	60.2	Low	143 Å²	143	113 Å²	113	67%	0.668	59%	0.586	S	S	*	*	H	α-helix	trans	-72.9	-37.7	174.9	-164.6	159.4	10.4	0	0	111.8	A673 S674 R675 A680 T681	A673-Q677 WeakPolarHBondContact O-CB 3.32Å; A673-Q677 PolarHBondContact O-N 3.45Å; S674-Q677 PolarHBondContact O-N 3.5Å; R675-Q677 VanDerWaalsContact C-N 3.27Å; R675-Q677 PolarHBondContact O-N 3.48Å; Q677-A680 PolarHBondContact O-N 2.94Å; Q677-T681 PolarHBondContact O-N 2.95Å; Q677-T681 PolarHBondContact O-OG1 3.38Å
678	E	55.8	Low	58	Low	122 Å²	122	109.9 Å²	109.9	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-63	-46.8	171.2	-78.6	175.1	166.3	0	0	111.6	S674 R675 A680 T681 E682	S674-E678 WeakPolarHBondContact O-CG 3.48Å; S674-E678 PolarHBondContact O-N 3.41Å; R675-E678 PolarHBondContact O-N 3.45Å; E678-A680 VanDerWaalsContact C-N 3.28Å; E678-A680 PolarHBondContact O-N 3.27Å; E678-T681 VanDerWaalsContact CA-OG1 3.29Å; E678-T681 WeakPolarHBondContact CA-OG1 3.48Å; E678-T681 PolarHBondContact O-N 3.49Å; E678-T681 VanDerWaalsContact O-N 3.16Å; E678-T681 PolarHBondContact O-OG1 2.85Å; E678-E682 PolarHBondContact O-N 3.02Å
679	D	53.8	Low	55.7	Low	95 Å²	95	108.5 Å²	108.5	51%	0.508	60%	0.599	S	S	.	*	H	α-helix	trans	-63	-31.7	174.1	-81.7	-22.7	0	0	0	112.3	R675 N683	R675-D679 WeakPolarHBondContact O-CB 3.36Å; R675-D679 PolarHBondContact O-N 3.4Å; D679-N683 WeakPolarHBondContact O-CB 3.33Å; D679-N683 PolarHBondContact O-N 2.87Å; D679-N683 PolarHBondContact O-ND2 3.49Å
680	A	55.4	Low	53.6	Low	50 Å²	50	110.4 Å²	110.4	41%	0.413	61%	0.612	S	S	.	*	H	α-helix	trans	-74.4	-32.9	175	0	0	0	0	0	112.2	I676 Q677 E678 I684	I676-A680 VanDerWaalsContact O-CB 3.28Å; I676-A680 WeakPolarHBondContact O-CB 3.43Å; I676-A680 PolarHBondContact O-N 3.35Å; Q677-A680 PolarHBondContact O-N 2.94Å; E678-A680 VanDerWaalsContact C-N 3.28Å; E678-A680 PolarHBondContact O-N 3.27Å; A680-I684 WeakPolarHBondContact O-CD1 3.36Å; A680-I684 VanDerWaalsContact O-CG1 3.27Å; A680-I684 WeakPolarHBondContact O-CG1 3.19Å
681	T	53.7	Low	52.2	Low	78 Å²	78	110.3 Å²	110.3	48%	0.479	62%	0.621	S	S	.	*	H	α-helix	trans	-75.5	-38.5	172.8	34.7	0	0	0	0	113	Q677 E678 N683 I684 E685	Q677-T681 PolarHBondContact O-N 2.95Å; Q677-T681 PolarHBondContact O-OG1 3.38Å; E678-T681 VanDerWaalsContact CA-OG1 3.29Å; E678-T681 WeakPolarHBondContact CA-OG1 3.48Å; E678-T681 PolarHBondContact O-N 3.49Å; E678-T681 VanDerWaalsContact O-N 3.16Å; E678-T681 PolarHBondContact O-OG1 2.85Å; T681-N683 VanDerWaalsContact C-N 3.3Å; T681-N683 PolarHBondContact O-N 2.66Å; T681-I684 PolarHBondContact O-N 3.14Å; T681-I684 VanDerWaalsContact O-N 3.1Å; T681-E685 PolarHBondContact O-N 3.49Å
682	E	50.2	Low	49.9	Very low	137 Å²	137	111.9 Å²	111.9	64%	0.64	64%	0.64	S	S	*	*	H	α-helix	trans	-66.5	-31.1	175.8	-77.5	-169.3	165.9	0	0	112.2	E678 I684	E678-E682 PolarHBondContact O-N 3.02Å; E682-I684 VanDerWaalsContact C-N 3.28Å; E682-I684 PolarHBondContact O-N 3.36Å
683	N	48	Very low	47.9	Very low	139 Å²	139	112.5 Å²	112.5	74%	0.743	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-10.7	173.3	-77	-48.3	0	0	0	114.3	D679 T681	D679-N683 WeakPolarHBondContact O-CB 3.33Å; D679-N683 PolarHBondContact O-N 2.87Å; D679-N683 PolarHBondContact O-ND2 3.49Å; T681-N683 VanDerWaalsContact C-N 3.3Å; T681-N683 PolarHBondContact O-N 2.66Å
684	I	50.8	Low	45.8	Very low	133 Å²	133	113.5 Å²	113.5	68%	0.682	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-22.7	176.7	-67.1	169.6	0	0	0	111.5	A680 T681 E682 G686	A680-I684 WeakPolarHBondContact O-CD1 3.36Å; A680-I684 VanDerWaalsContact O-CG1 3.27Å; A680-I684 WeakPolarHBondContact O-CG1 3.19Å; T681-I684 PolarHBondContact O-N 3.14Å; T681-I684 VanDerWaalsContact O-N 3.1Å; E682-I684 VanDerWaalsContact C-N 3.28Å; E682-I684 PolarHBondContact O-N 3.36Å; I684-G686 VanDerWaalsContact C-N 3.27Å; I684-G686 PolarHBondContact O-N 3.44Å
685	E	43.1	Very low	43.9	Very low	169 Å²	169	117.3 Å²	117.3	79%	0.79	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-1.3	177.3	-73	-172.3	157.5	0	0	114.3	T681	T681-E685 PolarHBondContact O-N 3.49Å
686	G	42.2	Very low	42.2	Very low	66 Å²	66	113 Å²	113	68%	0.68	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-7.1	-178.6	0	0	0	0	0	116.7	I684	I684-G686 VanDerWaalsContact C-N 3.27Å; I684-G686 PolarHBondContact O-N 3.44Å
687	D	38.3	Very low	40.4	Very low	153 Å²	153	116.4 Å²	116.4	82%	0.818	72%	0.72	S	S	*	*			trans	-151.4	88.7	177.9	-138.1	1.2	0	0	0	112.8
688	S	31.7	Very low	38.9	Very low	112 Å²	112	120.6 Å²	120.6	78%	0.783	73%	0.729	S	S	*	*			trans	-151.3	112.2	150.3	61.5	0	0	0	0	112.7
689	S	31.3	Very low	37.4	Very low	109 Å²	109	121.1 Å²	121.1	76%	0.762	74%	0.741	S	S	*	*			trans	-90.5	84.8	155	61.1	0	0	0	0	110.4
690	S	32.3	Very low	36	Very low	110 Å²	110	122.2 Å²	122.2	77%	0.769	76%	0.756	S	S	*	*			trans	73.7	165.8	139.2	87.4	0	0	0	0	119.3
691	P	47.6	Very low	34.5	Very low	112 Å²	112	124.8 Å²	124.8	73%	0.727	78%	0.777	S	S	*	*				-129.8	168.8	-110.5	26.2	-1.7	0	0	0	114
692	S	25.6	Very low	33.1	Very low	122 Å²	122	130 Å²	130	85%	0.853	80%	0.796	S	S	*	*			trans	173.1	144.6	135.7	45.6	0	0	0	0	114
693	S	28.2	Very low	31.9	Very low	124 Å²	124	127.3 Å²	127.3	87%	0.867	81%	0.805	S	S	*	*			trans	-55.9	137.2	-179	49.6	0	0	0	0	116.4
694	G	25.1	Very low	30.8	Very low	76 Å²	76	125.7 Å²	125.7	78%	0.784	81%	0.811	S	S	*	*			trans	-177	68.8	165.6	0	0	0	0	0	113	G696	G694-G696 PolarHBondContact O-N 2.85Å; G694-G696 VanDerWaalsContact O-N 3.08Å
695	S	25.9	Very low	29.7	Very low	128 Å²	128	127.4 Å²	127.4	90%	0.895	82%	0.816	S	S	*	*			trans	-75.8	92	174.7	58	0	0	0	0	110.9
696	G	25.7	Very low	28.8	Very low	77 Å²	77	125.7 Å²	125.7	79%	0.794	81%	0.812	S	S	*	*			trans	-90.9	123.6	164.3	0	0	0	0	0	110.9	G694	G694-G696 PolarHBondContact O-N 2.85Å; G694-G696 VanDerWaalsContact O-N 3.08Å
697	Q	27.6	Very low	28.2	Very low	189 Å²	189	129.4 Å²	129.4	88%	0.883	82%	0.817	S	S	*	*			trans	-79.7	134.3	-179.8	-161.9	170.9	16.8	0	0	111.2
698	R	24.6	Very low	27.8	Very low	232 Å²	232	130.1 Å²	130.1	88%	0.875	82%	0.815	S	S	*	*			trans	-171.7	94	156.2	-102.2	167	-166.6	-165.5	3.6	109
699	T	23.5	Very low	28	Very low	132 Å²	132	127.4 Å²	127.4	81%	0.81	81%	0.805	S	S	*	*				80.9	123.3	100.4	51.8	0	0	0	0	116.1
700	S	25.6	Very low	28.5	Very low	119 Å²	119	131.3 Å²	131.3	83%	0.832	81%	0.811	S	S	*	*			trans	-50.4	153	-177.4	-42.3	0	0	0	0	118.4
701	A	23.6	Very low	29.3	Very low	103 Å²	103	134.8 Å²	134.8	85%	0.851	82%	0.815	S	S	*	*			trans	-151.3	124.3	138.2	0	0	0	0	0	110.7
702	H	25.1	Very low	30	Very low	187 Å²	187	132.7 Å²	132.7	87%	0.866	79%	0.794	S	S	*	*			trans	-67.9	156.6	-179.6	-87.9	-76.2	0	0	0	113.8
703	G	23.6	Very low	32.5	Very low	81 Å²	81	130.6 Å²	130.6	84%	0.835	77%	0.774	S	S	*	*			trans	153.3	44.8	154.3	0	0	0	0	0	117.7
704	A	26.3	Very low	35	Very low	106 Å²	106	127.3 Å²	127.3	88%	0.876	74%	0.744	S	S	*	*			trans	-154.2	77.8	163.6	0	0	0	0	0	109.3
705	Q	27.7	Very low	37.8	Very low	168 Å²	168	125.2 Å²	125.2	79%	0.785	72%	0.723	S	S	*	*			trans	-135	103.4	172.3	-163.2	145.4	6.8	0	0	107.6
706	D	24.1	Very low	40.7	Very low	133 Å²	133	124.1 Å²	124.1	71%	0.711	71%	0.706	S	S	*	*			trans	170	73	136.5	-86.5	-10.2	0	0	0	107.9
707	D	28.4	Very low	43.5	Very low	144 Å²	144	122.9 Å²	122.9	77%	0.77	68%	0.681	S	S	*	*			trans	-103.3	87.5	158.8	-159.6	34.9	0	0	0	105.7	G709	D707-G709 PolarHBondContact O-N 3.4Å
708	H	30.2	Very low	46.3	Very low	168 Å²	168	117.2 Å²	117.2	78%	0.778	65%	0.654	S	S	*	*			trans	-68.6	79.3	164	-78.7	-68.5	0	0	0	108	E710	H708-E710 PolarHBondContact O-N 3.44Å
709	G	36.1	Very low	49.4	Very low	56 Å²	56	110 Å²	110	58%	0.577	64%	0.636	S	S	*	*			trans	-65.9	107.2	153.8	0	0	0	0	0	106.8	D707 E711	D707-G709 PolarHBondContact O-N 3.4Å; G709-E711 PolarHBondContact O-N 3.02Å
710	E	41.7	Very low	52.4	Low	190 Å²	190	110.1 Å²	110.1	89%	0.888	63%	0.627	S	S	*	*			trans	-47.2	116.4	173.8	-71.4	-177.4	162.4	0	0	109.2	H708 F712	H708-E710 PolarHBondContact O-N 3.44Å; E710-F712 PolarHBondContact O-N 2.99Å; E710-F712 VanDerWaalsContact O-N 3.12Å
711	E	49.9	Very low	55.4	Low	184 Å²	184	104.8 Å²	104.8	86%	0.86	59%	0.588	S	S	*	*			trans	-54.1	121.8	170.3	-70	-174.8	159.3	0	0	107.5	G709 N713	G709-E711 PolarHBondContact O-N 3.02Å; E711-N713 VanDerWaalsContact C-N 3.27Å; E711-N713 PolarHBondContact O-N 2.94Å
712	F	61.8	Low	58.5	Low	67 Å²	67	100.8 Å²	100.8	29%	0.294	56%	0.555	S	S	.	*			trans	-64.8	90.1	179.2	177.5	-96	0	0	0	109.3	L662 H666 E710 F714 I717	L662-F712 HydrophobicContact CB-CE2 4.32Å; L662-F712 HydrophobicContact CB-CZ 4.13Å; L662-F712 HydrophobicContact CD2-CE2 4.34Å; H666-F712 HydrophobicContact CB-CD1 4.06Å; H666-F712 HydrophobicContact CB-CE1 3.88Å; H666-F712 HydrophobicContact CB-CZ 4.15Å; H666-F712 AromaticContact CD2-CD1 3.59Å; H666-F712 AromaticContact CE1-CG 4Å; H666-F712 AromaticContact CG-CD1 3.61Å; H666-F712 AromaticContact CG-CE1 3.97Å; H666-F712 AromaticContact CG-CG 3.92Å; H666-F712 AromaticContact ND1-CG 3.83Å; H666-F712 AromaticContact NE2-CD1 3.98Å; E710-F712 PolarHBondContact O-N 2.99Å; E710-F712 VanDerWaalsContact O-N 3.12Å; F712-F714 HydrophobicContact CE1-CB 4.44Å; F712-F714 PolarHBondContact O-N 3.34Å; F712-I717 HydrophobicContact CD2-CD1 3.58Å; F712-I717 HydrophobicContact CE2-CD1 3.15Å; F712-I717 HydrophobicContact CG-CD1 4.46Å; F712-I717 HydrophobicContact CZ-CD1 3.72Å
713	N	77.6	Confident	61.6	Low	78 Å²	78	96.5 Å²	96.5	42%	0.417	54%	0.538	S	S	.	.			trans	-88.7	103.7	177.3	-168.1	-5.9	0	0	0	109.3	E711 G715 D716 I717	E711-N713 VanDerWaalsContact C-N 3.27Å; E711-N713 PolarHBondContact O-N 2.94Å; N713-G715 PolarHBondContact O-N 3.36Å; N713-G715 PolarHBondContact OD1-N 3.44Å; N713-D716 HydrophobicContact CB-CB 4.18Å; N713-D716 WeakPolarHBondContact CB-OD2 3.3Å; N713-D716 PolarHBondContact ND2-OD1 3.44Å; N713-D716 PolarHBondContact ND2-OD2 3.33Å; N713-D716 PolarHBondContact O-N 3.44Å; N713-I717 PolarHBondContact O-N 3.43Å
714	F	79.9	Confident	64.6	Low	56 Å²	56	95.2 Å²	95.2	25%	0.246	51%	0.51	C	S	.	.	H	α-helix	trans	-56.8	-32.5	176.1	178	-99.6	0	0	0	112.1	P659 R663 F712 F718	P659-F714 HydrophobicContact CB-CE2 3.91Å; P659-F714 HydrophobicContact CB-CZ 4.36Å; R663-F714 HydrophobicContact CB-CD2 3.85Å; R663-F714 HydrophobicContact CB-CE2 3.84Å; R663-F714 HydrophobicContact CG-CD2 4.16Å; R663-F714 HydrophobicContact CG-CE2 4.31Å; F712-F714 HydrophobicContact CE1-CB 4.44Å; F712-F714 PolarHBondContact O-N 3.34Å; F714-F718 VanDerWaalsContact O-CB 3.3Å; F714-F718 WeakPolarHBondContact O-CB 3.4Å; F714-F718 PolarHBondContact O-N 2.88Å
715	G	85.3	Confident	67.6	Low	32 Å²	32	90.2 Å²	90.2	33%	0.33	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-50	176.8	0	0	0	0	0	111.9	N713 I717 F718 V719	N713-G715 PolarHBondContact O-N 3.36Å; N713-G715 PolarHBondContact OD1-N 3.44Å; G715-I717 PolarHBondContact O-N 3.43Å; G715-F718 PolarHBondContact O-N 2.99Å; G715-V719 WeakPolarHBondContact O-CG2 3.27Å; G715-V719 PolarHBondContact O-N 3.5Å
716	D	86.9	Confident	70.6	Confident	104 Å²	104	86.9 Å²	86.9	56%	0.556	46%	0.455	S	S	*	.	H	α-helix	trans	-66.4	-41.6	-176.1	-61.1	-18	0	0	0	111.6	N713 F718 V719 H720	N713-D716 HydrophobicContact CB-CB 4.18Å; N713-D716 WeakPolarHBondContact CB-OD2 3.3Å; N713-D716 PolarHBondContact ND2-OD1 3.44Å; N713-D716 PolarHBondContact ND2-OD2 3.33Å; N713-D716 PolarHBondContact O-N 3.44Å; D716-F718 VanDerWaalsContact C-N 3.33Å; D716-F718 PolarHBondContact O-N 3.05Å; D716-V719 PolarHBondContact O-N 2.94Å; D716-H720 VanDerWaalsContact O-CB 3.26Å; D716-H720 WeakPolarHBondContact O-CB 3.45Å; D716-H720 PolarHBondContact O-N 2.95Å
717	I	83.9	Confident	73.8	Confident	51 Å²	51	85.6 Å²	85.6	26%	0.262	45%	0.445	S	S	.	.	H	α-helix	trans	-63.3	-41.1	175.9	-63.1	169.3	0	0	0	110.9	L662 F712 N713 G715 Q721	L662-I717 HydrophobicContact CD1-CG2 4.37Å; F712-I717 HydrophobicContact CD2-CD1 3.58Å; F712-I717 HydrophobicContact CE2-CD1 3.15Å; F712-I717 HydrophobicContact CG-CD1 4.46Å; F712-I717 HydrophobicContact CZ-CD1 3.72Å; N713-I717 PolarHBondContact O-N 3.43Å; G715-I717 PolarHBondContact O-N 3.43Å; I717-Q721 WeakPolarHBondContact O-CB 3.45Å; I717-Q721 PolarHBondContact O-N 3.47Å
718	F	86.5	Confident	76.7	Confident	70 Å²	70	79.4 Å²	79.4	31%	0.307	41%	0.411	S	S	.	.	H	α-helix	trans	-67	-45.4	178.7	-177.4	-97.2	0	0	0	111.5	L655 L656 P659 F714 G715 D716 Q721 A722	L655-F718 HydrophobicContact CD2-CE2 3.83Å; L655-F718 HydrophobicContact CD2-CZ 3.93Å; L656-F718 HydrophobicContact CD2-CE2 4.33Å; P659-F718 HydrophobicContact CB-CD2 4.22Å; P659-F718 HydrophobicContact CG-CD2 4.11Å; F714-F718 VanDerWaalsContact O-CB 3.3Å; F714-F718 WeakPolarHBondContact O-CB 3.4Å; F714-F718 PolarHBondContact O-N 2.88Å; G715-F718 PolarHBondContact O-N 2.99Å; D716-F718 VanDerWaalsContact C-N 3.33Å; D716-F718 PolarHBondContact O-N 3.05Å; F718-Q721 PolarHBondContact O-N 3.34Å; F718-A722 VanDerWaalsContact O-CB 3.3Å; F718-A722 WeakPolarHBondContact O-CB 3.33Å; F718-A722 PolarHBondContact O-N 2.67Å
719	V	89.7	Confident	79.5	Confident	82 Å²	82	72.2 Å²	72.2	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-48.1	178.1	172.6	0	0	0	0	110.8	G715 D716 Q721 A722 I723	G715-V719 WeakPolarHBondContact O-CG2 3.27Å; G715-V719 PolarHBondContact O-N 3.5Å; D716-V719 PolarHBondContact O-N 2.94Å; V719-Q721 VanDerWaalsContact C-N 3.35Å; V719-Q721 PolarHBondContact O-N 3.2Å; V719-A722 PolarHBondContact O-N 3.42Å; V719-I723 HydrophobicContact CG1-CD1 3.86Å; V719-I723 HydrophobicContact CG1-CG1 4.48Å; V719-I723 WeakPolarHBondContact O-CG1 3.49Å; V719-I723 PolarHBondContact O-N 2.96Å
720	H	86.9	Confident	82	Confident	134 Å²	134	75 Å²	75	62%	0.62	38%	0.38	S	S	*	.	H	α-helix	trans	-60.6	-43.3	178.3	-175.4	79.3	0	0	0	111.8	D716 A722 I723 H724	D716-H720 VanDerWaalsContact O-CB 3.26Å; D716-H720 WeakPolarHBondContact O-CB 3.45Å; D716-H720 PolarHBondContact O-N 2.95Å; H720-A722 PolarHBondContact O-N 2.86Å; H720-I723 PolarHBondContact O-N 3.37Å; H720-H724 WeakPolarHBondContact O-CB 3.47Å; H720-H724 PolarHBondContact O-N 3.13Å
721	Q	87.1	Confident	84.2	Confident	6 Å²	6	66.7 Å²	66.7	3%	0.028	35%	0.346	C	S	.	.	H	α-helix	trans	-67.3	-35.6	176.8	-173.5	63.4	30.9	0	0	112.6	M654 P659 I717 F718 V719 T725	M654-Q721 PolarHBondContact O-NE2 3.39Å; M654-Q721 VanDerWaalsContact O-NE2 3.08Å; P659-Q721 HydrophobicContact CG-CB 4.18Å; P659-Q721 HydrophobicContact CG-CG 4.15Å; I717-Q721 WeakPolarHBondContact O-CB 3.45Å; I717-Q721 PolarHBondContact O-N 3.47Å; F718-Q721 PolarHBondContact O-N 3.34Å; V719-Q721 VanDerWaalsContact C-N 3.35Å; V719-Q721 PolarHBondContact O-N 3.2Å; Q721-T725 WeakPolarHBondContact O-CB 3.28Å; Q721-T725 PolarHBondContact O-N 3.18Å; Q721-T725 PolarHBondContact O-OG1 3.36Å
722	A	89	Confident	86	Confident	19 Å²	19	58 Å²	58	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-44.5	175.3	0	0	0	0	0	111.3	F718 V719 H720 T725 I726	F718-A722 VanDerWaalsContact O-CB 3.3Å; F718-A722 WeakPolarHBondContact O-CB 3.33Å; F718-A722 PolarHBondContact O-N 2.67Å; V719-A722 PolarHBondContact O-N 3.42Å; H720-A722 PolarHBondContact O-N 2.86Å; A722-T725 PolarHBondContact O-N 3.22Å; A722-I726 WeakPolarHBondContact O-CG1 3.23Å; A722-I726 PolarHBondContact O-N 3.01Å
723	I	90.4	Very high	87.3	Confident	97 Å²	97	59.1 Å²	59.1	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-58.8	-52	174.6	-67.1	166.7	0	0	0	109.8	V719 H720 T725 I726 E727	V719-I723 HydrophobicContact CG1-CD1 3.86Å; V719-I723 HydrophobicContact CG1-CG1 4.48Å; V719-I723 WeakPolarHBondContact O-CG1 3.49Å; V719-I723 PolarHBondContact O-N 2.96Å; H720-I723 PolarHBondContact O-N 3.37Å; I723-T725 VanDerWaalsContact C-N 3.26Å; I723-T725 PolarHBondContact O-N 3.38Å; I723-I726 PolarHBondContact O-N 3.37Å; I723-E727 VanDerWaalsContact O-CB 3.28Å; I723-E727 WeakPolarHBondContact O-CB 3.4Å; I723-E727 PolarHBondContact O-N 3.48Å
724	H	88	Confident	88	Confident	54 Å²	54	59.1 Å²	59.1	25%	0.25	32%	0.319	C	S	.	.	H	α-helix	trans	-55.4	-41.6	178	-179.1	-76.1	0	0	0	112.3	Q575 E579 H720 Y728	Q575-H724 PolarHBondContact NE2-CE1 3.49Å; Q575-H724 PolarHBondContact NE2-NE2 2.96Å; E579-H724 IonicContact OE1-CE1 4Å; E579-H724 PolarHBondContact OE1-CE1 3.32Å; H720-H724 WeakPolarHBondContact O-CB 3.47Å; H720-H724 PolarHBondContact O-N 3.13Å; H724-Y728 VanDerWaalsContact O-CB 3.25Å; H724-Y728 WeakPolarHBondContact O-CB 3.37Å; H724-Y728 PolarHBondContact O-N 2.98Å
725	T	89.3	Confident	88.5	Confident	2 Å²	2	57 Å²	57	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-65.1	-48.1	179	-59.9	0	0	0	0	111.6	V651 M654 L655 Q721 A722 I723 Y728 C729	V651-T725 HydrophobicContact CG1-CG2 4.24Å; M654-T725 HydrophobicContact CE-CG2 3.45Å; M654-T725 VanDerWaalsContact CE-CG2 3.45Å; L655-T725 HydrophobicContact CB-CG2 4.1Å; L655-T725 HydrophobicContact CD1-CG2 4.31Å; Q721-T725 WeakPolarHBondContact O-CB 3.28Å; Q721-T725 PolarHBondContact O-N 3.18Å; Q721-T725 PolarHBondContact O-OG1 3.36Å; A722-T725 PolarHBondContact O-N 3.22Å; I723-T725 VanDerWaalsContact C-N 3.26Å; I723-T725 PolarHBondContact O-N 3.38Å; T725-Y728 PolarHBondContact O-N 3.41Å; T725-C729 WeakPolarHBondContact O-CB 3.27Å; T725-C729 PolarHBondContact O-N 3.32Å; T725-C729 PolarHBondContact O-SG 3.28Å; T725-C729 VanDerWaalsContact O-SG 3.39Å
726	I	90.3	Very high	88.8	Confident	98 Å²	98	56 Å²	56	50%	0.503	30%	0.298	S	S	.	.	H	α-helix	trans	-65.8	-45.6	-179.4	-68.2	168.1	0	0	0	110.4	A722 I723 Y728 C729 L730	A722-I726 WeakPolarHBondContact O-CG1 3.23Å; A722-I726 PolarHBondContact O-N 3.01Å; I723-I726 PolarHBondContact O-N 3.37Å; I726-Y728 VanDerWaalsContact C-N 3.35Å; I726-Y728 PolarHBondContact O-N 3.24Å; I726-C729 PolarHBondContact O-N 3.19Å; I726-L730 HydrophobicContact CG2-CD1 3.7Å; I726-L730 HydrophobicContact CG2-CG 4.35Å; I726-L730 WeakPolarHBondContact O-CB 3.31Å; I726-L730 WeakPolarHBondContact O-CG 3.26Å; I726-L730 PolarHBondContact O-N 3.07Å
727	E	90.6	Very high	88.9	Confident	106 Å²	106	53.8 Å²	53.8	50%	0.495	29%	0.294	S	S	.	.	H	α-helix	trans	-61.1	-43.8	177.9	-174.3	178.8	176.9	0	0	111.2	I723 G731	I723-E727 VanDerWaalsContact O-CB 3.28Å; I723-E727 WeakPolarHBondContact O-CB 3.4Å; I723-E727 PolarHBondContact O-N 3.48Å; E727-G731 WeakPolarHBondContact O-CA 3.49Å; E727-G731 PolarHBondContact O-N 3.46Å
728	Y	89.1	Confident	89.3	Confident	14 Å²	14	52 Å²	52	6%	0.055	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-50.6	176.7	-178.5	-90.4	0	0	0	111.9	E579 F582 I583 M654 H724 T725 I726 G731 C732 K814	E579-Y728 HydrophobicContact CB-CE1 3.9Å; E579-Y728 HydrophobicContact CB-CE2 4.03Å; E579-Y728 VanDerWaalsContact CB-CZ 3.5Å; E579-Y728 VanDerWaalsContact CB-OH 3.32Å; E579-Y728 WeakPolarHBondContact CB-OH 3.23Å; E579-Y728 HydrophobicContact CG-CD1 4.01Å; E579-Y728 HydrophobicContact CG-CD2 4.03Å; E579-Y728 HydrophobicContact CG-CE1 3.64Å; E579-Y728 HydrophobicContact CG-CE2 3.66Å; E579-Y728 HydrophobicContact CG-CG 4.21Å; E579-Y728 VanDerWaalsContact CG-CZ 3.45Å; E579-Y728 PolarHBondContact O-OH 2.97Å; F582-Y728 HydrophobicContact CD1-CE1 4.05Å; I583-Y728 WeakPolarHBondContact CD1-OH 3.38Å; I583-Y728 WeakPolarHBondContact CG1-OH 3.49Å; M654-Y728 HydrophobicContact CE-CD1 4.25Å; H724-Y728 VanDerWaalsContact O-CB 3.25Å; H724-Y728 WeakPolarHBondContact O-CB 3.37Å; H724-Y728 PolarHBondContact O-N 2.98Å; T725-Y728 PolarHBondContact O-N 3.41Å; I726-Y728 VanDerWaalsContact C-N 3.35Å; I726-Y728 PolarHBondContact O-N 3.24Å; Y728-G731 PolarHBondContact O-N 3.07Å; Y728-C732 VanDerWaalsContact CE1-SG 3.58Å; Y728-C732 VanDerWaalsContact CZ-SG 3.55Å; Y728-C732 WeakPolarHBondContact O-CB 3.36Å; Y728-C732 PolarHBondContact O-N 3.43Å; Y728-C732 PolarHBondContact O-SG 3.5Å; Y728-K814 HydrophobicContact CD2-CD 4.34Å; Y728-K814 VanDerWaalsContact CD2-NZ 3.29Å; Y728-K814 HydrophobicContact CE2-CD 3.96Å; Y728-K814 VanDerWaalsContact CE2-NZ 3.27Å
729	C	88.6	Confident	89.6	Confident	17 Å²	17	48.6 Å²	48.6	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-48.8	-175.9	-71.8	0	0	0	0	112.7	F582 T725 I726	F582-C729 HydrophobicContact CE1-CB 4.5Å; F582-C729 HydrophobicContact CZ-CB 4.2Å; T725-C729 WeakPolarHBondContact O-CB 3.27Å; T725-C729 PolarHBondContact O-N 3.32Å; T725-C729 PolarHBondContact O-SG 3.28Å; T725-C729 VanDerWaalsContact O-SG 3.39Å; I726-C729 PolarHBondContact O-N 3.19Å
730	L	89	Confident	89.7	Confident	114 Å²	114	47.5 Å²	47.5	60%	0.597	26%	0.262	S	S	*	.	H	α-helix	trans	-70.1	-38.3	177	-65.7	178	0	0	0	111.3	I726 C732 I733 S734	I726-L730 HydrophobicContact CG2-CD1 3.7Å; I726-L730 HydrophobicContact CG2-CG 4.35Å; I726-L730 WeakPolarHBondContact O-CB 3.31Å; I726-L730 WeakPolarHBondContact O-CG 3.26Å; I726-L730 PolarHBondContact O-N 3.07Å; L730-C732 VanDerWaalsContact C-N 3.34Å; L730-C732 PolarHBondContact O-N 2.92Å; L730-I733 PolarHBondContact O-N 3.01Å; L730-S734 PolarHBondContact O-N 3.41Å
731	G	88.8	Confident	90.1	Very high	16 Å²	16	43.9 Å²	43.9	17%	0.165	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-38.8	176.2	0	0	0	0	0	112.3	E727 Y728 I733 S734 N735	E727-G731 WeakPolarHBondContact O-CA 3.49Å; E727-G731 PolarHBondContact O-N 3.46Å; Y728-G731 PolarHBondContact O-N 3.07Å; G731-I733 VanDerWaalsContact C-N 3.31Å; G731-I733 PolarHBondContact O-N 2.7Å; G731-S734 PolarHBondContact O-N 3.49Å; G731-N735 WeakPolarHBondContact O-CA 3.11Å; G731-N735 WeakPolarHBondContact O-CB 3.31Å; G731-N735 PolarHBondContact O-N 2.88Å; G731-N735 PolarHBondContact O-ND2 3.28Å; G731-N735 PolarHBondContact O-OD1 2.85Å
732	C	87.1	Confident	90.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-40.3	175.6	-78.6	0	0	0	0	113	F582 I583 F587 Y728 L730 T736	F582-C732 HydrophobicContact CD1-CB 4.48Å; F582-C732 HydrophobicContact CE1-CB 3.98Å; I583-C732 HydrophobicContact CG1-CB 4.48Å; F587-C732 HydrophobicContact CE2-CB 4.19Å; Y728-C732 VanDerWaalsContact CE1-SG 3.58Å; Y728-C732 VanDerWaalsContact CZ-SG 3.55Å; Y728-C732 WeakPolarHBondContact O-CB 3.36Å; Y728-C732 PolarHBondContact O-N 3.43Å; Y728-C732 PolarHBondContact O-SG 3.5Å; L730-C732 VanDerWaalsContact C-N 3.34Å; L730-C732 PolarHBondContact O-N 2.92Å; C732-T736 WeakPolarHBondContact O-CB 3.3Å; C732-T736 PolarHBondContact O-N 3.48Å; C732-T736 VanDerWaalsContact O-N 3.11Å; C732-T736 PolarHBondContact O-OG1 3.06Å
733	I	90	Very high	90.6	Very high	90 Å²	90	45.4 Å²	45.4	46%	0.462	25%	0.245	S	C	.	.	H	α-helix	trans	-69.1	-48.9	177.3	-58.3	167.5	0	0	0	110.1	F587 L730 G731 T736 A737	F587-I733 HydrophobicContact CE2-CG1 4.48Å; F587-I733 HydrophobicContact CZ-CB 4.39Å; F587-I733 HydrophobicContact CZ-CG1 4Å; L730-I733 PolarHBondContact O-N 3.01Å; G731-I733 VanDerWaalsContact C-N 3.31Å; G731-I733 PolarHBondContact O-N 2.7Å; I733-T736 PolarHBondContact O-N 3.35Å; I733-A737 PolarHBondContact O-N 2.8Å; I733-A737 VanDerWaalsContact O-N 3.1Å
734	S	91.9	Very high	90.7	Very high	78 Å²	78	43.1 Å²	43.1	55%	0.545	24%	0.24	S	C	.	.	H	α-helix	trans	-62.6	-46.1	-179.5	-165.8	0	0	0	0	112.2	L730 G731 T736 A737 S738	L730-S734 PolarHBondContact O-N 3.41Å; G731-S734 PolarHBondContact O-N 3.49Å; S734-T736 PolarHBondContact O-N 3.47Å; S734-A737 PolarHBondContact O-N 3.18Å; S734-S738 WeakPolarHBondContact O-CB 3.32Å; S734-S738 PolarHBondContact O-N 3.36Å
735	N	90.6	Very high	91	Very high	13 Å²	13	41.7 Å²	41.7	7%	0.07	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-41	178.9	-66.2	-0.5	0	0	0	111.1	M552 G731 A737 S738 Y739 E810	M552-N735 HydrophobicContact SD-CB 3.79Å; G731-N735 WeakPolarHBondContact O-CA 3.11Å; G731-N735 WeakPolarHBondContact O-CB 3.31Å; G731-N735 PolarHBondContact O-N 2.88Å; G731-N735 PolarHBondContact O-ND2 3.28Å; G731-N735 PolarHBondContact O-OD1 2.85Å; N735-A737 PolarHBondContact O-N 3.46Å; N735-S738 WeakPolarHBondContact O-CB 3.4Å; N735-S738 PolarHBondContact O-N 3.35Å; N735-Y739 WeakPolarHBondContact O-CD2 3.2Å; N735-Y739 PolarHBondContact O-N 3.16Å; N735-E810 HydrophobicContact CB-CB 4.37Å; N735-E810 HydrophobicContact CB-CG 3.77Å
736	T	90.1	Very high	91.1	Very high	10 Å²	10	41.7 Å²	41.7	6%	0.061	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-45.3	175.3	-53.2	0	0	0	0	111.6	I549 M552 F587 C732 I733 S734 S738 Y739	I549-T736 HydrophobicContact CD1-CG2 4.22Å; I549-T736 HydrophobicContact CG1-CG2 4.07Å; M552-T736 HydrophobicContact CE-CG2 4.38Å; M552-T736 WeakPolarHBondContact CE-OG1 3.42Å; F587-T736 HydrophobicContact CD1-CG2 3.71Å; F587-T736 HydrophobicContact CE1-CG2 3.82Å; F587-T736 HydrophobicContact CG-CG2 4.46Å; C732-T736 WeakPolarHBondContact O-CB 3.3Å; C732-T736 PolarHBondContact O-N 3.48Å; C732-T736 VanDerWaalsContact O-N 3.11Å; C732-T736 PolarHBondContact O-OG1 3.06Å; I733-T736 PolarHBondContact O-N 3.35Å; S734-T736 PolarHBondContact O-N 3.47Å; T736-S738 VanDerWaalsContact C-N 3.28Å; T736-S738 PolarHBondContact O-N 2.99Å; T736-Y739 PolarHBondContact O-N 3.34Å
737	A	90.2	Very high	91.2	Very high	57 Å²	57	39.3 Å²	39.3	47%	0.471	22%	0.223	S	C	.	.	H	α-helix	trans	-64.7	-34.1	177.2	0	0	0	0	0	112.1	I733 S734 N735 Y739 L740	I733-A737 PolarHBondContact O-N 2.8Å; I733-A737 VanDerWaalsContact O-N 3.1Å; S734-A737 PolarHBondContact O-N 3.18Å; N735-A737 PolarHBondContact O-N 3.46Å; A737-Y739 PolarHBondContact O-N 3.18Å; A737-L740 VanDerWaalsContact O-CB 3.24Å; A737-L740 WeakPolarHBondContact O-CB 3.27Å; A737-L740 VanDerWaalsContact O-CG 3.28Å; A737-L740 WeakPolarHBondContact O-CG 2.99Å; A737-L740 PolarHBondContact O-N 2.98Å
738	S	91.7	Very high	91.3	Very high	13 Å²	13	36.4 Å²	36.4	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-57.5	-31.9	177.3	-164.1	0	0	0	0	113.2	S734 N735 T736 L740 R741 E810	S734-S738 WeakPolarHBondContact O-CB 3.32Å; S734-S738 PolarHBondContact O-N 3.36Å; N735-S738 WeakPolarHBondContact O-CB 3.4Å; N735-S738 PolarHBondContact O-N 3.35Å; T736-S738 VanDerWaalsContact C-N 3.28Å; T736-S738 PolarHBondContact O-N 2.99Å; S738-L740 PolarHBondContact O-N 3.45Å; S738-R741 WeakPolarHBondContact O-CB 3.47Å; S738-R741 VanDerWaalsContact O-CG 3.25Å; S738-R741 WeakPolarHBondContact O-CG 3.36Å; S738-R741 PolarHBondContact O-N 2.95Å; S738-R741 VanDerWaalsContact O-N 3.16Å; S738-R741 PolarHBondContact OG-NH1 3.29Å; S738-R741 PolarHBondContact OG-NH2 3.21Å; S738-E810 VanDerWaalsContact CB-OE1 3.24Å; S738-E810 WeakPolarHBondContact CB-OE1 3.36Å; S738-E810 PolarHBondContact OG-OE1 2.84Å
739	Y	93.5	Very high	91.4	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-15.6	176.6	-79.6	-77.5	0	0	0	114.5	G548 Q551 M552 N735 T736 A737 R741 L742 L806 E810	G548-Y739 VanDerWaalsContact CA-CD1 3.41Å; G548-Y739 VanDerWaalsContact CA-CD2 3.48Å; Q551-Y739 VanDerWaalsContact CD-OH 3.31Å; Q551-Y739 PolarHBondContact OE1-OH 3.36Å; M552-Y739 HydrophobicContact CE-CD2 4.2Å; M552-Y739 HydrophobicContact CE-CE2 4.03Å; M552-Y739 HydrophobicContact CG-CE2 3.75Å; M552-Y739 HydrophobicContact SD-CD2 4.43Å; M552-Y739 HydrophobicContact SD-CE2 3.85Å; N735-Y739 WeakPolarHBondContact O-CD2 3.2Å; N735-Y739 PolarHBondContact O-N 3.16Å; T736-Y739 PolarHBondContact O-N 3.34Å; A737-Y739 PolarHBondContact O-N 3.18Å; Y739-R741 PolarHBondContact O-N 3.45Å; Y739-L742 HydrophobicContact CD1-CD1 3.78Å; Y739-L742 WeakPolarHBondContact O-CB 3.49Å; Y739-L742 PolarHBondContact O-N 3.48Å; Y739-L806 HydrophobicContact CD1-CD1 4.07Å; Y739-L806 HydrophobicContact CD1-CD2 3.85Å; Y739-L806 HydrophobicContact CE1-CB 4.38Å; Y739-L806 HydrophobicContact CE1-CD1 4.1Å; Y739-L806 HydrophobicContact CE1-CD2 3.84Å; Y739-L806 HydrophobicContact CE1-CG 4.33Å; Y739-L806 HydrophobicContact CG-CD2 4.3Å; Y739-E810 HydrophobicContact CE2-CB 3.97Å; Y739-E810 HydrophobicContact CE2-CG 4.2Å
740	L	92.3	Very high	91.5	Very high	59 Å²	59	36.1 Å²	36.1	31%	0.309	22%	0.218	S	C	.	.	H	α-helix	trans	-59.5	-18.1	171.5	-66.3	173.8	0	0	0	112.6	M541 V545 A737 S738 L742 W743 A744	M541-L740 HydrophobicContact CG-CD2 3.81Å; V545-L740 HydrophobicContact CG2-CD2 4.01Å; A737-L740 VanDerWaalsContact O-CB 3.24Å; A737-L740 WeakPolarHBondContact O-CB 3.27Å; A737-L740 VanDerWaalsContact O-CG 3.28Å; A737-L740 WeakPolarHBondContact O-CG 2.99Å; A737-L740 PolarHBondContact O-N 2.98Å; S738-L740 PolarHBondContact O-N 3.45Å; L740-L742 VanDerWaalsContact C-N 3.26Å; L740-L742 PolarHBondContact O-N 3.25Å; L740-W743 HydrophobicContact CB-CE3 4.37Å; L740-W743 HydrophobicContact CD2-CE3 4.28Å; L740-W743 WeakPolarHBondContact O-CB 3.3Å; L740-W743 PolarHBondContact O-N 3.29Å; L740-W743 VanDerWaalsContact O-N 3.16Å; L740-A744 PolarHBondContact O-N 3.36Å
741	R	93.8	Very high	91.6	Very high	57 Å²	57	33.4 Å²	33.4	22%	0.215	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-37.3	171	-68.8	-178.8	-159.6	129.9	10.4	112.8	M408 S738 Y739 W743 A744 L745 E810	M408-R741 HydrophobicContact CE-CB 3.97Å; S738-R741 WeakPolarHBondContact O-CB 3.47Å; S738-R741 VanDerWaalsContact O-CG 3.25Å; S738-R741 WeakPolarHBondContact O-CG 3.36Å; S738-R741 PolarHBondContact O-N 2.95Å; S738-R741 VanDerWaalsContact O-N 3.16Å; S738-R741 PolarHBondContact OG-NH1 3.29Å; S738-R741 PolarHBondContact OG-NH2 3.21Å; Y739-R741 PolarHBondContact O-N 3.45Å; R741-W743 PolarHBondContact O-N 2.94Å; R741-A744 PolarHBondContact O-N 3.17Å; R741-L745 HydrophobicContact CB-CD1 4.2Å; R741-L745 VanDerWaalsContact O-CD1 3.22Å; R741-L745 WeakPolarHBondContact O-CD1 3.26Å; R741-L745 PolarHBondContact O-N 3.36Å; R741-E810 IonicContact NH1-OE1 3.87Å; R741-E810 PolarHBondContact NH1-OE1 3.04Å
742	L	93	Very high	91.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-55.7	-44	177.1	-66.8	166.6	0	0	0	110.3	L404 V407 M408 Y739 L740 S746 L806	L404-L742 HydrophobicContact CB-CD2 4.12Å; L404-L742 HydrophobicContact CD2-CD1 4.19Å; L404-L742 HydrophobicContact CD2-CD2 4.11Å; V407-L742 HydrophobicContact CG1-CB 4.24Å; V407-L742 HydrophobicContact CG1-CD2 4.42Å; M408-L742 HydrophobicContact CE-CB 4.43Å; M408-L742 HydrophobicContact CE-CD2 3.72Å; M408-L742 HydrophobicContact CE-CG 4.09Å; M408-L742 HydrophobicContact CG-CB 4.46Å; M408-L742 HydrophobicContact CG-CD2 3.85Å; M408-L742 HydrophobicContact SD-CD2 4.05Å; Y739-L742 HydrophobicContact CD1-CD1 3.78Å; Y739-L742 WeakPolarHBondContact O-CB 3.49Å; Y739-L742 PolarHBondContact O-N 3.48Å; L740-L742 VanDerWaalsContact C-N 3.26Å; L740-L742 PolarHBondContact O-N 3.25Å; L742-S746 WeakPolarHBondContact O-CB 3.32Å; L742-S746 PolarHBondContact O-N 3.41Å; L742-L806 HydrophobicContact CD1-CD1 4.47Å; L742-L806 HydrophobicContact CD2-CD1 3.8Å; L742-L806 HydrophobicContact CG-CD1 3.94Å
743	W	94.1	Very high	91.9	Very high	58 Å²	58	35.6 Å²	35.6	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-69	-50	176.1	158.5	52.1	0	0	0	112.3	N537 K540 M541 L740 R741 L745 S746 L747	N537-W743 WeakPolarHBondContact OD1-CZ2 3.46Å; N537-W743 PolarHBondContact OD1-NE1 3.5Å; K540-W743 HydrophobicContact CB-CB 4.42Å; K540-W743 VanDerWaalsContact CB-CD1 3.43Å; K540-W743 HydrophobicContact CB-CG 4.22Å; M541-W743 HydrophobicContact CB-CD2 4.01Å; M541-W743 HydrophobicContact CB-CE3 4.35Å; M541-W743 HydrophobicContact CB-CG 4.16Å; M541-W743 HydrophobicContact CG-CD2 4.36Å; M541-W743 HydrophobicContact CG-CE3 4.19Å; L740-W743 HydrophobicContact CB-CE3 4.37Å; L740-W743 HydrophobicContact CD2-CE3 4.28Å; L740-W743 WeakPolarHBondContact O-CB 3.3Å; L740-W743 PolarHBondContact O-N 3.29Å; L740-W743 VanDerWaalsContact O-N 3.16Å; R741-W743 PolarHBondContact O-N 2.94Å; W743-L745 PolarHBondContact O-N 3.44Å; W743-S746 PolarHBondContact O-N 3.38Å; W743-L747 HydrophobicContact CZ2-CD1 4.4Å; W743-L747 WeakPolarHBondContact O-CB 3.35Å; W743-L747 PolarHBondContact O-N 3.06Å
744	A	92.9	Very high	91.9	Very high	49 Å²	49	33.7 Å²	33.7	41%	0.405	20%	0.199	S	C	.	.	H	α-helix	trans	-59.2	-46.9	-174.8	0	0	0	0	0	112.3	L740 R741 L747 A748	L740-A744 PolarHBondContact O-N 3.36Å; R741-A744 PolarHBondContact O-N 3.17Å; A744-L747 PolarHBondContact O-N 2.86Å; A744-A748 WeakPolarHBondContact O-CB 3.42Å; A744-A748 PolarHBondContact O-N 3.18Å
745	L	93.2	Very high	91.9	Very high	23 Å²	23	33.7 Å²	33.7	12%	0.12	20%	0.196	C	C	.	.	H	α-helix	trans	-68.1	-41.1	177.7	-83.5	86.5	0	0	0	111.9	M408 R741 W743 L747 A748 H749 A799 H802	M408-L745 HydrophobicContact CB-CB 4.25Å; M408-L745 HydrophobicContact CG-CB 4.17Å; M408-L745 HydrophobicContact SD-CD2 4.49Å; R741-L745 HydrophobicContact CB-CD1 4.2Å; R741-L745 VanDerWaalsContact O-CD1 3.22Å; R741-L745 WeakPolarHBondContact O-CD1 3.26Å; R741-L745 PolarHBondContact O-N 3.36Å; W743-L745 PolarHBondContact O-N 3.44Å; L745-L747 VanDerWaalsContact C-N 3.25Å; L745-L747 PolarHBondContact O-N 3.12Å; L745-A748 PolarHBondContact O-N 3.12Å; L745-H749 WeakPolarHBondContact O-CB 3.45Å; L745-H749 PolarHBondContact O-N 2.85Å; L745-A799 HydrophobicContact CD2-CB 4.28Å; L745-H802 HydrophobicContact CD2-CB 4.33Å
746	S	92.8	Very high	91.9	Very high	3 Å²	3	34 Å²	34	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-32.1	176.4	-170.9	0	0	0	0	113	V407 M408 Y466 K540 L742 W743 A750	V407-S746 VanDerWaalsContact O-CB 3.27Å; V407-S746 WeakPolarHBondContact O-CB 3.34Å; V407-S746 PolarHBondContact O-OG 3.1Å; M408-S746 VanDerWaalsContact O-CA 3.26Å; M408-S746 WeakPolarHBondContact O-CA 3.34Å; Y466-S746 WeakPolarHBondContact CE2-OG 3.48Å; K540-S746 PolarHBondContact NZ-O 3.13Å; K540-S746 PolarHBondContact NZ-OG 3.43Å; L742-S746 WeakPolarHBondContact O-CB 3.32Å; L742-S746 PolarHBondContact O-N 3.41Å; W743-S746 PolarHBondContact O-N 3.38Å; S746-A750 WeakPolarHBondContact O-CB 3.37Å; S746-A750 PolarHBondContact O-N 2.82Å
747	L	91.2	Very high	91.9	Very high	48 Å²	48	36.4 Å²	36.4	25%	0.251	21%	0.205	S	C	.	.	H	α-helix	trans	-75.4	-45.8	174.5	-171	150.2	0	0	0	111.1	N537 W743 A744 L745 H749 A750 Q751	N537-L747 HydrophobicContact CB-CD1 4.35Å; W743-L747 HydrophobicContact CZ2-CD1 4.4Å; W743-L747 WeakPolarHBondContact O-CB 3.35Å; W743-L747 PolarHBondContact O-N 3.06Å; A744-L747 PolarHBondContact O-N 2.86Å; L745-L747 VanDerWaalsContact C-N 3.25Å; L745-L747 PolarHBondContact O-N 3.12Å; L747-H749 PolarHBondContact O-N 3.1Å; L747-A750 PolarHBondContact O-N 2.82Å; L747-Q751 HydrophobicContact CD2-CG 4.02Å; L747-Q751 WeakPolarHBondContact O-CG 3.28Å; L747-Q751 PolarHBondContact O-N 3.23Å
748	A	92.8	Very high	91.9	Very high	45 Å²	45	36.3 Å²	36.3	37%	0.372	20%	0.198	S	C	.	.	H	α-helix	trans	-58.9	-46	177.5	0	0	0	0	0	111.7	A744 L745 A750 Q751 L752	A744-A748 WeakPolarHBondContact O-CB 3.42Å; A744-A748 PolarHBondContact O-N 3.18Å; L745-A748 PolarHBondContact O-N 3.12Å; A748-A750 PolarHBondContact O-N 2.73Å; A748-Q751 PolarHBondContact O-N 3.44Å; A748-L752 WeakPolarHBondContact O-CB 3.31Å; A748-L752 PolarHBondContact O-N 2.86Å
749	H	91.5	Very high	91.7	Very high	5 Å²	5	41.9 Å²	41.9	2%	0.023	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-48.4	177.7	-176.2	70.1	0	0	0	112.1	F409 H414 L745 L747 Q751 L752 S753	F409-H749 AromaticContact CD2-CE1 3.64Å; F409-H749 AromaticContact CD2-ND1 3.79Å; F409-H749 AromaticContact CE2-CE1 3.12Å; F409-H749 WeakPolarHBondContact CE2-CE1 3.25Å; F409-H749 AromaticContact CE2-ND1 3.57Å; F409-H749 AromaticContact CE2-NE2 3.78Å; F409-H749 AromaticContact CZ-CE1 3.67Å; H414-H749 AromaticContact CE1-CE1 3.84Å; H414-H749 AromaticContact CE1-NE2 3.81Å; H414-H749 AromaticContact ND1-CE1 3.32Å; H414-H749 PolarHBondContact ND1-CE1 3.12Å; H414-H749 VanDerWaalsContact ND1-CE1 3.32Å; H414-H749 AromaticContact ND1-NE2 3.13Å; H414-H749 PolarHBondContact ND1-NE2 3.3Å; H414-H749 VanDerWaalsContact ND1-NE2 3.13Å; L745-H749 WeakPolarHBondContact O-CB 3.45Å; L745-H749 PolarHBondContact O-N 2.85Å; L747-H749 PolarHBondContact O-N 3.1Å; H749-Q751 VanDerWaalsContact C-N 3.33Å; H749-Q751 PolarHBondContact O-N 3.38Å; H749-L752 PolarHBondContact O-N 3.16Å; H749-S753 WeakPolarHBondContact O-CB 3.46Å; H749-S753 PolarHBondContact O-N 2.97Å
750	A	90.4	Very high	91.4	Very high	20 Å²	20	43.5 Å²	43.5	17%	0.165	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-40.8	178.5	0	0	0	0	0	112.1	S746 L747 A748 E754	S746-A750 WeakPolarHBondContact O-CB 3.37Å; S746-A750 PolarHBondContact O-N 2.82Å; L747-A750 PolarHBondContact O-N 2.82Å; A748-A750 PolarHBondContact O-N 2.73Å; A750-E754 WeakPolarHBondContact O-CB 3.46Å; A750-E754 PolarHBondContact O-N 3.15Å
751	Q	91.1	Very high	91.1	Very high	57 Å²	57	41.3 Å²	41.3	27%	0.266	22%	0.223	S	C	.	.	H	α-helix	trans	-70.6	-40.6	178.3	-70.7	-58.2	-74	0	0	112.9	L533 L747 A748 H749 S753 E754 V755	L533-Q751 HydrophobicContact CD2-CG 4.39Å; L747-Q751 HydrophobicContact CD2-CG 4.02Å; L747-Q751 WeakPolarHBondContact O-CG 3.28Å; L747-Q751 PolarHBondContact O-N 3.23Å; A748-Q751 PolarHBondContact O-N 3.44Å; H749-Q751 VanDerWaalsContact C-N 3.33Å; H749-Q751 PolarHBondContact O-N 3.38Å; Q751-S753 VanDerWaalsContact C-N 3.34Å; Q751-S753 PolarHBondContact O-N 3.39Å; Q751-E754 PolarHBondContact NE2-OE2 3.42Å; Q751-E754 VanDerWaalsContact NE2-OE2 3.07Å; Q751-E754 PolarHBondContact O-N 3.13Å; Q751-V755 WeakPolarHBondContact O-CG2 3.27Å; Q751-V755 PolarHBondContact O-N 2.99Å
752	L	91.3	Very high	90.8	Very high	59 Å²	59	41.8 Å²	41.8	31%	0.309	23%	0.23	S	C	.	.	H	α-helix	trans	-65.4	-40.8	177.6	-156.3	153.2	0	0	0	110.5	A748 H749 E754 V755 L756 I790 L791	A748-L752 WeakPolarHBondContact O-CB 3.31Å; A748-L752 PolarHBondContact O-N 2.86Å; H749-L752 PolarHBondContact O-N 3.16Å; L752-E754 VanDerWaalsContact C-N 3.33Å; L752-E754 PolarHBondContact O-N 3.3Å; L752-V755 PolarHBondContact O-N 2.83Å; L752-L756 HydrophobicContact CD2-CD1 4.5Å; L752-L756 VanDerWaalsContact O-CB 3.3Å; L752-L756 WeakPolarHBondContact O-CB 3.5Å; L752-L756 PolarHBondContact O-N 3.01Å; L752-I790 HydrophobicContact CD2-CG2 4.12Å; L752-L791 HydrophobicContact CB-CD2 4.11Å; L752-L791 HydrophobicContact CD2-CD1 4.39Å; L752-L791 HydrophobicContact CD2-CD2 3.44Å; L752-L791 VanDerWaalsContact CD2-CD2 3.44Å; L752-L791 HydrophobicContact CD2-CG 3.82Å; L752-L791 HydrophobicContact CG-CD2 4.29Å
753	S	90.6	Very high	90.3	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.028	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-40.5	173.4	-175.3	0	0	0	0	112.3	S471 H749 Q751 W757	S471-S753 PolarHBondContact N-OG 2.72Å; H749-S753 WeakPolarHBondContact O-CB 3.46Å; H749-S753 PolarHBondContact O-N 2.97Å; Q751-S753 VanDerWaalsContact C-N 3.34Å; Q751-S753 PolarHBondContact O-N 3.39Å; S753-W757 WeakPolarHBondContact O-CB 3.43Å; S753-W757 PolarHBondContact O-N 2.78Å
754	E	90.2	Very high	89.6	Confident	49 Å²	49	43.4 Å²	43.4	23%	0.229	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-44.6	178	176.4	171.2	-160.7	0	0	112.4	K532 A750 Q751 L752 L756 W757 T758	K532-E754 VanDerWaalsContact CE-OE2 3.3Å; K532-E754 WeakPolarHBondContact CE-OE2 3.3Å; K532-E754 IonicContact NZ-OE1 3.55Å; K532-E754 PolarHBondContact NZ-OE1 3.17Å; K532-E754 IonicContact NZ-OE2 2.67Å; K532-E754 PolarHBondContact NZ-OE2 3.41Å; A750-E754 WeakPolarHBondContact O-CB 3.46Å; A750-E754 PolarHBondContact O-N 3.15Å; Q751-E754 PolarHBondContact NE2-OE2 3.42Å; Q751-E754 VanDerWaalsContact NE2-OE2 3.07Å; Q751-E754 PolarHBondContact O-N 3.13Å; L752-E754 VanDerWaalsContact C-N 3.33Å; L752-E754 PolarHBondContact O-N 3.3Å; E754-L756 VanDerWaalsContact C-N 3.33Å; E754-L756 PolarHBondContact O-N 2.88Å; E754-W757 PolarHBondContact O-N 3.32Å; E754-T758 HydrophobicContact CG-CG2 4.37Å; E754-T758 WeakPolarHBondContact O-CB 3.31Å; E754-T758 WeakPolarHBondContact O-CG2 3.42Å; E754-T758 PolarHBondContact O-N 3.31Å; E754-T758 PolarHBondContact O-OG1 3.29Å
755	V	91.7	Very high	89.2	Confident	79 Å²	79	46.4 Å²	46.4	48%	0.479	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-43.9	176.7	171.7	0	0	0	0	110.5	Q751 L752 W757 T758 M759	Q751-V755 WeakPolarHBondContact O-CG2 3.27Å; Q751-V755 PolarHBondContact O-N 2.99Å; L752-V755 PolarHBondContact O-N 2.83Å; V755-W757 VanDerWaalsContact C-N 3.34Å; V755-W757 PolarHBondContact O-N 3.48Å; V755-T758 WeakPolarHBondContact CA-OG1 3.29Å; V755-T758 PolarHBondContact O-N 3.47Å; V755-T758 PolarHBondContact O-OG1 3.28Å; V755-M759 HydrophobicContact CG1-CG 4.16Å; V755-M759 VanDerWaalsContact O-CB 3.28Å; V755-M759 WeakPolarHBondContact O-CB 3.42Å; V755-M759 WeakPolarHBondContact O-CG 3.5Å; V755-M759 PolarHBondContact O-N 2.87Å
756	L	90.8	Very high	88.6	Confident	18 Å²	18	51.4 Å²	51.4	9%	0.094	27%	0.274	C	S	.	.	H	α-helix	trans	-65.1	-39.4	179.8	-162.5	149.9	0	0	0	111.1	L752 E754 V760 F783 L786 L791	L752-L756 HydrophobicContact CD2-CD1 4.5Å; L752-L756 VanDerWaalsContact O-CB 3.3Å; L752-L756 WeakPolarHBondContact O-CB 3.5Å; L752-L756 PolarHBondContact O-N 3.01Å; E754-L756 VanDerWaalsContact C-N 3.33Å; E754-L756 PolarHBondContact O-N 2.88Å; L756-V760 VanDerWaalsContact O-CB 3.31Å; L756-V760 WeakPolarHBondContact O-CB 3.31Å; L756-V760 PolarHBondContact O-N 3.43Å; L756-V760 VanDerWaalsContact O-N 3.16Å; L756-F783 HydrophobicContact CD2-CD2 3.17Å; L756-F783 HydrophobicContact CD2-CE2 3.12Å; L756-F783 HydrophobicContact CD2-CG 4.09Å; L756-F783 HydrophobicContact CD2-CZ 4Å; L756-L786 HydrophobicContact CD1-CB 4.07Å; L756-L791 HydrophobicContact CD1-CD1 3.95Å
757	W	90.6	Very high	88	Confident	62 Å²	62	56.7 Å²	56.7	24%	0.235	30%	0.3	C	S	.	.	I	π-helix	trans	-64.5	-49.4	173.3	-175	-82.4	0	0	0	112.5	F470 S471 K472 S753 E754 V755 M761 N762 F783	F470-W757 HydrophobicContact CB-CE3 4.25Å; F470-W757 HydrophobicContact CB-CZ3 4.2Å; S471-W757 WeakPolarHBondContact OG-CB 3.28Å; K472-W757 HydrophobicContact CG-CZ2 4.38Å; S753-W757 WeakPolarHBondContact O-CB 3.43Å; S753-W757 PolarHBondContact O-N 2.78Å; E754-W757 PolarHBondContact O-N 3.32Å; V755-W757 VanDerWaalsContact C-N 3.34Å; V755-W757 PolarHBondContact O-N 3.48Å; W757-M761 HydrophobicContact CD2-CB 4.13Å; W757-M761 HydrophobicContact CD2-CG 4.26Å; W757-M761 HydrophobicContact CE3-CB 4.34Å; W757-M761 HydrophobicContact CE3-CG 4.27Å; W757-M761 HydrophobicContact CG-CB 4.42Å; W757-M761 HydrophobicContact CH2-CG 4.06Å; W757-M761 HydrophobicContact CZ2-CG 4.02Å; W757-M761 HydrophobicContact CZ3-CE 4.44Å; W757-M761 HydrophobicContact CZ3-CG 4.17Å; W757-M761 WeakPolarHBondContact O-CA 3.49Å; W757-M761 VanDerWaalsContact O-CB 3.29Å; W757-M761 WeakPolarHBondContact O-CB 3.21Å; W757-M761 PolarHBondContact O-N 3.04Å; W757-N762 PolarHBondContact O-N 3.27Å; W757-N762 VanDerWaalsContact O-N 3.09Å; W757-F783 HydrophobicContact CE3-CE2 4.18Å; W757-F783 AromaticContact CE3-CZ 3.99Å; W757-F783 HydrophobicContact CE3-CZ 3.99Å; W757-F783 HydrophobicContact CZ3-CZ 4.35Å
758	T	89.6	Confident	87.4	Confident	54 Å²	54	66.3 Å²	66.3	33%	0.331	33%	0.333	S	S	.	.	I	π-helix	trans	-71.9	-35.5	-174	50.6	0	0	0	0	113.4	E754 V755 N762	E754-T758 HydrophobicContact CG-CG2 4.37Å; E754-T758 WeakPolarHBondContact O-CB 3.31Å; E754-T758 WeakPolarHBondContact O-CG2 3.42Å; E754-T758 PolarHBondContact O-N 3.31Å; E754-T758 PolarHBondContact O-OG1 3.29Å; V755-T758 WeakPolarHBondContact CA-OG1 3.29Å; V755-T758 PolarHBondContact O-N 3.47Å; V755-T758 PolarHBondContact O-OG1 3.28Å; T758-N762 WeakPolarHBondContact O-CB 3.34Å
759	M	87.9	Confident	87	Confident	130 Å²	130	66.5 Å²	66.5	64%	0.64	34%	0.339	S	S	*	.	I	π-helix	trans	-85	-32.8	-179.1	-71.6	-69.2	179.5	0	0	113.4	V755 N763	V755-M759 HydrophobicContact CG1-CG 4.16Å; V755-M759 VanDerWaalsContact O-CB 3.28Å; V755-M759 WeakPolarHBondContact O-CB 3.42Å; V755-M759 WeakPolarHBondContact O-CG 3.5Å; V755-M759 PolarHBondContact O-N 2.87Å; M759-N763 PolarHBondContact O-ND2 2.76Å
760	V	88.3	Confident	86.2	Confident	34 Å²	34	77.4 Å²	77.4	21%	0.206	38%	0.38	C	S	.	.	I	π-helix	trans	-101.9	-59.6	-175.6	-175.1	0	0	0	0	111.1	L756 N763 I779 F783	L756-V760 VanDerWaalsContact O-CB 3.31Å; L756-V760 WeakPolarHBondContact O-CB 3.31Å; L756-V760 PolarHBondContact O-N 3.43Å; L756-V760 VanDerWaalsContact O-N 3.16Å; V760-N763 PolarHBondContact O-N 3.09Å; V760-I779 HydrophobicContact CG1-CG2 3.89Å; V760-I779 WeakPolarHBondContact O-CG2 3.38Å; V760-F783 HydrophobicContact CB-CD2 4.43Å; V760-F783 HydrophobicContact CG1-CB 4.04Å; V760-F783 HydrophobicContact CG1-CD2 4.49Å
761	M	85.8	Confident	85.5	Confident	14 Å²	14	79.3 Å²	79.3	7%	0.069	40%	0.402	C	S	.	.	I	π-helix	trans	-69.5	-40.5	-171.4	-167.4	62.4	81.9	0	0	112.2	W757 N763 G764 L765 F780 F783	W757-M761 HydrophobicContact CD2-CB 4.13Å; W757-M761 HydrophobicContact CD2-CG 4.26Å; W757-M761 HydrophobicContact CE3-CB 4.34Å; W757-M761 HydrophobicContact CE3-CG 4.27Å; W757-M761 HydrophobicContact CG-CB 4.42Å; W757-M761 HydrophobicContact CH2-CG 4.06Å; W757-M761 HydrophobicContact CZ2-CG 4.02Å; W757-M761 HydrophobicContact CZ3-CE 4.44Å; W757-M761 HydrophobicContact CZ3-CG 4.17Å; W757-M761 WeakPolarHBondContact O-CA 3.49Å; W757-M761 VanDerWaalsContact O-CB 3.29Å; W757-M761 WeakPolarHBondContact O-CB 3.21Å; W757-M761 PolarHBondContact O-N 3.04Å; M761-N763 VanDerWaalsContact C-N 3.31Å; M761-N763 PolarHBondContact O-N 3.06Å; M761-G764 PolarHBondContact O-N 2.8Å; M761-G764 VanDerWaalsContact O-N 3.11Å; M761-L765 HydrophobicContact CG-CD1 3.67Å; M761-L765 WeakPolarHBondContact O-CD1 3.3Å; M761-L765 PolarHBondContact O-N 3.5Å; M761-L765 VanDerWaalsContact O-N 3.09Å; M761-L765 HydrophobicContact SD-CD1 3.91Å; M761-F780 HydrophobicContact CE-CD2 3.59Å; M761-F780 HydrophobicContact CE-CE2 4.1Å; M761-F780 HydrophobicContact SD-CD2 4.45Å; M761-F783 HydrophobicContact CB-CD2 4.21Å; M761-F783 HydrophobicContact CB-CE2 4.32Å; M761-F783 HydrophobicContact CE-CB 4.09Å; M761-F783 HydrophobicContact CE-CD1 3.41Å; M761-F783 VanDerWaalsContact CE-CD1 3.41Å; M761-F783 HydrophobicContact CE-CD2 3.82Å; M761-F783 HydrophobicContact CE-CE1 3.72Å; M761-F783 HydrophobicContact CE-CE2 4.08Å; M761-F783 HydrophobicContact CE-CG 3.49Å; M761-F783 VanDerWaalsContact CE-CG 3.49Å; M761-F783 HydrophobicContact CE-CZ 4.06Å
762	N	86	Confident	85.1	Confident	67 Å²	67	77 Å²	77	36%	0.358	39%	0.393	S	S	.	.	H	α-helix	trans	-60	-39.4	179.9	-166.1	21.5	0	0	0	112.6	W757 T758 G764 L765 Q766	W757-N762 PolarHBondContact O-N 3.27Å; W757-N762 VanDerWaalsContact O-N 3.09Å; T758-N762 WeakPolarHBondContact O-CB 3.34Å; N762-G764 VanDerWaalsContact C-N 3.28Å; N762-G764 PolarHBondContact O-N 3.43Å; N762-L765 PolarHBondContact O-N 2.67Å; N762-Q766 PolarHBondContact ND2-NE2 2.77Å; N762-Q766 WeakPolarHBondContact O-CG 3.28Å; N762-Q766 PolarHBondContact O-N 3.31Å; N762-Q766 VanDerWaalsContact O-N 3.16Å; N762-Q766 PolarHBondContact OD1-NE2 2.88Å
763	N	84.1	Confident	84.6	Confident	91 Å²	91	79.9 Å²	79.9	49%	0.487	41%	0.408	S	S	.	.	H	α-helix	trans	-63.2	-36.8	177.4	-70.8	-6.1	0	0	0	111.5	M759 V760 M761	M759-N763 PolarHBondContact O-ND2 2.76Å; V760-N763 PolarHBondContact O-N 3.09Å; M761-N763 VanDerWaalsContact C-N 3.31Å; M761-N763 PolarHBondContact O-N 3.06Å
764	G	79.8	Confident	84.3	Confident	1 Å²	1	84.2 Å²	84.2	1%	0.01	43%	0.434	C	S	.	.	H	α-helix	trans	-65.7	-44.2	174	0	0	0	0	0	112.8	M761 N762 Q766 M767 V776	M761-G764 PolarHBondContact O-N 2.8Å; M761-G764 VanDerWaalsContact O-N 3.11Å; N762-G764 VanDerWaalsContact C-N 3.28Å; N762-G764 PolarHBondContact O-N 3.43Å; G764-Q766 VanDerWaalsContact C-N 3.32Å; G764-Q766 PolarHBondContact O-N 3.43Å; G764-M767 PolarHBondContact O-N 3.34Å; G764-V776 WeakPolarHBondContact O-CG2 3.38Å
765	L	82.5	Confident	84	Confident	112 Å²	112	82.8 Å²	82.8	59%	0.586	43%	0.432	S	S	*	.	H	α-helix	trans	-70.5	-23.4	-177.7	-87.4	80.6	0	0	0	114.1	M761 N762 M767	M761-L765 HydrophobicContact CG-CD1 3.67Å; M761-L765 WeakPolarHBondContact O-CD1 3.3Å; M761-L765 PolarHBondContact O-N 3.5Å; M761-L765 VanDerWaalsContact O-N 3.09Å; M761-L765 HydrophobicContact SD-CD1 3.91Å; N762-L765 PolarHBondContact O-N 2.67Å; L765-M767 VanDerWaalsContact C-N 3.34Å
766	Q	82.4	Confident	83.8	Confident	127 Å²	127	81.5 Å²	81.5	59%	0.593	42%	0.424	S	S	*	.	H	α-helix	trans	-77.3	-17.8	-179.5	-73.1	178.2	15	0	0	113.7	N762 G764 R768	N762-Q766 PolarHBondContact ND2-NE2 2.77Å; N762-Q766 WeakPolarHBondContact O-CG 3.28Å; N762-Q766 PolarHBondContact O-N 3.31Å; N762-Q766 VanDerWaalsContact O-N 3.16Å; N762-Q766 PolarHBondContact OD1-NE2 2.88Å; G764-Q766 VanDerWaalsContact C-N 3.32Å; G764-Q766 PolarHBondContact O-N 3.43Å; Q766-R768 PolarHBondContact O-N 3.48Å
767	M	78.9	Confident	83.7	Confident	115 Å²	115	87.9 Å²	87.9	57%	0.567	45%	0.452	S	S	*	.			trans	-76.4	109.6	-179.6	-61.4	-173	79.9	0	0	111.4	G764 L765	G764-M767 PolarHBondContact O-N 3.34Å; L765-M767 VanDerWaalsContact C-N 3.34Å
768	R	79.5	Confident	83.6	Confident	249 Å²	249	89.8 Å²	89.8	94%	0.94	47%	0.465	S	S	*	.			trans	-88.1	134.6	175.3	-66.5	-177.7	175.9	170.2	-0.5	111.5	Q766	Q766-R768 PolarHBondContact O-N 3.48Å
769	G	83	Confident	83.6	Confident	49 Å²	49	89.1 Å²	89.1	51%	0.505	46%	0.459	S	S	.	.	S	Bend	trans	130.3	173	172	0	0	0	0	0	114.4	G771 G772	G769-G771 VanDerWaalsContact C-N 3.34Å; G769-G771 PolarHBondContact O-N 3.11Å; G769-G772 WeakPolarHBondContact O-CA 3.46Å; G769-G772 PolarHBondContact O-N 3.4Å
770	W	74.8	Confident	83.8	Confident	235 Å²	235	88.2 Å²	88.2	89%	0.89	45%	0.452	S	S	*	.	H	α-helix	trans	-64.3	-35.1	178.2	-83.4	43.9	0	0	0	112.8	G772 I773	W770-G772 PolarHBondContact O-N 3.09Å; W770-I773 PolarHBondContact O-N 2.81Å
771	G	77.6	Confident	83.9	Confident	60 Å²	60	88.8 Å²	88.8	62%	0.619	46%	0.46	S	S	*	.	H	α-helix	trans	-65.7	-24.1	169.8	0	0	0	0	0	113.4	G769 I773 V774 G775	G769-G771 VanDerWaalsContact C-N 3.34Å; G769-G771 PolarHBondContact O-N 3.11Å; G771-I773 VanDerWaalsContact C-N 3.31Å; G771-I773 PolarHBondContact O-N 3.34Å; G771-V774 PolarHBondContact O-N 3.44Å; G771-G775 PolarHBondContact O-N 3.17Å
772	G	80.9	Confident	84.1	Confident	8 Å²	8	91.8 Å²	91.8	8%	0.082	48%	0.479	C	S	.	.	H	α-helix	trans	-65.7	-31	173.8	0	0	0	0	0	112.8	G769 W770 G775 V776	G769-G772 WeakPolarHBondContact O-CA 3.46Å; G769-G772 PolarHBondContact O-N 3.4Å; W770-G772 PolarHBondContact O-N 3.09Å; G772-G775 PolarHBondContact O-N 3.3Å; G772-V776 WeakPolarHBondContact O-CB 3.4Å; G772-V776 WeakPolarHBondContact O-CG2 3.3Å; G772-V776 PolarHBondContact O-N 3.38Å
773	I	82.1	Confident	84.4	Confident	120 Å²	120	89.2 Å²	89.2	62%	0.615	47%	0.465	S	S	*	.	H	α-helix	trans	-65.2	-45.2	177.2	-60	172.7	0	0	0	110.5	W770 G771 F777	W770-I773 PolarHBondContact O-N 2.81Å; G771-I773 VanDerWaalsContact C-N 3.31Å; G771-I773 PolarHBondContact O-N 3.34Å; I773-F777 PolarHBondContact O-N 3.45Å; I773-F777 VanDerWaalsContact O-N 3.12Å
774	V	84.4	Confident	84.7	Confident	95 Å²	95	86.5 Å²	86.5	58%	0.576	46%	0.455	S	S	*	.	H	α-helix	trans	-67.7	-41.5	176.8	-178.3	0	0	0	0	110.6	G771 F777 I778	G771-V774 PolarHBondContact O-N 3.44Å; V774-F777 PolarHBondContact O-N 3.31Å; V774-I778 HydrophobicContact CG1-CD1 4.25Å; V774-I778 WeakPolarHBondContact O-CG1 3.48Å; V774-I778 PolarHBondContact O-N 3.38Å; V774-I778 VanDerWaalsContact O-N 3.17Å
775	G	84	Confident	85.3	Confident	18 Å²	18	91.3 Å²	91.3	19%	0.186	48%	0.484	C	S	.	.	H	α-helix	trans	-59.7	-45.8	175.2	0	0	0	0	0	113	G771 G772 F777 I778 I779	G771-G775 PolarHBondContact O-N 3.17Å; G772-G775 PolarHBondContact O-N 3.3Å; G775-F777 VanDerWaalsContact C-N 3.33Å; G775-F777 PolarHBondContact O-N 3.12Å; G775-I778 PolarHBondContact O-N 3Å; G775-I779 WeakPolarHBondContact O-CB 3.47Å; G775-I779 VanDerWaalsContact O-CG1 3.27Å; G775-I779 WeakPolarHBondContact O-CG1 3.47Å; G775-I779 PolarHBondContact O-N 3.07Å
776	V	87.9	Confident	85.8	Confident	53 Å²	53	89 Å²	89	32%	0.321	47%	0.472	S	S	.	.	H	α-helix	trans	-61.4	-40.8	176.5	168.8	0	0	0	0	111.2	G764 G772 I779 F780	G764-V776 WeakPolarHBondContact O-CG2 3.38Å; G772-V776 WeakPolarHBondContact O-CB 3.4Å; G772-V776 WeakPolarHBondContact O-CG2 3.3Å; G772-V776 PolarHBondContact O-N 3.38Å; V776-I779 PolarHBondContact O-N 3.18Å; V776-F780 WeakPolarHBondContact O-CB 3.47Å; V776-F780 PolarHBondContact O-N 3.38Å
777	F	88.3	Confident	86.2	Confident	152 Å²	152	83.2 Å²	83.2	67%	0.667	45%	0.445	S	S	*	.	H	α-helix	trans	-61.8	-45.3	178	-178.2	-98.9	0	0	0	112.4	I773 V774 G775 F780 A781	I773-F777 PolarHBondContact O-N 3.45Å; I773-F777 VanDerWaalsContact O-N 3.12Å; V774-F777 PolarHBondContact O-N 3.31Å; G775-F777 VanDerWaalsContact C-N 3.33Å; G775-F777 PolarHBondContact O-N 3.12Å; F777-F780 PolarHBondContact O-N 3.42Å; F777-A781 PolarHBondContact O-N 3.1Å
778	I	88.9	Confident	86.8	Confident	101 Å²	101	81 Å²	81	52%	0.518	44%	0.438	S	S	.	.	H	α-helix	trans	-66.2	-45.9	178.3	-64.5	170.4	0	0	0	110.7	V774 G775 F780 A781 V782	V774-I778 HydrophobicContact CG1-CD1 4.25Å; V774-I778 WeakPolarHBondContact O-CG1 3.48Å; V774-I778 PolarHBondContact O-N 3.38Å; V774-I778 VanDerWaalsContact O-N 3.17Å; G775-I778 PolarHBondContact O-N 3Å; I778-F780 VanDerWaalsContact C-N 3.3Å; I778-F780 PolarHBondContact O-N 3.1Å; I778-A781 WeakPolarHBondContact O-CB 3.47Å; I778-A781 PolarHBondContact O-N 3.19Å; I778-V782 PolarHBondContact O-N 3.06Å
779	I	89.8	Confident	87.4	Confident	41 Å²	41	71.4 Å²	71.4	21%	0.21	41%	0.412	C	S	.	.	H	α-helix	trans	-63.6	-38.7	178.6	-68.4	168.1	0	0	0	110.8	V760 G775 V776 V782 F783	V760-I779 HydrophobicContact CG1-CG2 3.89Å; V760-I779 WeakPolarHBondContact O-CG2 3.38Å; G775-I779 WeakPolarHBondContact O-CB 3.47Å; G775-I779 VanDerWaalsContact O-CG1 3.27Å; G775-I779 WeakPolarHBondContact O-CG1 3.47Å; G775-I779 PolarHBondContact O-N 3.07Å; V776-I779 PolarHBondContact O-N 3.18Å; I779-V782 PolarHBondContact O-N 3.48Å; I779-F783 WeakPolarHBondContact O-CB 3.37Å; I779-F783 PolarHBondContact O-N 3.06Å
780	F	90.5	Very high	87.8	Confident	111 Å²	111	71.8 Å²	71.8	49%	0.487	40%	0.401	S	S	.	.	H	α-helix	trans	-63.6	-40.9	174.1	-179.1	-92.8	0	0	0	111.8	M761 V776 F777 I778 V782 F783 A784	M761-F780 HydrophobicContact CE-CD2 3.59Å; M761-F780 HydrophobicContact CE-CE2 4.1Å; M761-F780 HydrophobicContact SD-CD2 4.45Å; V776-F780 WeakPolarHBondContact O-CB 3.47Å; V776-F780 PolarHBondContact O-N 3.38Å; F777-F780 PolarHBondContact O-N 3.42Å; I778-F780 VanDerWaalsContact C-N 3.3Å; I778-F780 PolarHBondContact O-N 3.1Å; F780-V782 VanDerWaalsContact C-N 3.34Å; F780-V782 PolarHBondContact O-N 3.43Å; F780-F783 WeakPolarHBondContact O-CB 3.44Å; F780-F783 PolarHBondContact O-N 3.19Å; F780-A784 HydrophobicContact CE1-CB 4.45Å; F780-A784 WeakPolarHBondContact O-CB 3.41Å; F780-A784 PolarHBondContact O-N 2.88Å
781	A	91.1	Very high	88.5	Confident	46 Å²	46	60.6 Å²	60.6	38%	0.38	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-43.4	175.7	0	0	0	0	0	111.6	F777 I778 A784 V785	F777-A781 PolarHBondContact O-N 3.1Å; I778-A781 WeakPolarHBondContact O-CB 3.47Å; I778-A781 PolarHBondContact O-N 3.19Å; A781-A784 PolarHBondContact O-N 3.16Å; A781-V785 WeakPolarHBondContact O-CG2 3.47Å; A781-V785 PolarHBondContact O-N 3.26Å
782	V	91	Very high	89.2	Confident	76 Å²	76	58.9 Å²	58.9	46%	0.461	34%	0.336	S	S	.	.	H	α-helix	trans	-63.4	-45.6	174.4	175.5	0	0	0	0	111.1	I778 I779 F780 A784 V785 L786	I778-V782 PolarHBondContact O-N 3.06Å; I779-V782 PolarHBondContact O-N 3.48Å; F780-V782 VanDerWaalsContact C-N 3.34Å; F780-V782 PolarHBondContact O-N 3.43Å; V782-A784 VanDerWaalsContact C-N 3.32Å; V782-A784 PolarHBondContact O-N 2.8Å; V782-V785 PolarHBondContact O-N 2.88Å; V782-L786 HydrophobicContact CG1-CD1 3.88Å; V782-L786 HydrophobicContact CG1-CG 4.35Å; V782-L786 WeakPolarHBondContact O-CB 3.49Å; V782-L786 WeakPolarHBondContact O-CG 3.3Å; V782-L786 PolarHBondContact O-N 3.48Å
783	F	90.8	Very high	89.6	Confident	14 Å²	14	63.3 Å²	63.3	6%	0.061	36%	0.356	C	S	.	.	H	α-helix	trans	-56.8	-45	175	173	-87.8	0	0	0	111.7	L756 W757 V760 M761 I779 F780 L786 T787	L756-F783 HydrophobicContact CD2-CD2 3.17Å; L756-F783 HydrophobicContact CD2-CE2 3.12Å; L756-F783 HydrophobicContact CD2-CG 4.09Å; L756-F783 HydrophobicContact CD2-CZ 4Å; W757-F783 HydrophobicContact CE3-CE2 4.18Å; W757-F783 AromaticContact CE3-CZ 3.99Å; W757-F783 HydrophobicContact CE3-CZ 3.99Å; W757-F783 HydrophobicContact CZ3-CZ 4.35Å; V760-F783 HydrophobicContact CB-CD2 4.43Å; V760-F783 HydrophobicContact CG1-CB 4.04Å; V760-F783 HydrophobicContact CG1-CD2 4.49Å; M761-F783 HydrophobicContact CB-CD2 4.21Å; M761-F783 HydrophobicContact CB-CE2 4.32Å; M761-F783 HydrophobicContact CE-CB 4.09Å; M761-F783 HydrophobicContact CE-CD1 3.41Å; M761-F783 VanDerWaalsContact CE-CD1 3.41Å; M761-F783 HydrophobicContact CE-CD2 3.82Å; M761-F783 HydrophobicContact CE-CE1 3.72Å; M761-F783 HydrophobicContact CE-CE2 4.08Å; M761-F783 HydrophobicContact CE-CG 3.49Å; M761-F783 VanDerWaalsContact CE-CG 3.49Å; M761-F783 HydrophobicContact CE-CZ 4.06Å; I779-F783 WeakPolarHBondContact O-CB 3.37Å; I779-F783 PolarHBondContact O-N 3.06Å; F780-F783 WeakPolarHBondContact O-CB 3.44Å; F780-F783 PolarHBondContact O-N 3.19Å; F783-L786 PolarHBondContact O-N 3.46Å; F783-T787 VanDerWaalsContact O-CB 3.26Å; F783-T787 WeakPolarHBondContact O-CB 3.33Å; F783-T787 PolarHBondContact O-N 3.45Å; F783-T787 PolarHBondContact O-OG1 3.12Å
784	A	90.9	Very high	90.1	Very high	34 Å²	34	63.2 Å²	63.2	28%	0.281	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-45.1	-180	0	0	0	0	0	111.6	F780 A781 V782 T787 V788	F780-A784 HydrophobicContact CE1-CB 4.45Å; F780-A784 WeakPolarHBondContact O-CB 3.41Å; F780-A784 PolarHBondContact O-N 2.88Å; A781-A784 PolarHBondContact O-N 3.16Å; V782-A784 VanDerWaalsContact C-N 3.32Å; V782-A784 PolarHBondContact O-N 2.8Å; A784-T787 PolarHBondContact O-N 3.35Å; A784-V788 WeakPolarHBondContact O-CG2 3.34Å; A784-V788 PolarHBondContact O-N 2.94Å
785	V	92.9	Very high	90.4	Very high	102 Å²	102	60.7 Å²	60.7	62%	0.618	34%	0.337	S	S	*	.	H	α-helix	trans	-62.4	-46.4	177.1	171.6	0	0	0	0	111.2	A781 V782 T787 V788 A789	A781-V785 WeakPolarHBondContact O-CG2 3.47Å; A781-V785 PolarHBondContact O-N 3.26Å; V782-V785 PolarHBondContact O-N 2.88Å; V785-T787 VanDerWaalsContact C-N 3.33Å; V785-T787 PolarHBondContact O-N 3.45Å; V785-V788 PolarHBondContact O-N 3.18Å; V785-A789 WeakPolarHBondContact O-CB 3.41Å; V785-A789 PolarHBondContact O-N 3.39Å
786	L	91.7	Very high	90.8	Very high	62 Å²	62	60.1 Å²	60.1	33%	0.325	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-39	178.2	-68.9	174.6	0	0	0	111.9	L756 V782 F783 I790	L756-L786 HydrophobicContact CD1-CB 4.07Å; V782-L786 HydrophobicContact CG1-CD1 3.88Å; V782-L786 HydrophobicContact CG1-CG 4.35Å; V782-L786 WeakPolarHBondContact O-CB 3.49Å; V782-L786 WeakPolarHBondContact O-CG 3.3Å; V782-L786 PolarHBondContact O-N 3.48Å; F783-L786 PolarHBondContact O-N 3.46Å; L786-I790 HydrophobicContact CD2-CD1 4.05Å; L786-I790 WeakPolarHBondContact O-CB 3.29Å; L786-I790 PolarHBondContact O-N 3.16Å
787	T	92	Very high	91	Very high	7 Å²	7	62 Å²	62	4%	0.043	34%	0.339	C	S	.	.	I	π-helix	trans	-64.7	-44.3	176.7	-59.2	0	0	0	0	111.2	H414 F470 F783 A784 V785 L791 L792	H414-T787 VanDerWaalsContact NE2-CG2 3.32Å; H414-T787 WeakPolarHBondContact NE2-CG2 3.32Å; F470-T787 HydrophobicContact CE1-CG2 4.35Å; F783-T787 VanDerWaalsContact O-CB 3.26Å; F783-T787 WeakPolarHBondContact O-CB 3.33Å; F783-T787 PolarHBondContact O-N 3.45Å; F783-T787 PolarHBondContact O-OG1 3.12Å; A784-T787 PolarHBondContact O-N 3.35Å; V785-T787 VanDerWaalsContact C-N 3.33Å; V785-T787 PolarHBondContact O-N 3.45Å; T787-L791 HydrophobicContact CG2-CB 4.38Å; T787-L791 HydrophobicContact CG2-CD1 4.09Å; T787-L791 WeakPolarHBondContact O-CA 3.49Å; T787-L791 VanDerWaalsContact O-CB 3.3Å; T787-L791 WeakPolarHBondContact O-CB 3.17Å; T787-L791 PolarHBondContact O-N 3.3Å; T787-L791 VanDerWaalsContact O-N 3.14Å; T787-L792 PolarHBondContact O-N 3.25Å
788	V	91.6	Very high	91.2	Very high	69 Å²	69	56.7 Å²	56.7	42%	0.418	32%	0.321	S	S	.	.	I	π-helix	trans	-66.8	-47.6	178.1	173.2	0	0	0	0	111.3	A784 V785 L792 I793	A784-V788 WeakPolarHBondContact O-CG2 3.34Å; A784-V788 PolarHBondContact O-N 2.94Å; V785-V788 PolarHBondContact O-N 3.18Å; V788-L792 HydrophobicContact CG2-CD1 4.2Å; V788-L792 WeakPolarHBondContact O-CB 3.14Å; V788-I793 HydrophobicContact CG1-CD1 4.35Å; V788-I793 WeakPolarHBondContact O-CG1 3.4Å; V788-I793 PolarHBondContact O-N 3.47Å
789	A	91.2	Very high	91.4	Very high	46 Å²	46	52 Å²	52	38%	0.38	30%	0.297	S	S	.	.	I	π-helix	trans	-71.1	-48.7	-175.1	0	0	0	0	0	113	V785 M794	V785-A789 WeakPolarHBondContact O-CB 3.41Å; V785-A789 PolarHBondContact O-N 3.39Å; A789-M794 PolarHBondContact O-N 3.39Å
790	I	91.4	Very high	91.6	Very high	57 Å²	57	52 Å²	52	29%	0.292	30%	0.296	S	S	.	.	I	π-helix	trans	-88.8	-54.5	-172.2	-57.6	176.7	0	0	0	110.5	L752 L786 M794 E795	L752-I790 HydrophobicContact CD2-CG2 4.12Å; L786-I790 HydrophobicContact CD2-CD1 4.05Å; L786-I790 WeakPolarHBondContact O-CB 3.29Å; L786-I790 PolarHBondContact O-N 3.16Å; I790-M794 HydrophobicContact CG1-CE 4.42Å; I790-M794 HydrophobicContact CG2-CE 4.24Å; I790-M794 WeakPolarHBondContact O-CB 3.16Å; I790-M794 PolarHBondContact O-N 3.27Å; I790-E795 PolarHBondContact O-N 3.42Å; I790-E795 VanDerWaalsContact O-N 3.1Å
791	L	90.4	Very high	91.7	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	30%	0.296	C	S	.	.	I	π-helix	trans	-77.1	-43.9	-173.1	-71.8	164.2	0	0	0	112.3	F409 L752 L756 T787 E795	F409-L791 VanDerWaalsContact CE2-O 3.23Å; F409-L791 WeakPolarHBondContact CE2-O 3.42Å; L752-L791 HydrophobicContact CB-CD2 4.11Å; L752-L791 HydrophobicContact CD2-CD1 4.39Å; L752-L791 HydrophobicContact CD2-CD2 3.44Å; L752-L791 VanDerWaalsContact CD2-CD2 3.44Å; L752-L791 HydrophobicContact CD2-CG 3.82Å; L752-L791 HydrophobicContact CG-CD2 4.29Å; L756-L791 HydrophobicContact CD1-CD1 3.95Å; T787-L791 HydrophobicContact CG2-CB 4.38Å; T787-L791 HydrophobicContact CG2-CD1 4.09Å; T787-L791 WeakPolarHBondContact O-CA 3.49Å; T787-L791 VanDerWaalsContact O-CB 3.3Å; T787-L791 WeakPolarHBondContact O-CB 3.17Å; T787-L791 PolarHBondContact O-N 3.3Å; T787-L791 VanDerWaalsContact O-N 3.14Å; L791-E795 WeakPolarHBondContact O-CB 3.43Å
792	L	90.9	Very high	91.9	Very high	23 Å²	23	51.4 Å²	51.4	12%	0.12	29%	0.289	C	S	.	.	I	π-helix	trans	-82.6	-48.8	-177.9	-85	156.4	0	0	0	113.1	F409 H414 V417 M418 T787 V788 G796	F409-L792 HydrophobicContact CE1-CD2 4.3Å; F409-L792 HydrophobicContact CZ-CD2 4.09Å; H414-L792 HydrophobicContact CB-CD2 4.08Å; H414-L792 HydrophobicContact CB-CG 4.4Å; V417-L792 HydrophobicContact CB-CD1 4.02Å; V417-L792 HydrophobicContact CG1-CD1 3.73Å; M418-L792 HydrophobicContact CB-CD2 4.3Å; M418-L792 HydrophobicContact CE-CD2 4.04Å; T787-L792 PolarHBondContact O-N 3.25Å; V788-L792 HydrophobicContact CG2-CD1 4.2Å; V788-L792 WeakPolarHBondContact O-CB 3.14Å; L792-G796 VanDerWaalsContact O-CA 3.3Å; L792-G796 WeakPolarHBondContact O-CA 3.46Å; L792-G796 PolarHBondContact O-N 3.46Å
793	I	90.7	Very high	92	Very high	101 Å²	101	47.8 Å²	47.8	52%	0.518	27%	0.267	S	S	.	.	I	π-helix	trans	-80	-59.2	-175.3	-64.6	170.9	0	0	0	111.4	V788 L797	V788-I793 HydrophobicContact CG1-CD1 4.35Å; V788-I793 WeakPolarHBondContact O-CG1 3.4Å; V788-I793 PolarHBondContact O-N 3.47Å; I793-L797 WeakPolarHBondContact O-CB 3.24Å; I793-L797 PolarHBondContact O-N 3.25Å
794	M	91.1	Very high	92.1	Very high	119 Å²	119	48 Å²	48	59%	0.586	27%	0.268	S	S	*	.	I	π-helix	trans	-69.9	-53.4	-173.9	-65.1	-150.2	-61	0	0	113	A789 I790 L797 S798	A789-M794 PolarHBondContact O-N 3.39Å; I790-M794 HydrophobicContact CG1-CE 4.42Å; I790-M794 HydrophobicContact CG2-CE 4.24Å; I790-M794 WeakPolarHBondContact O-CB 3.16Å; I790-M794 PolarHBondContact O-N 3.27Å; M794-L797 PolarHBondContact O-N 3.37Å; M794-S798 WeakPolarHBondContact O-CB 3.28Å; M794-S798 PolarHBondContact O-N 2.97Å
795	E	92.3	Very high	92.2	Very high	41 Å²	41	52.2 Å²	52.2	19%	0.192	28%	0.277	C	S	.	.	I	π-helix	trans	-67.7	-37.1	178.3	-77.1	-71	168.8	0	0	111.9	I790 L791 S798 A799	I790-E795 PolarHBondContact O-N 3.42Å; I790-E795 VanDerWaalsContact O-N 3.1Å; L791-E795 WeakPolarHBondContact O-CB 3.43Å; E795-S798 PolarHBondContact O-N 3.46Å; E795-A799 WeakPolarHBondContact O-CB 3.32Å; E795-A799 PolarHBondContact O-N 3.13Å
796	G	91.7	Very high	92.2	Very high	7 Å²	7	47.3 Å²	47.3	7%	0.072	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-43.2	173.9	0	0	0	0	0	112.7	F405 L792 F800	F405-G796 WeakPolarHBondContact CE2-O 3.42Å; L792-G796 VanDerWaalsContact O-CA 3.3Å; L792-G796 WeakPolarHBondContact O-CA 3.46Å; L792-G796 PolarHBondContact O-N 3.46Å; G796-F800 VanDerWaalsContact O-CB 3.29Å; G796-F800 WeakPolarHBondContact O-CB 3.34Å; G796-F800 PolarHBondContact O-N 3.12Å
797	L	91.9	Very high	92.2	Very high	91 Å²	91	44.6 Å²	44.6	48%	0.476	23%	0.233	S	C	.	.	H	α-helix	trans	-67.2	-40.2	175.6	-174.5	67.2	0	0	0	111.9	I793 M794 F800 L801	I793-L797 WeakPolarHBondContact O-CB 3.24Å; I793-L797 PolarHBondContact O-N 3.25Å; M794-L797 PolarHBondContact O-N 3.37Å; L797-F800 HydrophobicContact CD1-CD1 4.4Å; L797-F800 WeakPolarHBondContact O-CB 3.43Å; L797-F800 PolarHBondContact O-N 3.19Å; L797-L801 HydrophobicContact CG-CD1 4.48Å; L797-L801 WeakPolarHBondContact O-CG 3.27Å; L797-L801 PolarHBondContact O-N 3.41Å
798	S	92.5	Very high	92.2	Very high	42 Å²	42	47.3 Å²	47.3	29%	0.294	24%	0.243	S	C	.	.	H	α-helix	trans	-59.1	-51.7	175	179.7	0	0	0	0	111.5	M794 E795 F800 L801 H802	M794-S798 WeakPolarHBondContact O-CB 3.28Å; M794-S798 PolarHBondContact O-N 2.97Å; E795-S798 PolarHBondContact O-N 3.46Å; S798-F800 VanDerWaalsContact C-N 3.31Å; S798-F800 PolarHBondContact O-N 3.19Å; S798-L801 PolarHBondContact O-N 2.97Å; S798-H802 PolarHBondContact O-CD2 2.85Å; S798-H802 PolarHBondContact O-N 3.13Å
799	A	93.8	Very high	92.1	Very high	2 Å²	2	46.7 Å²	46.7	2%	0.017	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-37.3	177	0	0	0	0	0	112.1	F405 M408 F409 L745 E795 H802 A803	F405-A799 HydrophobicContact CD2-CB 3.87Å; F405-A799 HydrophobicContact CE2-CB 3.63Å; M408-A799 HydrophobicContact CB-CB 3.94Å; F409-A799 HydrophobicContact CB-CB 4.41Å; L745-A799 HydrophobicContact CD2-CB 4.28Å; E795-A799 WeakPolarHBondContact O-CB 3.32Å; E795-A799 PolarHBondContact O-N 3.13Å; A799-H802 PolarHBondContact O-N 2.89Å; A799-A803 WeakPolarHBondContact O-CB 3.49Å; A799-A803 PolarHBondContact O-N 3.13Å
800	F	93.4	Very high	92.1	Very high	41 Å²	41	44.6 Å²	44.6	18%	0.18	22%	0.221	C	C	.	.	H	α-helix	trans	-59.8	-50.3	174	170.7	-89.5	0	0	0	111.7	I379 F401 F405 L451 M455 G796 L797 S798 H802 A803 L804	I379-F800 HydrophobicContact CD1-CE2 4.49Å; I379-F800 HydrophobicContact CD1-CZ 4.22Å; F401-F800 AromaticContact CE1-CD2 3.74Å; F401-F800 HydrophobicContact CE1-CD2 3.74Å; F401-F800 AromaticContact CE1-CE2 3.58Å; F401-F800 HydrophobicContact CE1-CE2 3.58Å; F401-F800 HydrophobicContact CE2-CE2 4.45Å; F401-F800 AromaticContact CZ-CD2 3.34Å; F401-F800 HydrophobicContact CZ-CD2 3.34Å; F401-F800 AromaticContact CZ-CE2 3.29Å; F401-F800 HydrophobicContact CZ-CE2 3.29Å; F401-F800 HydrophobicContact CZ-CG 4.14Å; F401-F800 HydrophobicContact CZ-CZ 4.09Å; F405-F800 HydrophobicContact CD2-CB 4.37Å; F405-F800 HydrophobicContact CE2-CB 4.36Å; L451-F800 HydrophobicContact CD1-CE2 4.15Å; L451-F800 HydrophobicContact CD2-CD2 4.15Å; L451-F800 HydrophobicContact CD2-CE2 3.66Å; M455-F800 HydrophobicContact CE-CB 4.29Å; M455-F800 HydrophobicContact CE-CD2 3.94Å; M455-F800 HydrophobicContact SD-CD2 4.08Å; G796-F800 VanDerWaalsContact O-CB 3.29Å; G796-F800 WeakPolarHBondContact O-CB 3.34Å; G796-F800 PolarHBondContact O-N 3.12Å; L797-F800 HydrophobicContact CD1-CD1 4.4Å; L797-F800 WeakPolarHBondContact O-CB 3.43Å; L797-F800 PolarHBondContact O-N 3.19Å; S798-F800 VanDerWaalsContact C-N 3.31Å; S798-F800 PolarHBondContact O-N 3.19Å; F800-H802 PolarHBondContact O-N 3.18Å; F800-A803 PolarHBondContact O-N 3.3Å; F800-L804 HydrophobicContact CE1-CD1 4.15Å; F800-L804 HydrophobicContact CZ-CD1 4.23Å; F800-L804 WeakPolarHBondContact O-CB 3.37Å; F800-L804 PolarHBondContact O-N 2.72Å
801	L	92.8	Very high	92	Very high	93 Å²	93	42 Å²	42	49%	0.487	21%	0.208	S	C	.	.	H	α-helix	trans	-66	-38.1	179.9	-70.7	175.5	0	0	0	112.3	L797 S798 L804 R805	L797-L801 HydrophobicContact CG-CD1 4.48Å; L797-L801 WeakPolarHBondContact O-CG 3.27Å; L797-L801 PolarHBondContact O-N 3.41Å; S798-L801 PolarHBondContact O-N 2.97Å; L801-L804 PolarHBondContact O-N 3.21Å; L801-R805 WeakPolarHBondContact O-CB 3.49Å; L801-R805 PolarHBondContact O-N 3.29Å
802	H	94.2	Very high	91.9	Very high	52 Å²	52	42 Å²	42	24%	0.241	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-38.9	175.6	-79	-63.4	0	0	0	112.7	M408 L745 S798 A799 F800 L804 R805 L806	M408-H802 HydrophobicContact CE-CB 3.72Å; M408-H802 HydrophobicContact SD-CB 3.99Å; L745-H802 HydrophobicContact CD2-CB 4.33Å; S798-H802 PolarHBondContact O-CD2 2.85Å; S798-H802 PolarHBondContact O-N 3.13Å; A799-H802 PolarHBondContact O-N 2.89Å; F800-H802 PolarHBondContact O-N 3.18Å; H802-L804 VanDerWaalsContact C-N 3.28Å; H802-L804 PolarHBondContact O-N 3.15Å; H802-R805 PolarHBondContact O-N 3.15Å; H802-L806 WeakPolarHBondContact O-CG 3.04Å; H802-L806 PolarHBondContact O-N 3.38Å; H802-L806 VanDerWaalsContact O-N 3.16Å
803	A	93.6	Very high	91.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-37	172.9	0	0	0	0	0	111.4	F401 L404 F405 A799 F800 L806 H807	F401-A803 HydrophobicContact CD2-CB 4.27Å; F401-A803 HydrophobicContact CE2-CB 3.84Å; F401-A803 HydrophobicContact CZ-CB 4.4Å; L404-A803 HydrophobicContact CB-CB 4.45Å; F405-A803 HydrophobicContact CB-CB 4.21Å; A799-A803 WeakPolarHBondContact O-CB 3.49Å; A799-A803 PolarHBondContact O-N 3.13Å; F800-A803 PolarHBondContact O-N 3.3Å; A803-L806 PolarHBondContact O-N 3.31Å; A803-H807 PolarHBondContact O-N 3.19Å; A803-H807 PolarHBondContact O-ND1 3.31Å
804	L	92.4	Very high	91.4	Very high	17 Å²	17	40.6 Å²	40.6	9%	0.089	20%	0.2	C	C	.	.	H	α-helix	trans	-69.1	-42.6	179.3	175.4	153.5	0	0	0	110.6	I379 F401 F800 L801 H802 L806 H807 W808	I379-L804 HydrophobicContact CG2-CD1 3.74Å; I379-L804 HydrophobicContact CG2-CG 4.34Å; F401-L804 HydrophobicContact CE2-CB 3.71Å; F401-L804 HydrophobicContact CZ-CB 4.44Å; F800-L804 HydrophobicContact CE1-CD1 4.15Å; F800-L804 HydrophobicContact CZ-CD1 4.23Å; F800-L804 WeakPolarHBondContact O-CB 3.37Å; F800-L804 PolarHBondContact O-N 2.72Å; L801-L804 PolarHBondContact O-N 3.21Å; H802-L804 VanDerWaalsContact C-N 3.28Å; H802-L804 PolarHBondContact O-N 3.15Å; L804-L806 VanDerWaalsContact C-N 3.32Å; L804-L806 PolarHBondContact O-N 3.08Å; L804-H807 WeakPolarHBondContact O-CB 3.45Å; L804-H807 PolarHBondContact O-N 3.22Å; L804-W808 HydrophobicContact CD1-CH2 4.23Å; L804-W808 HydrophobicContact CD1-CZ2 3.84Å; L804-W808 HydrophobicContact CD2-CD2 3.35Å; L804-W808 VanDerWaalsContact CD2-CE2 3.43Å; L804-W808 HydrophobicContact CD2-CE3 3.31Å; L804-W808 HydrophobicContact CD2-CG 4.19Å; L804-W808 HydrophobicContact CD2-CH2 3.52Å; L804-W808 HydrophobicContact CD2-CZ2 3.53Å; L804-W808 HydrophobicContact CD2-CZ3 3.39Å; L804-W808 HydrophobicContact CG-CD2 4.08Å; L804-W808 HydrophobicContact CG-CE3 4.46Å; L804-W808 HydrophobicContact CG-CH2 4.3Å; L804-W808 HydrophobicContact CG-CZ2 3.87Å; L804-W808 PolarHBondContact O-N 2.96Å
805	R	93.7	Very high	91.1	Very high	123 Å²	123	35.4 Å²	35.4	46%	0.464	18%	0.175	S	C	.	.	H	α-helix	trans	-56.2	-45.7	173.8	-177	173.5	179.7	170.9	2.4	112.1	L801 H802 H807 W808 V809	L801-R805 WeakPolarHBondContact O-CB 3.49Å; L801-R805 PolarHBondContact O-N 3.29Å; H802-R805 PolarHBondContact O-N 3.15Å; R805-H807 PolarHBondContact O-N 3.35Å; R805-W808 PolarHBondContact O-N 2.97Å; R805-W808 VanDerWaalsContact O-N 3.17Å; R805-V809 HydrophobicContact CG-CG2 4.37Å; R805-V809 PolarHBondContact O-N 3.07Å
806	L	93.1	Very high	90.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.169	C	C	.	.	I	π-helix	trans	-57.1	-29.5	176	-69.1	174.5	0	0	0	113	L404 M408 Y739 L742 H802 A803 L804 E810 F811	L404-L806 HydrophobicContact CD1-CB 4.29Å; L404-L806 HydrophobicContact CD1-CD1 4.28Å; M408-L806 HydrophobicContact CE-CD1 4Å; Y739-L806 HydrophobicContact CD1-CD1 4.07Å; Y739-L806 HydrophobicContact CD1-CD2 3.85Å; Y739-L806 HydrophobicContact CE1-CB 4.38Å; Y739-L806 HydrophobicContact CE1-CD1 4.1Å; Y739-L806 HydrophobicContact CE1-CD2 3.84Å; Y739-L806 HydrophobicContact CE1-CG 4.33Å; Y739-L806 HydrophobicContact CG-CD2 4.3Å; L742-L806 HydrophobicContact CD1-CD1 4.47Å; L742-L806 HydrophobicContact CD2-CD1 3.8Å; L742-L806 HydrophobicContact CG-CD1 3.94Å; H802-L806 WeakPolarHBondContact O-CG 3.04Å; H802-L806 PolarHBondContact O-N 3.38Å; H802-L806 VanDerWaalsContact O-N 3.16Å; A803-L806 PolarHBondContact O-N 3.31Å; L804-L806 VanDerWaalsContact C-N 3.32Å; L804-L806 PolarHBondContact O-N 3.08Å; L806-E810 WeakPolarHBondContact CA-OE2 3.38Å; L806-E810 HydrophobicContact CD2-CG 4.28Å; L806-E810 WeakPolarHBondContact O-CB 3.17Å; L806-F811 PolarHBondContact O-N 3.06Å
807	H	91.7	Very high	90.2	Very high	5 Å²	5	38.5 Å²	38.5	2%	0.023	19%	0.193	C	C	.	.	I	π-helix	trans	-81.3	-42.3	176.3	-73.1	79	0	0	0	112.4	T400 F401 Q551 A803 L804 R805 F811 Q812	T400-H807 PolarHBondContact OG1-NE2 3.09Å; F401-H807 VanDerWaalsContact CA-CE1 3.41Å; F401-H807 WeakPolarHBondContact CA-CE1 3.15Å; F401-H807 AromaticContact CD2-ND1 3.8Å; F401-H807 PolarHBondContact N-NE2 3.49Å; Q551-H807 PolarHBondContact NE2-NE2 3.3Å; A803-H807 PolarHBondContact O-N 3.19Å; A803-H807 PolarHBondContact O-ND1 3.31Å; L804-H807 WeakPolarHBondContact O-CB 3.45Å; L804-H807 PolarHBondContact O-N 3.22Å; R805-H807 PolarHBondContact O-N 3.35Å; H807-F811 WeakPolarHBondContact O-CB 3.37Å; H807-Q812 WeakPolarHBondContact O-CB 2.94Å; H807-Q812 VanDerWaalsContact O-CG 3.29Å; H807-Q812 WeakPolarHBondContact O-CG 3.32Å; H807-Q812 PolarHBondContact O-N 3.35Å
808	W	91.5	Very high	89.5	Confident	64 Å²	64	35.1 Å²	35.1	24%	0.242	18%	0.179	C	C	.	.	I	π-helix	trans	-71.4	-48.7	-177.9	-68.6	-10.2	0	0	0	112.9	I379 A382 Y383 L804 R805 Q812	I379-W808 WeakPolarHBondContact O-CZ2 3.28Å; I379-W808 PolarHBondContact O-NE1 3.41Å; I379-W808 VanDerWaalsContact O-NE1 3.17Å; A382-W808 HydrophobicContact CB-CH2 4.48Å; A382-W808 HydrophobicContact CB-CZ2 4.17Å; Y383-W808 HydrophobicContact CD2-CB 3.65Å; Y383-W808 AromaticContact CD2-CD2 3.78Å; Y383-W808 HydrophobicContact CD2-CD2 3.78Å; Y383-W808 AromaticContact CD2-CE3 3.94Å; Y383-W808 HydrophobicContact CD2-CE3 3.94Å; Y383-W808 AromaticContact CD2-CG 3.69Å; Y383-W808 HydrophobicContact CD2-CG 3.69Å; Y383-W808 HydrophobicContact CE2-CB 3.86Å; Y383-W808 HydrophobicContact CE2-CG 4.4Å; Y383-W808 HydrophobicContact CG-CB 4.03Å; Y383-W808 AromaticContact CG-CD1 4Å; Y383-W808 HydrophobicContact CG-CD2 4.11Å; Y383-W808 AromaticContact CG-CG 3.82Å; Y383-W808 HydrophobicContact CG-CG 3.82Å; L804-W808 HydrophobicContact CD1-CH2 4.23Å; L804-W808 HydrophobicContact CD1-CZ2 3.84Å; L804-W808 HydrophobicContact CD2-CD2 3.35Å; L804-W808 VanDerWaalsContact CD2-CE2 3.43Å; L804-W808 HydrophobicContact CD2-CE3 3.31Å; L804-W808 HydrophobicContact CD2-CG 4.19Å; L804-W808 HydrophobicContact CD2-CH2 3.52Å; L804-W808 HydrophobicContact CD2-CZ2 3.53Å; L804-W808 HydrophobicContact CD2-CZ3 3.39Å; L804-W808 HydrophobicContact CG-CD2 4.08Å; L804-W808 HydrophobicContact CG-CE3 4.46Å; L804-W808 HydrophobicContact CG-CH2 4.3Å; L804-W808 HydrophobicContact CG-CZ2 3.87Å; L804-W808 PolarHBondContact O-N 2.96Å; R805-W808 PolarHBondContact O-N 2.97Å; R805-W808 VanDerWaalsContact O-N 3.17Å; W808-Q812 WeakPolarHBondContact O-CB 3.1Å
809	V	90.1	Very high	89.1	Confident	55 Å²	55	40 Å²	40	33%	0.333	20%	0.202	S	C	.	.	I	π-helix	trans	-91.3	-43.5	-171.9	-179.9	0	0	0	0	111.8	R805 N813	R805-V809 HydrophobicContact CG-CG2 4.37Å; R805-V809 PolarHBondContact O-N 3.07Å; V809-N813 WeakPolarHBondContact O-CB 3.4Å
810	E	90.4	Very high	88.7	Confident	3 Å²	3	41 Å²	41	1%	0.014	21%	0.213	C	C	.	.	I	π-helix	trans	-90	-36	-172.6	-65.4	83	164.5	0	0	113.1	N735 S738 Y739 R741 L806	N735-E810 HydrophobicContact CB-CB 4.37Å; N735-E810 HydrophobicContact CB-CG 3.77Å; S738-E810 VanDerWaalsContact CB-OE1 3.24Å; S738-E810 WeakPolarHBondContact CB-OE1 3.36Å; S738-E810 PolarHBondContact OG-OE1 2.84Å; Y739-E810 HydrophobicContact CE2-CB 3.97Å; Y739-E810 HydrophobicContact CE2-CG 4.2Å; R741-E810 IonicContact NH1-OE1 3.87Å; R741-E810 PolarHBondContact NH1-OE1 3.04Å; L806-E810 WeakPolarHBondContact CA-OE2 3.38Å; L806-E810 HydrophobicContact CD2-CG 4.28Å; L806-E810 WeakPolarHBondContact O-CB 3.17Å
811	F	89.9	Confident	88.4	Confident	1 Å²	1	43.3 Å²	43.3	0%	0.004	22%	0.221	C	C	.	.	I	π-helix	trans	-91.2	-53	-178.5	-178.3	-111.5	0	0	0	113.5	Q551 F554 L558 L806 H807 F815	Q551-F811 HydrophobicContact CG-CD2 3.9Å; Q551-F811 HydrophobicContact CG-CE2 4.5Å; F554-F811 AromaticContact CD1-CE2 3.58Å; F554-F811 HydrophobicContact CD1-CE2 3.58Å; F554-F811 AromaticContact CD1-CZ 3.93Å; F554-F811 HydrophobicContact CD1-CZ 3.93Å; F554-F811 HydrophobicContact CE1-CE2 4.05Å; F554-F811 AromaticContact CE1-CZ 3.89Å; F554-F811 HydrophobicContact CE1-CZ 3.89Å; L558-F811 HydrophobicContact CD1-CE1 4.46Å; L558-F811 HydrophobicContact CD1-CE2 4.27Å; L558-F811 HydrophobicContact CD1-CZ 3.65Å; L806-F811 PolarHBondContact O-N 3.06Å; H807-F811 WeakPolarHBondContact O-CB 3.37Å; F811-F815 AromaticContact CD1-CE1 3.88Å; F811-F815 HydrophobicContact CD1-CE1 3.88Å; F811-F815 HydrophobicContact CD1-CZ 4.2Å; F811-F815 HydrophobicContact CD2-CE1 4.41Å; F811-F815 AromaticContact CE1-CE1 3.6Å; F811-F815 HydrophobicContact CE1-CE1 3.6Å; F811-F815 AromaticContact CE1-CZ 3.69Å; F811-F815 HydrophobicContact CE1-CZ 3.69Å; F811-F815 HydrophobicContact CE2-CE1 4.15Å; F811-F815 HydrophobicContact CG-CE1 4.29Å; F811-F815 AromaticContact CZ-CE1 3.75Å; F811-F815 HydrophobicContact CZ-CE1 3.75Å; F811-F815 HydrophobicContact CZ-CZ 4.08Å; F811-F815 WeakPolarHBondContact O-CE1 3.02Å
812	Q	88.8	Confident	88.2	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-69.5	-36.4	-174.5	-75.9	171.1	-6.9	0	0	112.9	Y383 P393 H807 W808 K814 F815 Y816	Y383-Q812 HydrophobicContact CE1-CB 4.5Å; P393-Q812 HydrophobicContact CB-CG 4.36Å; P393-Q812 HydrophobicContact CG-CG 4.13Å; H807-Q812 WeakPolarHBondContact O-CB 2.94Å; H807-Q812 VanDerWaalsContact O-CG 3.29Å; H807-Q812 WeakPolarHBondContact O-CG 3.32Å; H807-Q812 PolarHBondContact O-N 3.35Å; W808-Q812 WeakPolarHBondContact O-CB 3.1Å; Q812-K814 PolarHBondContact O-N 3.1Å; Q812-F815 PolarHBondContact O-N 3.22Å; Q812-F815 VanDerWaalsContact O-N 3.11Å; Q812-Y816 HydrophobicContact CB-CD1 4.43Å; Q812-Y816 HydrophobicContact CB-CG 4.44Å; Q812-Y816 WeakPolarHBondContact O-CB 3.47Å; Q812-Y816 PolarHBondContact O-N 3.23Å
813	N	86.1	Confident	87.9	Confident	75 Å²	75	42.1 Å²	42.1	40%	0.401	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-56.7	-12.7	179.4	-165.6	14.6	0	0	0	114.5	V809	V809-N813 WeakPolarHBondContact O-CB 3.4Å
814	K	84.5	Confident	87.6	Confident	20 Å²	20	45.1 Å²	45.1	9%	0.087	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-88.2	-24	179.8	-59.9	-53.3	-173.5	-175.8	0	114.9	V556 S559 Y728 Q812	V556-K814 HydrophobicContact CG2-CB 4.11Å; V556-K814 HydrophobicContact CG2-CD 4.21Å; V556-K814 HydrophobicContact CG2-CG 4.07Å; S559-K814 WeakPolarHBondContact CB-O 3.39Å; Y728-K814 HydrophobicContact CD2-CD 4.34Å; Y728-K814 VanDerWaalsContact CD2-NZ 3.29Å; Y728-K814 HydrophobicContact CE2-CD 3.96Å; Y728-K814 VanDerWaalsContact CE2-NZ 3.27Å; Q812-K814 PolarHBondContact O-N 3.1Å
815	F	85.3	Confident	87.4	Confident	11 Å²	11	45.7 Å²	45.7	5%	0.048	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.9	-14.9	-173.5	69.6	-89.4	0	0	0	114.6	P393 G555 L558 N562 F811 Q812	P393-F815 HydrophobicContact CB-CE2 4.44Å; P393-F815 HydrophobicContact CB-CZ 4.05Å; P393-F815 HydrophobicContact CG-CE2 3.85Å; P393-F815 HydrophobicContact CG-CZ 3.85Å; G555-F815 WeakPolarHBondContact O-CD1 3.4Å; L558-F815 HydrophobicContact CB-CB 4.11Å; L558-F815 HydrophobicContact CB-CD1 3.99Å; L558-F815 HydrophobicContact CB-CD2 4.1Å; L558-F815 HydrophobicContact CB-CE1 4.46Å; L558-F815 HydrophobicContact CB-CG 3.8Å; L558-F815 HydrophobicContact CD1-CD1 4.16Å; L558-F815 HydrophobicContact CD1-CE1 3.79Å; L558-F815 HydrophobicContact CD1-CE2 4.18Å; L558-F815 HydrophobicContact CD1-CZ 3.79Å; N562-F815 PolarHBondContact ND2-O 3.28Å; F811-F815 AromaticContact CD1-CE1 3.88Å; F811-F815 HydrophobicContact CD1-CE1 3.88Å; F811-F815 HydrophobicContact CD1-CZ 4.2Å; F811-F815 HydrophobicContact CD2-CE1 4.41Å; F811-F815 AromaticContact CE1-CE1 3.6Å; F811-F815 HydrophobicContact CE1-CE1 3.6Å; F811-F815 AromaticContact CE1-CZ 3.69Å; F811-F815 HydrophobicContact CE1-CZ 3.69Å; F811-F815 HydrophobicContact CE2-CE1 4.15Å; F811-F815 HydrophobicContact CG-CE1 4.29Å; F811-F815 AromaticContact CZ-CE1 3.75Å; F811-F815 HydrophobicContact CZ-CE1 3.75Å; F811-F815 HydrophobicContact CZ-CZ 4.08Å; F811-F815 WeakPolarHBondContact O-CE1 3.02Å; Q812-F815 PolarHBondContact O-N 3.22Å; Q812-F815 VanDerWaalsContact O-N 3.11Å
816	Y	85.1	Confident	87.1	Confident	20 Å²	20	40.8 Å²	40.8	8%	0.078	22%	0.219	C	C	.	.			trans	-102.5	116.2	-172.5	-171	-102.8	0	0	0	110.3	Y383 G384 G386 E390 P393 Q812	Y383-Y816 HydrophobicContact CD1-CD1 4.48Å; Y383-Y816 HydrophobicContact CD1-CE1 4.42Å; G384-Y816 PolarHBondContact O-OH 3.41Å; G386-Y816 WeakPolarHBondContact CA-OH 3.39Å; G386-Y816 PolarHBondContact N-OH 3.28Å; E390-Y816 VanDerWaalsContact OE1-CA 3.29Å; E390-Y816 WeakPolarHBondContact OE1-CA 3.28Å; P393-Y816 HydrophobicContact CG-CD2 3.71Å; P393-Y816 HydrophobicContact CG-CE2 3.97Å; P393-Y816 HydrophobicContact CG-CG 4.31Å; Q812-Y816 HydrophobicContact CB-CD1 4.43Å; Q812-Y816 HydrophobicContact CB-CG 4.44Å; Q812-Y816 WeakPolarHBondContact O-CB 3.47Å; Q812-Y816 PolarHBondContact O-N 3.23Å
817	V	78.9	Confident	86.8	Confident	93 Å²	93	41.4 Å²	41.4	56%	0.564	22%	0.223	S	C	*	.			trans	-83	-41.8	-177.6	-178.9	0	0	0	0	111.7	E390 D819	E390-V817 PolarHBondContact OE1-N 3.47Å; V817-D819 HydrophobicContact CG1-CB 4.44Å; V817-D819 WeakPolarHBondContact CG1-OD2 3.24Å; V817-D819 PolarHBondContact O-N 2.93Å
818	G	78.4	Confident	86.4	Confident	19 Å²	19	41.3 Å²	41.3	20%	0.196	22%	0.223	C	C	.	.			trans	78.2	9.6	170.3	0	0	0	0	0	117.3	V385 G820	V385-G818 CarbonylContact O-C 3.57Å; V385-G818 WeakPolarHBondContact O-CA 3.45Å; V385-G818 VanDerWaalsContact O-O 3.07Å; G818-G820 VanDerWaalsContact C-N 3.29Å; G818-G820 PolarHBondContact O-N 3.04Å
819	D	83.3	Confident	85.5	Confident	144 Å²	144	45.1 Å²	45.1	77%	0.77	24%	0.241	S	C	*	.	B	Isolated β-bridge	trans	-86.9	16.4	-179.3	-66.4	-30.7	0	0	0	114.3	V817	V817-D819 HydrophobicContact CG1-CB 4.44Å; V817-D819 WeakPolarHBondContact CG1-OD2 3.24Å; V817-D819 PolarHBondContact O-N 2.93Å
820	G	84.5	Confident	84.4	Confident	23 Å²	23	47.2 Å²	47.2	24%	0.237	25%	0.247	C	C	.	.			trans	-79.2	169.8	-178	0	0	0	0	0	113.7	V385 G386 G818	V385-G820 WeakPolarHBondContact O-CA 3.5Å; V385-G820 PolarHBondContact O-N 2.79Å; G386-G820 WeakPolarHBondContact O-CA 3.4Å; G818-G820 VanDerWaalsContact C-N 3.29Å; G818-G820 PolarHBondContact O-N 3.04Å
821	Y	87.8	Confident	83.5	Confident	91 Å²	91	49.3 Å²	49.3	36%	0.357	26%	0.258	S	S	.	.			trans	-122.3	141.6	167	69.8	-85.4	0	0	0	110.8	A362 P363 P364 T365	A362-Y821 HydrophobicContact CB-CE1 4.4Å; A362-Y821 WeakPolarHBondContact O-CE1 3.43Å; A362-Y821 PolarHBondContact O-OH 3.12Å; P363-Y821 VanDerWaalsContact C-CZ 3.45Å; P363-Y821 VanDerWaalsContact C-OH 3.26Å; P363-Y821 WeakPolarHBondContact CA-OH 3.31Å; P364-Y821 HydrophobicContact CB-CD2 3.88Å; P364-Y821 HydrophobicContact CB-CE2 3.37Å; P364-Y821 WeakPolarHBondContact CD-OH 3.37Å; P364-Y821 HydrophobicContact CG-CE2 4.08Å; P364-Y821 VanDerWaalsContact N-OH 3.09Å; T365-Y821 PolarHBondContact N-O 3.49Å; T365-Y821 PolarHBondContact OG1-O 3.15Å
822	K	87.8	Confident	82.4	Confident	110 Å²	110	51.5 Å²	51.5	48%	0.478	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-74.5	139.5	-170.9	-170.9	171.9	-179.8	170.8	0	110.5	D381 V385 S824	D381-K822 IonicContact OD2-NZ 2.66Å; V385-K822 HydrophobicContact CG1-CB 4.21Å; V385-K822 HydrophobicContact CG2-CB 4.03Å; K822-S824 PolarHBondContact O-N 3.46Å
823	F	89.4	Confident	81	Confident	9 Å²	9	57.1 Å²	57.1	4%	0.039	30%	0.299	C	S	.	.			trans	-72.2	110.2	169	-175.9	-112.4	0	0	0	110.1	M10 L34 Q36 W326 P364 T365 F366 P825	M10-F823 HydrophobicContact CE-CB 4.09Å; M10-F823 HydrophobicContact CE-CD1 4.11Å; M10-F823 HydrophobicContact CE-CD2 3.56Å; M10-F823 HydrophobicContact CE-CE1 4.42Å; M10-F823 HydrophobicContact CE-CE2 3.93Å; M10-F823 HydrophobicContact CE-CG 3.65Å; M10-F823 HydrophobicContact CE-CZ 4.34Å; L34-F823 WeakPolarHBondContact O-CZ 3.4Å; Q36-F823 HydrophobicContact CB-CD2 3.9Å; Q36-F823 HydrophobicContact CB-CE2 3.44Å; Q36-F823 VanDerWaalsContact CB-CE2 3.44Å; Q36-F823 HydrophobicContact CB-CZ 4.22Å; W326-F823 HydrophobicContact CB-CE2 4.33Å; P364-F823 HydrophobicContact CB-CB 3.98Å; P364-F823 HydrophobicContact CB-CD2 3.94Å; P364-F823 HydrophobicContact CB-CG 4.48Å; P364-F823 HydrophobicContact CG-CD2 3.66Å; P364-F823 HydrophobicContact CG-CE2 4.41Å; T365-F823 VanDerWaalsContact O-CB 3.3Å; T365-F823 WeakPolarHBondContact O-CB 3.08Å; T365-F823 PolarHBondContact O-N 3.37Å; F366-F823 HydrophobicContact CB-CB 3.77Å; F366-F823 HydrophobicContact CB-CD1 3.94Å; F366-F823 HydrophobicContact CB-CG 3.99Å; F366-F823 HydrophobicContact CD2-CB 4.25Å; F366-F823 AromaticContact CD2-CD1 3.45Å; F366-F823 HydrophobicContact CD2-CD1 3.45Å; F366-F823 VanDerWaalsContact CD2-CD1 3.45Å; F366-F823 HydrophobicContact CD2-CE1 4.22Å; F366-F823 HydrophobicContact CD2-CG 4.24Å; F366-F823 HydrophobicContact CE2-CD1 4.02Å; F366-F823 HydrophobicContact CE2-CE1 4.46Å; F366-F823 HydrophobicContact CG-CB 4.4Å; F366-F823 AromaticContact CG-CD1 3.75Å; F366-F823 HydrophobicContact CG-CD1 3.75Å; F366-F823 HydrophobicContact CG-CE1 4.38Å; F366-F823 HydrophobicContact CG-CG 4.31Å; F823-P825 HydrophobicContact CD1-CB 4.31Å; F823-P825 HydrophobicContact CD1-CG 4.21Å; F823-P825 HydrophobicContact CE1-CB 3.63Å; F823-P825 HydrophobicContact CE1-CG 3.95Å; F823-P825 HydrophobicContact CZ-CB 4.02Å; F823-P825 VanDerWaalsContact O-CD 3.3Å; F823-P825 WeakPolarHBondContact O-CD 3.44Å
824	S	86.9	Confident	79.4	Confident	63 Å²	63	56.2 Å²	56.2	44%	0.441	31%	0.308	S	S	.	.			trans	-104.3	93.5	171.6	48	0	0	0	0	109.3	Q36 K822	Q36-S824 WeakPolarHBondContact CG-O 3.41Å; Q36-S824 PolarHBondContact NE2-OG 3.01Å; K822-S824 PolarHBondContact O-N 3.46Å
825	P	87.9	Confident	77.4	Confident	29 Å²	29	59.7 Å²	59.7	19%	0.188	33%	0.331	C	S	.	.			trans	-70.3	140.7	178.2	26.9	-31.1	0	0	0	110.9	G33 F823 S827	G33-P825 VanDerWaalsContact O-CB 3.24Å; G33-P825 WeakPolarHBondContact O-CB 3.15Å; F823-P825 HydrophobicContact CD1-CB 4.31Å; F823-P825 HydrophobicContact CD1-CG 4.21Å; F823-P825 HydrophobicContact CE1-CB 3.63Å; F823-P825 HydrophobicContact CE1-CG 3.95Å; F823-P825 HydrophobicContact CZ-CB 4.02Å; F823-P825 VanDerWaalsContact O-CD 3.3Å; F823-P825 WeakPolarHBondContact O-CD 3.44Å; P825-S827 PolarHBondContact O-N 3.22Å; P825-S827 VanDerWaalsContact O-N 3.08Å
826	F	88.1	Confident	74.9	Confident	21 Å²	21	62 Å²	62	9%	0.092	35%	0.352	C	S	.	.			trans	-67.8	104	168.7	176.6	-115.1	0	0	0	109.7	V26 G30 G33 V35 F37 A304 V305 I308 F828 I831	V26-F826 HydrophobicContact CG1-CE1 4.02Å; G30-F826 VanDerWaalsContact CA-CE1 3.43Å; G33-F826 WeakPolarHBondContact CA-O 3.49Å; V35-F826 WeakPolarHBondContact O-CB 3.33Å; V35-F826 PolarHBondContact O-N 2.98Å; F37-F826 HydrophobicContact CD2-CB 4.07Å; F37-F826 HydrophobicContact CD2-CG 4.43Å; F37-F826 HydrophobicContact CE2-CB 4.13Å; F37-F826 AromaticContact CE2-CD1 3.96Å; F37-F826 HydrophobicContact CE2-CD1 3.96Å; F37-F826 HydrophobicContact CE2-CG 4.24Å; A304-F826 HydrophobicContact CB-CE2 3.96Å; A304-F826 HydrophobicContact CB-CZ 4.23Å; V305-F826 HydrophobicContact CG2-CZ 4.48Å; I308-F826 HydrophobicContact CD1-CB 4.44Å; I308-F826 HydrophobicContact CD1-CD2 3.51Å; I308-F826 HydrophobicContact CD1-CE2 3.8Å; I308-F826 HydrophobicContact CD1-CG 3.95Å; I308-F826 HydrophobicContact CD1-CZ 4.48Å; I308-F826 HydrophobicContact CG1-CD1 4.07Å; I308-F826 HydrophobicContact CG1-CD2 3.46Å; I308-F826 VanDerWaalsContact CG1-CD2 3.46Å; I308-F826 HydrophobicContact CG1-CE1 3.91Å; I308-F826 HydrophobicContact CG1-CE2 3.27Å; I308-F826 HydrophobicContact CG1-CG 3.85Å; I308-F826 HydrophobicContact CG1-CZ 3.52Å; F826-F828 HydrophobicContact CE1-CZ 4.5Å; F826-F828 AromaticContact CZ-CE1 3.97Å; F826-F828 HydrophobicContact CZ-CE1 3.97Å; F826-F828 HydrophobicContact CZ-CZ 4.32Å; F826-I831 HydrophobicContact CD2-CD1 4.4Å; F826-I831 HydrophobicContact CE2-CD1 4.01Å
827	S	86.7	Confident	72.1	Confident	12 Å²	12	70 Å²	70	8%	0.084	39%	0.39	C	S	.	.			trans	-139.2	136.2	177.5	-173.8	0	0	0	0	112.2	G30 P825 K829 H830 I831	G30-S827 WeakPolarHBondContact O-CA 3.24Å; P825-S827 PolarHBondContact O-N 3.22Å; P825-S827 VanDerWaalsContact O-N 3.08Å; S827-K829 VanDerWaalsContact C-N 3.26Å; S827-K829 PolarHBondContact O-N 3.02Å; S827-K829 PolarHBondContact OG-N 3.18Å; S827-H830 PolarHBondContact O-N 3.32Å; S827-I831 WeakPolarHBondContact O-CD1 3.38Å; S827-I831 WeakPolarHBondContact O-CG1 3.24Å
828	F	82.4	Confident	69.7	Low	3 Å²	3	77.5 Å²	77.5	1%	0.013	42%	0.419	C	S	.	.	H	α-helix	trans	-64.1	-28.6	176.7	-62.7	-53.9	0	0	0	113.8	A27 G30 E31 T87 K301 A304 V305 F826 H830 I831 L832	A27-F828 VanDerWaalsContact O-CE2 3.28Å; A27-F828 WeakPolarHBondContact O-CE2 3.46Å; G30-F828 PolarHBondContact O-N 3.3Å; G30-F828 VanDerWaalsContact O-N 3.13Å; E31-F828 HydrophobicContact CG-CD2 3.93Å; E31-F828 HydrophobicContact CG-CE2 3.97Å; E31-F828 WeakPolarHBondContact OE1-CD2 3.41Å; T87-F828 HydrophobicContact CG2-CD2 4.16Å; T87-F828 HydrophobicContact CG2-CE2 3.37Å; T87-F828 HydrophobicContact CG2-CZ 3.64Å; K301-F828 HydrophobicContact CB-CD1 3.98Å; K301-F828 HydrophobicContact CB-CE1 3.83Å; K301-F828 HydrophobicContact CB-CZ 4.3Å; K301-F828 HydrophobicContact CD-CB 4.46Å; K301-F828 HydrophobicContact CD-CD1 4.33Å; K301-F828 HydrophobicContact CD-CD2 4.2Å; K301-F828 HydrophobicContact CD-CG 4.09Å; K301-F828 HydrophobicContact CG-CB 4.23Å; K301-F828 HydrophobicContact CG-CD1 3.6Å; K301-F828 HydrophobicContact CG-CD2 4.36Å; K301-F828 HydrophobicContact CG-CE1 3.97Å; K301-F828 HydrophobicContact CG-CG 3.82Å; K301-F828 HydrophobicContact CG-CZ 4.49Å; A304-F828 HydrophobicContact CB-CE1 4.18Å; V305-F828 HydrophobicContact CG2-CE1 4Å; V305-F828 HydrophobicContact CG2-CZ 3.66Å; F826-F828 HydrophobicContact CE1-CZ 4.5Å; F826-F828 AromaticContact CZ-CE1 3.97Å; F826-F828 HydrophobicContact CZ-CE1 3.97Å; F826-F828 HydrophobicContact CZ-CZ 4.32Å; F828-H830 PolarHBondContact O-N 3.25Å; F828-I831 HydrophobicContact CD1-CD1 4.35Å; F828-I831 PolarHBondContact O-N 3.33Å; F828-L832 WeakPolarHBondContact O-CB 3.14Å; F828-L832 VanDerWaalsContact O-CG 3.22Å; F828-L832 WeakPolarHBondContact O-CG 3.38Å; F828-L832 PolarHBondContact O-N 2.89Å
829	K	73.6	Confident	69.3	Low	145 Å²	145	80.5 Å²	80.5	63%	0.63	43%	0.43	S	S	*	.	H	α-helix	trans	-61.9	-44.7	179.7	-67.5	177.7	-177.6	168	0	111.6	S827 I831 L832 D833	S827-K829 VanDerWaalsContact C-N 3.26Å; S827-K829 PolarHBondContact O-N 3.02Å; S827-K829 PolarHBondContact OG-N 3.18Å; K829-I831 VanDerWaalsContact C-N 3.29Å; K829-I831 PolarHBondContact O-N 3.16Å; K829-L832 PolarHBondContact O-N 3.32Å; K829-D833 WeakPolarHBondContact O-CB 3.5Å; K829-D833 PolarHBondContact O-N 3.28Å
830	H	67.1	Low	68.5	Low	98 Å²	98	77.1 Å²	77.1	45%	0.454	41%	0.412	S	S	.	.	H	α-helix	trans	-63.9	-35.6	177.9	-78.6	-65.3	0	0	0	113.1	S827 F828 T835	S827-H830 PolarHBondContact O-N 3.32Å; F828-H830 PolarHBondContact O-N 3.25Å; H830-T835 PolarHBondContact O-N 3.38Å; H830-T835 PolarHBondContact O-OG1 3.5Å
831	I	70.4	Confident	67.6	Low	47 Å²	47	80.1 Å²	80.1	24%	0.241	42%	0.422	C	S	.	.	H	α-helix	trans	-72.5	-42.1	-179.8	-60.8	165	0	0	0	110.4	A304 F826 S827 F828 K829 G834	A304-I831 HydrophobicContact CB-CD1 3.66Å; F826-I831 HydrophobicContact CD2-CD1 4.4Å; F826-I831 HydrophobicContact CE2-CD1 4.01Å; S827-I831 WeakPolarHBondContact O-CD1 3.38Å; S827-I831 WeakPolarHBondContact O-CG1 3.24Å; F828-I831 HydrophobicContact CD1-CD1 4.35Å; F828-I831 PolarHBondContact O-N 3.33Å; K829-I831 VanDerWaalsContact C-N 3.29Å; K829-I831 PolarHBondContact O-N 3.16Å; I831-G834 PolarHBondContact O-N 2.99Å
832	L	66.6	Low	66.5	Low	48 Å²	48	79.5 Å²	79.5	25%	0.251	43%	0.426	S	S	.	.	H	α-helix	trans	-71.5	-33.3	179.6	-66.9	177	0	0	0	113.3	I297 Q300 F828 K829 G834	I297-L832 HydrophobicContact CB-CD2 4.12Å; I297-L832 HydrophobicContact CG1-CD1 4.36Å; I297-L832 HydrophobicContact CG1-CD2 3.87Å; I297-L832 HydrophobicContact CG2-CD1 3.81Å; I297-L832 HydrophobicContact CG2-CD2 3.92Å; Q300-L832 HydrophobicContact CB-CD2 4.33Å; F828-L832 WeakPolarHBondContact O-CB 3.14Å; F828-L832 VanDerWaalsContact O-CG 3.22Å; F828-L832 WeakPolarHBondContact O-CG 3.38Å; F828-L832 PolarHBondContact O-N 2.89Å; K829-L832 PolarHBondContact O-N 3.32Å; L832-G834 PolarHBondContact O-N 3.47Å
833	D	59.9	Low	65.1	Low	118 Å²	118	77.6 Å²	77.6	63%	0.631	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-5.7	175.1	-73.1	-19.8	0	0	0	112.4	K829 T835	K829-D833 WeakPolarHBondContact O-CB 3.5Å; K829-D833 PolarHBondContact O-N 3.28Å; D833-T835 HydrophobicContact CB-CG2 4.36Å; D833-T835 PolarHBondContact O-N 3.5Å
834	G	53.2	Low	63.5	Low	56 Å²	56	82.1 Å²	82.1	58%	0.577	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	11.6	-179.6	0	0	0	0	0	113.7	I831 L832 A836	I831-G834 PolarHBondContact O-N 2.99Å; L832-G834 PolarHBondContact O-N 3.47Å; G834-A836 PolarHBondContact O-N 3.21Å
835	T	42.8	Very low	61.8	Low	93 Å²	93	83.5 Å²	83.5	57%	0.571	45%	0.449	S	S	*	.			trans	-77.9	0.2	178.5	53.2	0	0	0	0	113.9	H830 D833 E837	H830-T835 PolarHBondContact O-N 3.38Å; H830-T835 PolarHBondContact O-OG1 3.5Å; D833-T835 HydrophobicContact CB-CG2 4.36Å; D833-T835 PolarHBondContact O-N 3.5Å; T835-E837 VanDerWaalsContact C-N 3.32Å; T835-E837 PolarHBondContact O-N 3.34Å
836	A	32.8	Very low	59.8	Low	60 Å²	60	87.7 Å²	87.7	50%	0.496	47%	0.469	S	S	.	.			trans	-90	68.1	175.1	0	0	0	0	0	110.2	G834 E838	G834-A836 PolarHBondContact O-N 3.21Å; A836-E838 VanDerWaalsContact C-N 3.28Å
837	E	26.7	Very low	57.5	Low	188 Å²	188	93.3 Å²	93.3	88%	0.879	50%	0.5	S	S	*	.			trans	-92.7	68.3	150.7	-74.5	-166.1	159.2	0	0	108.3	T835	T835-E837 VanDerWaalsContact C-N 3.32Å; T835-E837 PolarHBondContact O-N 3.34Å
838	E	27.6	Very low	54.8	Low	251 Å²	251	100.6 Å²	100.6	100%	1.173	54%	0.538	S	S	*	.			trans	-146.5	0	154.2	-73.7	-165.9	162	0	0	110	A836	A836-E838 VanDerWaalsContact C-N 3.28Å

Retrieved 838 of 838 residues in 1462.9 ms (Link to these results)

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