A0A5K4FBG9_SCHMA Loading...

EGF-like domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FBG9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,329 aa.

						>A0A5K4FBG9_SCHMA|A0A5K4FBG9
MNNILWILNILLILLLILLLLLQTCIYGFIMEHSLLKNIQENVEYWRLRSLDLGPCLQEGDAYCMRRVANSMCSIEKNECFCKPGYVSIQESYGITCKTLLTNLKCQVDSDCIHVVNSACHPGAGYCACPGGTIYVSQDNACRQSVENNQNPFCLKCRQANGVCYHYSSSNQILNVNDIKRYKRYEYKDHDLIPFNSPIDLIFKEILQYTENTETYGCSCSHNTGMLVSFSMNDLKTNTNHSHLQKPHHSTSFNKINENISLSTYQLVQQQFPQWYFCKAMMVDLWEYCNNIDLLCRSKNARCIKTDNELDLIRFTCQCIPGYIPVYQNHLDYYECFLQLEANHSSCSSCIHSNGKCYTMNEQAIESSIGCLCPNNLQSIISSSTQTYLVQPNNNNNIPIDSNNDEIINNNGNEQNNYKSMLSQATIMEYEACGENLVHVFCQRHLLEICFLPINQPPYQNLAENLQLHRSIALITNLTIYQKFLDHCILNIKKDYGLQYDQWYNNTIIKNYNKLNTKYIWCKTMDWRKDTTKIPCGLSITEYMTGDLYTGYLAIITNQEYRNHEIDLLFQFTCKTNNDVPHRIPGQVFERNIKVNRQDLFDNSPWPKLDVKFTVKDENGQSVQTILESTPIRFEAELIDELNVYKAVTVEECYVIDRIKSGQRNEDSKETLLLYKGCPISKTLLNNLSTIGLTFHTNHYNNEENFLIFQPTTTSSSSSSNHHHLQTDLFYLYLNGPLYIQSNQSKIINKTIKINNNNNNNKINKNFLFFHNQTINEQLNLIDDIYKQKLNEIGYKLYELKFTCIFRICKQLAWCSWPSACDSTTSTLNNPRITFLPPSLRIIQRSIPLYLIESIPSSQLPVKKKVPSRICDELYCSNTLHILLMISLIGILTCLMGVMGMLLARKYRHHLNHTRNSLIQSKSLIIKQNHCTQSNKNYYNPIKQSSRSQYLIHKPHVQLDQHIDNDIIKSLLTVDSHINTNTNHITNNNVSSSSTSSSSNSNNSNSSSNNQPYTIDVKDCCKYWLNEHSYANPLLLQRSLPHDLPLCQQHHYYNHRHHHHHHQQQQQQQQPYEQHQLYHSQCQQHQQPSQYQLQHYEISPSSTMATPNHCSCLNETLFTDNKIIQNLSNYYTLKSYTTLPITTTITTSNTFTSFKSLENSRQNDDYPLMNRTTTAFILEPSHTLISSSNNSSNTITTTTTNSNTTTTMITTINNNDTHNYDNNNNMSISTMNNIHELIASSYPITNISNTTTTTTTNTTDNNNSSSNQMCTIKNLQFLNNTPNYLLLQSKYKKLSTFDDTIYFGINYHNPNCILNSTIDTIQMNTNGSQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	56.2	Low	78.1	Confident	195 Å²	195	124.9 Å²	124.9	96%	0.961	63%	0.625	S	S	*	*				0	-41.4	0	-66.2	-162.6	79.5	0	0	113.2	N3 I4 L5	M1-N3 VanDerWaalsContact C-N 3.31Å; M1-N3 PolarHBondContact O-N 3.39Å; M1-N3 VanDerWaalsContact O-N 3.07Å; M1-I4 WeakPolarHBondContact O-CB 3.28Å; M1-I4 PolarHBondContact O-N 3.07Å; M1-L5 PolarHBondContact O-N 3.39Å
2	N	68.7	Low	78.9	Confident	130 Å²	130	123.2 Å²	123.2	70%	0.695	62%	0.618	S	S	*	*	H	α-helix	trans	-47.1	-42.3	-170.8	-58.6	20.9	0	0	0	115.4	I4 L5 W6	N2-I4 VanDerWaalsContact C-N 3.3Å; N2-I4 PolarHBondContact O-N 2.94Å; N2-L5 PolarHBondContact O-N 3.24Å; N2-L5 VanDerWaalsContact O-N 3.14Å; N2-W6 PolarHBondContact O-N 3.29Å
3	N	74	Confident	79.5	Confident	130 Å²	130	120.7 Å²	120.7	70%	0.695	61%	0.607	S	S	*	*	H	α-helix	trans	-60.7	-36.5	178	-62.3	22.4	0	0	0	112.9	M1 W6 I7	M1-N3 VanDerWaalsContact C-N 3.31Å; M1-N3 PolarHBondContact O-N 3.39Å; M1-N3 VanDerWaalsContact O-N 3.07Å; N3-W6 PolarHBondContact O-N 3.27Å; N3-I7 WeakPolarHBondContact O-CB 3.42Å; N3-I7 WeakPolarHBondContact O-CD1 3.36Å; N3-I7 VanDerWaalsContact O-CG1 3.23Å; N3-I7 WeakPolarHBondContact O-CG1 3.5Å; N3-I7 PolarHBondContact O-N 3.42Å
4	I	79.9	Confident	79.9	Confident	116 Å²	116	119.9 Å²	119.9	60%	0.595	60%	0.604	S	S	*	*	H	α-helix	trans	-67.4	-42.7	176.4	-58.7	174.2	0	0	0	109.8	M1 N2 W6 I7 L8	M1-I4 WeakPolarHBondContact O-CB 3.28Å; M1-I4 PolarHBondContact O-N 3.07Å; N2-I4 VanDerWaalsContact C-N 3.3Å; N2-I4 PolarHBondContact O-N 2.94Å; I4-W6 VanDerWaalsContact C-N 3.34Å; I4-W6 PolarHBondContact O-N 3.48Å; I4-I7 PolarHBondContact O-N 3.37Å; I4-L8 WeakPolarHBondContact O-CB 3.45Å; I4-L8 PolarHBondContact O-N 3Å
5	L	77.7	Confident	80.4	Confident	125 Å²	125	118.6 Å²	118.6	65%	0.654	60%	0.599	S	S	*	*	H	α-helix	trans	-64.8	-38.3	177.5	-169.4	68.2	0	0	0	111.7	M1 N2 L8 N9	M1-L5 PolarHBondContact O-N 3.39Å; N2-L5 PolarHBondContact O-N 3.24Å; N2-L5 VanDerWaalsContact O-N 3.14Å; L5-L8 PolarHBondContact O-N 3.29Å; L5-N9 WeakPolarHBondContact O-CB 3.42Å; L5-N9 PolarHBondContact O-N 2.98Å
6	W	79.4	Confident	80.7	Confident	184 Å²	184	117.5 Å²	117.5	70%	0.697	60%	0.595	S	S	*	*	H	α-helix	trans	-66.4	-44.6	175.8	-166.2	63.9	0	0	0	111.9	N2 N3 I4 L8 N9 I10	N2-W6 PolarHBondContact O-N 3.29Å; N3-W6 PolarHBondContact O-N 3.27Å; I4-W6 VanDerWaalsContact C-N 3.34Å; I4-W6 PolarHBondContact O-N 3.48Å; W6-L8 PolarHBondContact O-N 3.23Å; W6-N9 PolarHBondContact O-N 3.39Å; W6-I10 HydrophobicContact CD2-CD1 3.69Å; W6-I10 HydrophobicContact CE3-CD1 3.69Å; W6-I10 HydrophobicContact CG-CD1 4.37Å; W6-I10 HydrophobicContact CH2-CD1 3.91Å; W6-I10 HydrophobicContact CZ2-CD1 3.9Å; W6-I10 HydrophobicContact CZ3-CD1 3.8Å; W6-I10 WeakPolarHBondContact O-CG1 3.4Å; W6-I10 PolarHBondContact O-N 3.05Å
7	I	84.6	Confident	80.9	Confident	105 Å²	105	115.8 Å²	115.8	54%	0.538	59%	0.587	S	S	.	*	H	α-helix	trans	-60.9	-43.2	173.7	-69.2	163.7	0	0	0	111	N3 I4 N9 I10 L11	N3-I7 WeakPolarHBondContact O-CB 3.42Å; N3-I7 WeakPolarHBondContact O-CD1 3.36Å; N3-I7 VanDerWaalsContact O-CG1 3.23Å; N3-I7 WeakPolarHBondContact O-CG1 3.5Å; N3-I7 PolarHBondContact O-N 3.42Å; I4-I7 PolarHBondContact O-N 3.37Å; I7-N9 VanDerWaalsContact C-N 3.31Å; I7-N9 PolarHBondContact O-N 3.18Å; I7-I10 PolarHBondContact O-N 3.1Å; I7-L11 WeakPolarHBondContact O-CB 3.31Å; I7-L11 PolarHBondContact O-N 2.82Å
8	L	82.6	Confident	81.1	Confident	111 Å²	111	115.1 Å²	115.1	58%	0.581	58%	0.584	S	S	*	*	H	α-helix	trans	-60.8	-40.7	176.9	-131.9	81.2	0	0	0	111.9	I4 L5 W6 L11 L12	I4-L8 WeakPolarHBondContact O-CB 3.45Å; I4-L8 PolarHBondContact O-N 3Å; L5-L8 PolarHBondContact O-N 3.29Å; W6-L8 PolarHBondContact O-N 3.23Å; L8-L11 PolarHBondContact O-N 3.33Å; L8-L12 WeakPolarHBondContact O-CB 3.17Å; L8-L12 PolarHBondContact O-N 2.88Å
9	N	83.1	Confident	81.3	Confident	90 Å²	90	114.6 Å²	114.6	48%	0.481	58%	0.582	S	S	.	*	H	α-helix	trans	-71.5	-38.5	-179.6	-152.4	8.5	0	0	0	111.7	L5 W6 I7 L12 I13	L5-N9 WeakPolarHBondContact O-CB 3.42Å; L5-N9 PolarHBondContact O-N 2.98Å; W6-N9 PolarHBondContact O-N 3.39Å; I7-N9 VanDerWaalsContact C-N 3.31Å; I7-N9 PolarHBondContact O-N 3.18Å; N9-L12 PolarHBondContact O-N 2.89Å; N9-I13 WeakPolarHBondContact O-CD1 3.07Å; N9-I13 VanDerWaalsContact O-CG1 3.26Å; N9-I13 WeakPolarHBondContact O-CG1 3.17Å; N9-I13 PolarHBondContact O-N 3.46Å
10	I	86.8	Confident	81.3	Confident	71 Å²	71	114.1 Å²	114.1	36%	0.364	58%	0.58	S	S	.	*	H	α-helix	trans	-60.4	-45.1	170.5	-69.9	165.8	0	0	0	110.7	W6 I7 L12 I13 L14	W6-I10 HydrophobicContact CD2-CD1 3.69Å; W6-I10 HydrophobicContact CE3-CD1 3.69Å; W6-I10 HydrophobicContact CG-CD1 4.37Å; W6-I10 HydrophobicContact CH2-CD1 3.91Å; W6-I10 HydrophobicContact CZ2-CD1 3.9Å; W6-I10 HydrophobicContact CZ3-CD1 3.8Å; W6-I10 WeakPolarHBondContact O-CG1 3.4Å; W6-I10 PolarHBondContact O-N 3.05Å; I7-I10 PolarHBondContact O-N 3.1Å; I10-L12 VanDerWaalsContact C-N 3.33Å; I10-L12 PolarHBondContact O-N 3.42Å; I10-I13 PolarHBondContact O-N 3.08Å; I10-L14 HydrophobicContact CG2-CD1 4.42Å; I10-L14 WeakPolarHBondContact O-CB 3.32Å; I10-L14 PolarHBondContact O-N 2.91Å
11	L	86.1	Confident	81.3	Confident	117 Å²	117	113.3 Å²	113.3	61%	0.613	58%	0.577	S	S	*	*	H	α-helix	trans	-62.1	-40.9	178.2	-162.4	79.3	0	0	0	111.7	I7 L8 L14 L15	I7-L11 WeakPolarHBondContact O-CB 3.31Å; I7-L11 PolarHBondContact O-N 2.82Å; L8-L11 PolarHBondContact O-N 3.33Å; L11-L14 PolarHBondContact O-N 3.46Å; L11-L15 PolarHBondContact O-N 2.78Å
12	L	87.4	Confident	82.3	Confident	104 Å²	104	108.9 Å²	108.9	55%	0.545	56%	0.557	S	S	.	*	H	α-helix	trans	-63.6	-44.2	176.3	-169	72.7	0	0	0	111.7	L8 N9 I10 L15 L16	L8-L12 WeakPolarHBondContact O-CB 3.17Å; L8-L12 PolarHBondContact O-N 2.88Å; N9-L12 PolarHBondContact O-N 2.89Å; I10-L12 VanDerWaalsContact C-N 3.33Å; I10-L12 PolarHBondContact O-N 3.42Å; L12-L15 PolarHBondContact O-N 3.41Å; L12-L16 WeakPolarHBondContact O-CB 3.44Å; L12-L16 PolarHBondContact O-N 3.27Å
13	I	86.9	Confident	82.7	Confident	91 Å²	91	108.4 Å²	108.4	47%	0.467	55%	0.55	S	S	.	*	H	α-helix	trans	-62.4	-43.4	175.9	-69.2	163	0	0	0	110.8	N9 I10 L15 L16 I17	N9-I13 WeakPolarHBondContact O-CD1 3.07Å; N9-I13 VanDerWaalsContact O-CG1 3.26Å; N9-I13 WeakPolarHBondContact O-CG1 3.17Å; N9-I13 PolarHBondContact O-N 3.46Å; I10-I13 PolarHBondContact O-N 3.08Å; I13-L15 PolarHBondContact O-N 3.14Å; I13-L16 PolarHBondContact O-N 3.48Å; I13-I17 HydrophobicContact CG2-CD1 3.82Å; I13-I17 HydrophobicContact CG2-CG1 4.49Å; I13-I17 WeakPolarHBondContact O-CG1 3.43Å; I13-I17 PolarHBondContact O-N 3.1Å
14	L	85.6	Confident	82.8	Confident	110 Å²	110	106.4 Å²	106.4	58%	0.576	54%	0.543	S	S	*	.	H	α-helix	trans	-60.8	-42.2	176.4	-113.8	155.8	0	0	0	112.3	I10 L11 L16 I17 L18	I10-L14 HydrophobicContact CG2-CD1 4.42Å; I10-L14 WeakPolarHBondContact O-CB 3.32Å; I10-L14 PolarHBondContact O-N 2.91Å; L11-L14 PolarHBondContact O-N 3.46Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L14-I17 PolarHBondContact O-N 3.08Å; L14-L18 WeakPolarHBondContact O-CB 3.47Å; L14-L18 PolarHBondContact O-N 3.45Å
15	L	87	Confident	82.3	Confident	100 Å²	100	104.8 Å²	104.8	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-62.4	-40.8	174.9	-165.7	81.2	0	0	0	111.9	L11 L12 I13 L18 L19	L11-L15 PolarHBondContact O-N 2.78Å; L12-L15 PolarHBondContact O-N 3.41Å; I13-L15 PolarHBondContact O-N 3.14Å; L15-L18 PolarHBondContact O-N 3.09Å; L15-L19 PolarHBondContact O-N 2.98Å
16	L	84.9	Confident	82.2	Confident	101 Å²	101	103 Å²	103	53%	0.529	53%	0.531	S	S	.	.	H	α-helix	trans	-70.1	-38.8	-178.6	-139.2	160	0	0	0	111.6	L12 I13 L14 L19 L20	L12-L16 WeakPolarHBondContact O-CB 3.44Å; L12-L16 PolarHBondContact O-N 3.27Å; I13-L16 PolarHBondContact O-N 3.48Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L16-L19 PolarHBondContact O-N 3.02Å; L16-L20 HydrophobicContact CD2-CD1 4.05Å; L16-L20 PolarHBondContact O-N 3.07Å; L16-L20 VanDerWaalsContact O-N 3.07Å
17	I	85	Confident	81.6	Confident	89 Å²	89	101.3 Å²	101.3	46%	0.456	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-43.3	171.2	-67.6	166	0	0	0	110.7	I13 L14 L19 L20 L21	I13-I17 HydrophobicContact CG2-CD1 3.82Å; I13-I17 HydrophobicContact CG2-CG1 4.49Å; I13-I17 WeakPolarHBondContact O-CG1 3.43Å; I13-I17 PolarHBondContact O-N 3.1Å; L14-I17 PolarHBondContact O-N 3.08Å; I17-L19 VanDerWaalsContact C-N 3.34Å; I17-L19 PolarHBondContact O-N 2.86Å; I17-L20 PolarHBondContact O-N 3.21Å; I17-L21 HydrophobicContact CG2-CD1 4.02Å; I17-L21 WeakPolarHBondContact O-CG 3.23Å; I17-L21 PolarHBondContact O-N 3.05Å
18	L	84.4	Confident	80.9	Confident	103 Å²	103	98 Å²	98	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-40.5	178	-169	71.3	0	0	0	112	L14 L15 L21 L22	L14-L18 WeakPolarHBondContact O-CB 3.47Å; L14-L18 PolarHBondContact O-N 3.45Å; L15-L18 PolarHBondContact O-N 3.09Å; L18-L21 PolarHBondContact O-N 3.39Å; L18-L22 PolarHBondContact O-N 3.49Å
19	L	84.3	Confident	80	Confident	106 Å²	106	99.8 Å²	99.8	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-62.7	-43.5	174.1	-88.6	158.4	0	0	0	112.6	L15 L16 I17 L22 Q23	L15-L19 PolarHBondContact O-N 2.98Å; L16-L19 PolarHBondContact O-N 3.02Å; I17-L19 VanDerWaalsContact C-N 3.34Å; I17-L19 PolarHBondContact O-N 2.86Å; L19-L22 PolarHBondContact O-N 2.94Å; L19-Q23 WeakPolarHBondContact O-CB 3.37Å; L19-Q23 PolarHBondContact O-N 2.98Å
20	L	81.4	Confident	79.1	Confident	103 Å²	103	100.3 Å²	100.3	54%	0.539	52%	0.523	S	S	.	.	H	α-helix	trans	-62.9	-40.4	175.2	-79	162.4	0	0	0	112.2	L16 I17 Q23 T24	L16-L20 HydrophobicContact CD2-CD1 4.05Å; L16-L20 PolarHBondContact O-N 3.07Å; L16-L20 VanDerWaalsContact O-N 3.07Å; I17-L20 PolarHBondContact O-N 3.21Å; L20-Q23 PolarHBondContact O-N 2.04Å; L20-T24 PolarHBondContact O-N 3.29Å; L20-T24 PolarHBondContact O-OG1 2.95Å
21	L	80.4	Confident	77.4	Confident	99 Å²	99	101 Å²	101	52%	0.518	53%	0.525	S	S	.	.	H	α-helix	trans	-66.5	-42.3	174.7	-71	170.8	0	0	0	111.8	I17 L18 Q23 T24 C25	I17-L21 HydrophobicContact CG2-CD1 4.02Å; I17-L21 WeakPolarHBondContact O-CG 3.23Å; I17-L21 PolarHBondContact O-N 3.05Å; L18-L21 PolarHBondContact O-N 3.39Å; L21-Q23 VanDerWaalsContact C-N 3.33Å; L21-Q23 PolarHBondContact O-N 2.88Å; L21-T24 WeakPolarHBondContact CA-OG1 3.36Å; L21-T24 PolarHBondContact O-N 2.71Å; L21-T24 PolarHBondContact O-OG1 3.37Å; L21-C25 WeakPolarHBondContact O-CB 3.45Å; L21-C25 PolarHBondContact O-N 2.96Å; L21-C25 PolarHBondContact O-SG 3.23Å; L21-C25 VanDerWaalsContact O-SG 3.39Å
22	L	77.8	Confident	75.6	Confident	102 Å²	102	101.7 Å²	101.7	53%	0.534	53%	0.526	S	S	.	.	H	α-helix	trans	-60	-44.6	173.9	-125.4	87.8	0	0	0	111.4	L18 L19 C25 I26	L18-L22 PolarHBondContact O-N 3.49Å; L19-L22 PolarHBondContact O-N 2.94Å; L22-C25 PolarHBondContact O-N 3.07Å; L22-I26 HydrophobicContact CD2-CD1 4.46Å; L22-I26 WeakPolarHBondContact O-CB 3.38Å; L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.31Å; L22-I26 PolarHBondContact O-N 3.28Å
23	Q	78.2	Confident	73.9	Confident	119 Å²	119	103.2 Å²	103.2	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-69.3	-34.4	-177.5	-171.1	164.6	-21.2	0	0	112.5	L19 L20 L21 Y27	L19-Q23 WeakPolarHBondContact O-CB 3.37Å; L19-Q23 PolarHBondContact O-N 2.98Å; L20-Q23 PolarHBondContact O-N 2.04Å; L21-Q23 VanDerWaalsContact C-N 3.33Å; L21-Q23 PolarHBondContact O-N 2.88Å; Q23-Y27 HydrophobicContact CG-CD2 4.34Å; Q23-Y27 WeakPolarHBondContact O-CB 3.31Å; Q23-Y27 PolarHBondContact O-N 3.2Å
24	T	75.3	Confident	72.2	Confident	89 Å²	89	101.4 Å²	101.4	55%	0.546	53%	0.525	S	S	.	.	H	α-helix	trans	-71.5	-37.8	172.1	48.7	0	0	0	0	112.5	L20 L21 Y27 G28	L20-T24 PolarHBondContact O-N 3.29Å; L20-T24 PolarHBondContact O-OG1 2.95Å; L21-T24 WeakPolarHBondContact CA-OG1 3.36Å; L21-T24 PolarHBondContact O-N 2.71Å; L21-T24 PolarHBondContact O-OG1 3.37Å; T24-Y27 PolarHBondContact O-N 3.17Å; T24-G28 PolarHBondContact O-N 3.07Å
25	C	70.6	Confident	70.1	Confident	81 Å²	81	101.5 Å²	101.5	55%	0.547	53%	0.526	S	S	.	.	H	α-helix	trans	-63.3	-41.9	171.4	-73.8	0	0	0	0	112.7	L21 L22 G28 F29	L21-C25 WeakPolarHBondContact O-CB 3.45Å; L21-C25 PolarHBondContact O-N 2.96Å; L21-C25 PolarHBondContact O-SG 3.23Å; L21-C25 VanDerWaalsContact O-SG 3.39Å; L22-C25 PolarHBondContact O-N 3.07Å; C25-G28 PolarHBondContact O-N 2.77Å; C25-F29 PolarHBondContact O-N 3.46Å
26	I	74.1	Confident	67.9	Low	88 Å²	88	102.3 Å²	102.3	45%	0.451	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-44.4	175.9	-70.8	164	0	0	0	110.7	L22 G28 F29 I30	L22-I26 HydrophobicContact CD2-CD1 4.46Å; L22-I26 WeakPolarHBondContact O-CB 3.38Å; L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.31Å; L22-I26 PolarHBondContact O-N 3.28Å; I26-G28 VanDerWaalsContact C-N 3.31Å; I26-G28 PolarHBondContact O-N 3.32Å; I26-F29 PolarHBondContact O-N 3.41Å; I26-I30 HydrophobicContact CG2-CD1 3.68Å; I26-I30 HydrophobicContact CG2-CG1 4.44Å; I26-I30 WeakPolarHBondContact O-CB 3.46Å; I26-I30 VanDerWaalsContact O-CG1 3.28Å; I26-I30 WeakPolarHBondContact O-CG1 3.13Å; I26-I30 PolarHBondContact O-N 3.22Å
27	Y	67.9	Low	65.7	Low	149 Å²	149	104.8 Å²	104.8	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-61.9	-37.8	172.7	-101.6	-91.2	0	0	0	112.4	Q23 T24 M31	Q23-Y27 HydrophobicContact CG-CD2 4.34Å; Q23-Y27 WeakPolarHBondContact O-CB 3.31Å; Q23-Y27 PolarHBondContact O-N 3.2Å; T24-Y27 PolarHBondContact O-N 3.17Å; Y27-M31 VanDerWaalsContact O-CB 3.3Å; Y27-M31 WeakPolarHBondContact O-CB 3.35Å; Y27-M31 WeakPolarHBondContact O-CG 3.5Å; Y27-M31 PolarHBondContact O-N 3.14Å
28	G	68.4	Low	63.4	Low	36 Å²	36	106 Å²	106	37%	0.371	54%	0.544	S	S	.	.	H	α-helix	trans	-58.2	-56.3	173.1	0	0	0	0	0	111.9	T24 C25 I26 I30 M31 E32	T24-G28 PolarHBondContact O-N 3.07Å; C25-G28 PolarHBondContact O-N 2.77Å; I26-G28 VanDerWaalsContact C-N 3.31Å; I26-G28 PolarHBondContact O-N 3.32Å; G28-I30 PolarHBondContact O-N 3.27Å; G28-M31 PolarHBondContact O-N 3.16Å; G28-E32 WeakPolarHBondContact O-CB 3.22Å; G28-E32 PolarHBondContact O-N 3.13Å
29	F	63.9	Low	61.3	Low	148 Å²	148	105.1 Å²	105.1	65%	0.649	54%	0.539	S	S	*	.	H	α-helix	trans	-57.4	-44.1	177.9	-103.6	-89.9	0	0	0	112.8	C25 I26 E32 H33	C25-F29 PolarHBondContact O-N 3.46Å; I26-F29 PolarHBondContact O-N 3.41Å; F29-E32 PolarHBondContact O-N 3.39Å; F29-H33 WeakPolarHBondContact O-CB 3.36Å; F29-H33 PolarHBondContact O-N 3.11Å
30	I	64.4	Low	59.1	Low	101 Å²	101	103.3 Å²	103.3	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-43.1	178.3	-69.7	169.4	0	0	0	111.1	I26 G28 S34	I26-I30 HydrophobicContact CG2-CD1 3.68Å; I26-I30 HydrophobicContact CG2-CG1 4.44Å; I26-I30 WeakPolarHBondContact O-CB 3.46Å; I26-I30 VanDerWaalsContact O-CG1 3.28Å; I26-I30 WeakPolarHBondContact O-CG1 3.13Å; I26-I30 PolarHBondContact O-N 3.22Å; G28-I30 PolarHBondContact O-N 3.27Å; I30-S34 WeakPolarHBondContact O-CB 3.2Å; I30-S34 PolarHBondContact O-N 3.39Å; I30-S34 PolarHBondContact O-OG 2.96Å
31	M	52	Low	57	Low	84 Å²	84	102.9 Å²	102.9	41%	0.414	52%	0.523	S	S	.	.	H	α-helix	trans	-66.4	-36.4	177.2	-72.5	-62.6	-44.9	0	0	112.2	Y27 G28 S34 L35	Y27-M31 VanDerWaalsContact O-CB 3.3Å; Y27-M31 WeakPolarHBondContact O-CB 3.35Å; Y27-M31 WeakPolarHBondContact O-CG 3.5Å; Y27-M31 PolarHBondContact O-N 3.14Å; G28-M31 PolarHBondContact O-N 3.16Å; M31-S34 WeakPolarHBondContact CA-OG 3.42Å; M31-S34 PolarHBondContact O-OG 3.3Å; M31-S34 VanDerWaalsContact O-OG 3.14Å; M31-L35 WeakPolarHBondContact O-CB 3.34Å; M31-L35 PolarHBondContact O-N 3.17Å
32	E	48.8	Very low	54.8	Low	133 Å²	133	104.6 Å²	104.6	62%	0.621	53%	0.532	S	S	*	.	H	α-helix	trans	-76.8	-41.3	-179.1	-163.4	155.2	-133.1	0	0	112	G28 F29 S34 L35 L36	G28-E32 WeakPolarHBondContact O-CB 3.22Å; G28-E32 PolarHBondContact O-N 3.13Å; F29-E32 PolarHBondContact O-N 3.39Å; E32-S34 VanDerWaalsContact C-N 3.34Å; E32-S34 PolarHBondContact O-N 2.79Å; E32-L35 PolarHBondContact O-N 3Å; E32-L36 HydrophobicContact CG-CD1 4.39Å; E32-L36 WeakPolarHBondContact O-CD1 3.37Å; E32-L36 PolarHBondContact O-N 2.91Å
33	H	51.2	Low	53	Low	135 Å²	135	103.8 Å²	103.8	63%	0.625	53%	0.532	S	S	*	.	H	α-helix	trans	-65.5	-34.1	173.7	-113.5	-62.6	0	0	0	113.3	F29 K37	F29-H33 WeakPolarHBondContact O-CB 3.36Å; F29-H33 PolarHBondContact O-N 3.11Å; H33-K37 PolarHBondContact O-N 3.25Å
34	S	50.7	Low	51.2	Low	54 Å²	54	104.2 Å²	104.2	38%	0.378	53%	0.533	S	S	.	.	H	α-helix	trans	-75.3	-32.6	174.3	52.4	0	0	0	0	112.5	I30 M31 E32 N38	I30-S34 WeakPolarHBondContact O-CB 3.2Å; I30-S34 PolarHBondContact O-N 3.39Å; I30-S34 PolarHBondContact O-OG 2.96Å; M31-S34 WeakPolarHBondContact CA-OG 3.42Å; M31-S34 PolarHBondContact O-OG 3.3Å; M31-S34 VanDerWaalsContact O-OG 3.14Å; E32-S34 VanDerWaalsContact C-N 3.34Å; E32-S34 PolarHBondContact O-N 2.79Å; S34-N38 PolarHBondContact O-N 2.85Å
35	L	41.2	Very low	49.3	Very low	111 Å²	111	108.2 Å²	108.2	58%	0.581	54%	0.54	S	S	*	.	H	α-helix	trans	-67.2	-40	174	-147.6	84.5	0	0	0	112.5	M31 E32 I39	M31-L35 WeakPolarHBondContact O-CB 3.34Å; M31-L35 PolarHBondContact O-N 3.17Å; E32-L35 PolarHBondContact O-N 3Å; L35-I39 WeakPolarHBondContact O-CG1 3.35Å
36	L	40.4	Very low	48	Very low	118 Å²	118	108.7 Å²	108.7	62%	0.618	53%	0.53	S	S	*	.	H	α-helix	trans	-65.4	-42.9	175.9	-97.8	82.5	0	0	0	112.1	E32 N38 I39	E32-L36 HydrophobicContact CG-CD1 4.39Å; E32-L36 WeakPolarHBondContact O-CD1 3.37Å; E32-L36 PolarHBondContact O-N 2.91Å; L36-N38 VanDerWaalsContact C-N 3.31Å; L36-N38 PolarHBondContact O-N 3.33Å; L36-I39 PolarHBondContact O-N 2.75Å
37	K	39.8	Very low	46.6	Very low	153 Å²	153	115.7 Å²	115.7	67%	0.665	55%	0.551	S	S	*	*	H	α-helix	trans	-63.9	-34	-176.5	-120.2	-179.5	178.3	-177.4	0	113.4	H33 I39	H33-K37 PolarHBondContact O-N 3.25Å; K37-I39 PolarHBondContact O-N 3.48Å
38	N	36.5	Very low	46	Very low	113 Å²	113	110.8 Å²	110.8	60%	0.604	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	4.6	-178.2	-79.5	20.7	0	0	0	114.9	S34 L36 N516	S34-N38 PolarHBondContact O-N 2.85Å; L36-N38 VanDerWaalsContact C-N 3.31Å; L36-N38 PolarHBondContact O-N 3.33Å; N38-N516 PolarHBondContact ND2-OD1 2.96Å
39	I	41.3	Very low	45.8	Very low	85 Å²	85	116.9 Å²	116.9	44%	0.436	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-17.7	-179	-66.9	174.9	0	0	0	112.6	L35 L36 K37	L35-I39 WeakPolarHBondContact O-CG1 3.35Å; L36-I39 PolarHBondContact O-N 2.75Å; K37-I39 PolarHBondContact O-N 3.48Å
40	Q	36.7	Very low	46.4	Very low	69 Å²	69	110.6 Å²	110.6	32%	0.322	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-21.6	-161	-161.1	166.7	-43.1	0	0	115.8	I75 E76	Q40-I75 HydrophobicContact CG-CD1 4.49Å; Q40-E76 PolarHBondContact NE2-OE1 3.07Å
41	E	37.4	Very low	47.2	Very low	93 Å²	93	106 Å²	106	44%	0.435	50%	0.497	S	S	.	.			trans	-96.9	14.8	-168.9	-58.1	-163.2	160.8	0	0	115.5	V43 K514	E41-V43 VanDerWaalsContact C-N 3.29Å; E41-V43 PolarHBondContact O-N 2.86Å; E41-K514 IonicContact OE1-NZ 2.86Å; E41-K514 PolarHBondContact OE1-NZ 3.06Å; E41-K514 WeakPolarHBondContact OE2-CD 3.41Å; E41-K514 WeakPolarHBondContact OE2-CE 3.27Å; E41-K514 IonicContact OE2-NZ 3.97Å; E41-K514 PolarHBondContact OE2-NZ 2.85Å
42	N	34.6	Very low	48.5	Very low	135 Å²	135	108 Å²	108	72%	0.722	51%	0.509	S	S	*	.			trans	-91.3	21.4	-178.2	-127	48.4	0	0	0	113.6
43	V	40	Very low	50	Low	86 Å²	86	103.9 Å²	103.9	52%	0.521	49%	0.492	S	S	.	.			trans	-101.5	104	-175.4	-179	0	0	0	0	109.9	E41 Y45	E41-V43 VanDerWaalsContact C-N 3.29Å; E41-V43 PolarHBondContact O-N 2.86Å; V43-Y45 PolarHBondContact O-N 3Å
44	E	39.4	Very low	51.4	Low	127 Å²	127	99 Å²	99	59%	0.593	48%	0.478	S	S	*	.			trans	-55.5	132.1	158	-73.8	-177.2	147	0	0	109	W46	E44-W46 VanDerWaalsContact O-CD1 3.3Å; E44-W46 PolarHBondContact O-N 2.92Å; E44-W46 PolarHBondContact OE2-NE1 3.36Å
45	Y	36.6	Very low	53.1	Low	173 Å²	173	100.4 Å²	100.4	68%	0.678	49%	0.485	S	S	*	.			trans	-82	50.3	-166.4	-141.3	-87.8	0	0	0	113.4	V43 R47	V43-Y45 PolarHBondContact O-N 3Å; Y45-R47 PolarHBondContact O-N 2.95Å
46	W	42.5	Very low	55.4	Low	92 Å²	92	95.1 Å²	95.1	35%	0.348	46%	0.458	S	S	.	.			trans	-49.2	136.1	166	-62.7	108	0	0	0	109.7	E44 L48 Y126	E44-W46 VanDerWaalsContact O-CD1 3.3Å; E44-W46 PolarHBondContact O-N 2.92Å; E44-W46 PolarHBondContact OE2-NE1 3.36Å; W46-L48 HydrophobicContact CB-CD1 4.13Å; W46-L48 HydrophobicContact CB-CG 3.89Å; W46-L48 PolarHBondContact O-N 3.24Å; W46-Y126 AromaticContact CH2-CE2 3.51Å; W46-Y126 HydrophobicContact CH2-CE2 3.51Å; W46-Y126 AromaticContact CH2-CZ 3.94Å; W46-Y126 WeakPolarHBondContact CH2-OH 3.43Å; W46-Y126 HydrophobicContact CZ2-CE2 4.28Å; W46-Y126 AromaticContact CZ3-CE2 3.64Å; W46-Y126 HydrophobicContact CZ3-CE2 3.64Å
47	R	45.3	Very low	57.6	Low	234 Å²	234	94.2 Å²	94.2	88%	0.883	45%	0.453	S	S	*	.			trans	-73.7	57.4	172.7	-77.4	-176.3	170.8	171.9	-2.1	110.9	Y45 R49	Y45-R47 PolarHBondContact O-N 2.95Å; R47-R49 PolarHBondContact O-N 3.18Å; R47-R49 VanDerWaalsContact O-N 3.16Å
48	L	55	Low	59.7	Low	47 Å²	47	96.4 Å²	96.4	25%	0.246	47%	0.466	C	S	.	.			trans	-57.8	115.7	175.5	-72.6	156.2	0	0	0	108.8	W46 F81	W46-L48 HydrophobicContact CB-CD1 4.13Å; W46-L48 HydrophobicContact CB-CG 3.89Å; W46-L48 PolarHBondContact O-N 3.24Å; L48-F81 HydrophobicContact CB-CB 4.42Å; L48-F81 HydrophobicContact CB-CD1 3.74Å; L48-F81 HydrophobicContact CB-CG 4.39Å; L48-F81 WeakPolarHBondContact O-CD1 3.19Å; L48-F81 WeakPolarHBondContact O-CE1 3.36Å
49	R	64.1	Low	62	Low	164 Å²	164	95.3 Å²	95.3	62%	0.619	46%	0.457	S	S	*	.			trans	-67.9	135.3	171.9	-174.4	-178.3	177.9	171.4	0.2	108.8	R47	R47-R49 PolarHBondContact O-N 3.18Å; R47-R49 VanDerWaalsContact O-N 3.16Å
50	S	76.1	Confident	64.1	Low	16 Å²	16	92.4 Å²	92.4	11%	0.112	45%	0.448	C	S	.	.			trans	-60.5	149.6	173.6	-156	0	0	0	0	110.6	D52 E79	S50-D52 VanDerWaalsContact C-N 3.31Å; S50-E79 WeakPolarHBondContact CB-OE2 3.31Å; S50-E79 PolarHBondContact OG-OE2 2.97Å
51	L	82.3	Confident	66.5	Low	4 Å²	4	92.9 Å²	92.9	2%	0.021	45%	0.453	C	S	.	.			trans	-88.6	-1.6	175.6	-61.3	174.8	0	0	0	112.5	L53 V68 C80 I95	L51-L53 HydrophobicContact CB-CD1 3.92Å; L51-L53 HydrophobicContact CB-CG 3.75Å; L51-L53 HydrophobicContact CD1-CD1 4.18Å; L51-L53 WeakPolarHBondContact O-CG 3.17Å; L51-L53 PolarHBondContact O-N 2.97Å; L51-V68 HydrophobicContact CD1-CB 4.33Å; L51-V68 HydrophobicContact CD1-CG1 4.23Å; L51-C80 HydrophobicContact CB-CB 4.22Å; L51-C80 WeakPolarHBondContact CB-O 3.25Å; L51-C80 HydrophobicContact CD1-CB 4.1Å; L51-C80 WeakPolarHBondContact CG-O 3.45Å; L51-C80 PolarHBondContact N-O 2.83Å; L51-I95 HydrophobicContact CD2-CB 4.39Å; L51-I95 HydrophobicContact CD2-CG2 3.57Å
52	D	78.8	Confident	68.8	Low	125 Å²	125	90.5 Å²	90.5	67%	0.668	45%	0.449	S	S	*	.			trans	53.5	22.3	178.1	-57.5	-27.9	0	0	0	114.8	S50 G54	S50-D52 VanDerWaalsContact C-N 3.31Å; D52-G54 PolarHBondContact O-N 3.15Å
53	L	80.4	Confident	71.5	Confident	48 Å²	48	85.7 Å²	85.7	25%	0.251	42%	0.421	S	S	.	.			trans	-74.2	-6.9	-174.1	-61.9	178.1	0	0	0	114.9	L51 Y63 R67 V68 C80	L51-L53 HydrophobicContact CB-CD1 3.92Å; L51-L53 HydrophobicContact CB-CG 3.75Å; L51-L53 HydrophobicContact CD1-CD1 4.18Å; L51-L53 WeakPolarHBondContact O-CG 3.17Å; L51-L53 PolarHBondContact O-N 2.97Å; L53-Y63 HydrophobicContact CB-CE1 4.43Å; L53-Y63 PolarHBondContact O-OH 2.69Å; L53-R67 HydrophobicContact CD1-CB 3.94Å; L53-R67 HydrophobicContact CD2-CB 4.34Å; L53-V68 HydrophobicContact CD1-CB 4.19Å; L53-V68 HydrophobicContact CD1-CG2 3.77Å; L53-V68 HydrophobicContact CD2-CG2 4.04Å; L53-V68 HydrophobicContact CG-CG2 4.48Å; L53-C80 HydrophobicContact CB-CB 4.32Å; L53-C80 HydrophobicContact CD1-CB 3.79Å; L53-C80 HydrophobicContact CG-CB 4.34Å
54	G	81.2	Confident	73.9	Confident	32 Å²	32	81.6 Å²	81.6	33%	0.33	40%	0.396	S	S	.	.			trans	95.3	177.2	-171.7	0	0	0	0	0	114.3	D52 C56	D52-G54 PolarHBondContact O-N 3.15Å; G54-C56 PolarHBondContact O-N 3.39Å
55	P	85.3	Confident	76.2	Confident	83 Å²	83	79.1 Å²	79.1	54%	0.539	39%	0.385	S	S	.	.			trans	-70.2	123	-171.8	27.5	-34.6	0	0	0	112.5	Y63 N78	P55-Y63 WeakPolarHBondContact O-CE2 3.46Å; P55-N78 WeakPolarHBondContact CA-O 3.32Å; P55-N78 WeakPolarHBondContact CB-ND2 3.28Å
56	C	90.1	Very high	78.7	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	39%	0.386	C	S	.	.			trans	-101.2	-17.2	-171.6	58.8	0	0	0	0	115.2	G54 Q58 E59 G60 Y63 C64 C73 N78 E79	G54-C56 PolarHBondContact O-N 3.39Å; C56-Q58 PolarHBondContact O-N 2.78Å; C56-E59 PolarHBondContact O-N 3.19Å; C56-G60 PolarHBondContact O-N 2.85Å; C56-Y63 HydrophobicContact CB-CD1 3.67Å; C56-Y63 HydrophobicContact CB-CE1 4.39Å; C56-Y63 HydrophobicContact CB-CG 3.92Å; C56-C64 VanDerWaalsContact CB-SG 3.56Å; C56-C73 HydrophobicContact CB-CB 3.74Å; C56-C73 WeakPolarHBondContact CB-SG 3.08Å; C56-C73 WeakPolarHBondContact SG-CA 3.38Å; C56-C73 WeakPolarHBondContact SG-CB 3.43Å; C56-C73 CovalentContact SG-SG 2.03Å; C56-C73 PolarHBondContact SG-SG 3.36Å; C56-N78 PolarHBondContact N-OD1 3.2Å; C56-E79 VanDerWaalsContact SG-C 3.53Å
57	L	86.7	Confident	80.8	Confident	99 Å²	99	80.8 Å²	80.8	52%	0.518	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.9	-166.7	-173.2	66.4	0	0	0	115.1	I75 N78	L57-I75 HydrophobicContact CD1-CG2 4.3Å; L57-N78 HydrophobicContact CB-CB 4.47Å; L57-N78 WeakPolarHBondContact CB-OD1 3.32Å; L57-N78 PolarHBondContact N-OD1 3.16Å
58	Q	82.7	Confident	82.8	Confident	200 Å²	200	70.4 Å²	70.4	94%	0.935	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-32.3	177.6	-65.8	-176.3	-5.7	0	0	113.7	C56	C56-Q58 PolarHBondContact O-N 2.78Å
59	E	84.6	Confident	84.3	Confident	89 Å²	89	71.3 Å²	71.3	42%	0.416	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-11.8	-178.6	-93.9	-180	-121.6	0	0	112.2	C56 Y63 R66	C56-E59 PolarHBondContact O-N 3.19Å; E59-Y63 HydrophobicContact CB-CD2 4.12Å; E59-Y63 HydrophobicContact CB-CG 4.4Å; E59-R66 IonicContact OE2-CZ 2.65Å; E59-R66 IonicContact OE2-NH1 2.7Å; E59-R66 PolarHBondContact OE2-NH1 3.04Å
60	G	87.3	Confident	85.5	Confident	25 Å²	25	66.2 Å²	66.2	26%	0.258	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	-147.9	-175.9	0	0	0	0	0	112.7	C56 A62 Y63	C56-G60 PolarHBondContact O-N 2.85Å; G60-A62 PolarHBondContact O-N 2.8Å; G60-A62 VanDerWaalsContact O-N 3.09Å; G60-Y63 VanDerWaalsContact O-CB 3.26Å; G60-Y63 WeakPolarHBondContact O-CB 3.27Å; G60-Y63 PolarHBondContact O-N 3.36Å
61	D	85.2	Confident	86.2	Confident	79 Å²	79	65.5 Å²	65.5	42%	0.422	35%	0.347	S	S	.	.	H	α-helix	trans	-55.9	-28.4	180	-64.7	-27.1	0	0	0	113.4	Y63 C64 M65 M72 C73	D61-Y63 VanDerWaalsContact C-N 3.25Å; D61-Y63 PolarHBondContact O-N 3.26Å; D61-C64 PolarHBondContact O-N 3.11Å; D61-M65 WeakPolarHBondContact O-CB 3.42Å; D61-M65 WeakPolarHBondContact O-CG 3.14Å; D61-M65 PolarHBondContact O-N 2.93Å; D61-M72 WeakPolarHBondContact OD1-CA 3.38Å; D61-M72 WeakPolarHBondContact OD1-CB 3.44Å; D61-C73 PolarHBondContact OD1-N 3.28Å
62	A	87.5	Confident	86.6	Confident	42 Å²	42	67.4 Å²	67.4	35%	0.347	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-35	177.6	0	0	0	0	0	112	G60 C64 R66	G60-A62 PolarHBondContact O-N 2.8Å; G60-A62 VanDerWaalsContact O-N 3.09Å; A62-C64 VanDerWaalsContact C-N 3.31Å; A62-C64 PolarHBondContact O-N 2.76Å; A62-R66 VanDerWaalsContact O-CB 3.29Å; A62-R66 WeakPolarHBondContact O-CB 3.4Å; A62-R66 VanDerWaalsContact O-CD 3.23Å; A62-R66 WeakPolarHBondContact O-CD 3.46Å; A62-R66 WeakPolarHBondContact O-CG 3.33Å; A62-R66 PolarHBondContact O-N 2.89Å; A62-R66 VanDerWaalsContact O-N 3.09Å
63	Y	90.1	Very high	87.1	Confident	34 Å²	34	62.1 Å²	62.1	13%	0.133	33%	0.329	C	S	.	.	H	α-helix	trans	-57.7	-47.1	175.2	-171.7	-89	0	0	0	111.7	L53 P55 C56 E59 G60 D61 R67	L53-Y63 HydrophobicContact CB-CE1 4.43Å; L53-Y63 PolarHBondContact O-OH 2.69Å; P55-Y63 WeakPolarHBondContact O-CE2 3.46Å; C56-Y63 HydrophobicContact CB-CD1 3.67Å; C56-Y63 HydrophobicContact CB-CE1 4.39Å; C56-Y63 HydrophobicContact CB-CG 3.92Å; E59-Y63 HydrophobicContact CB-CD2 4.12Å; E59-Y63 HydrophobicContact CB-CG 4.4Å; G60-Y63 VanDerWaalsContact O-CB 3.26Å; G60-Y63 WeakPolarHBondContact O-CB 3.27Å; G60-Y63 PolarHBondContact O-N 3.36Å; D61-Y63 VanDerWaalsContact C-N 3.25Å; D61-Y63 PolarHBondContact O-N 3.26Å; Y63-R67 VanDerWaalsContact CD2-NH1 3.32Å; Y63-R67 VanDerWaalsContact CE2-CZ 3.5Å; Y63-R67 VanDerWaalsContact CE2-NH2 3.32Å; Y63-R67 PolarHBondContact O-NH1 3.15Å
64	C	90.8	Very high	87.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-75.3	-51.5	-175.3	-54.3	0	0	0	0	109.8	C56 D61 A62 R66 R67 V68 S71 C80	C56-C64 VanDerWaalsContact CB-SG 3.56Å; D61-C64 PolarHBondContact O-N 3.11Å; A62-C64 VanDerWaalsContact C-N 3.31Å; A62-C64 PolarHBondContact O-N 2.76Å; C64-R66 VanDerWaalsContact C-N 3.26Å; C64-R66 PolarHBondContact O-N 2.83Å; C64-R67 PolarHBondContact O-N 2.73Å; C64-V68 PolarHBondContact O-N 2.89Å; C64-S71 WeakPolarHBondContact CB-OG 3.07Å; C64-S71 PolarHBondContact O-OG 2.93Å; C64-S71 VanDerWaalsContact O-OG 3.1Å; C64-C80 VanDerWaalsContact CA-SG 3.51Å; C64-C80 HydrophobicContact CB-CB 3.7Å; C64-C80 WeakPolarHBondContact CB-SG 3.47Å; C64-C80 VanDerWaalsContact SG-CA 3.56Å; C64-C80 WeakPolarHBondContact SG-CB 3.48Å; C64-C80 CovalentContact SG-SG 2.04Å; C64-C80 PolarHBondContact SG-SG 2.72Å
65	M	88.6	Confident	87.5	Confident	75 Å²	75	63.8 Å²	63.8	37%	0.369	33%	0.332	S	S	.	.	H	α-helix	trans	-60.3	-30.3	-178.7	-72.5	-175.2	58.6	0	0	113.9	D61 R67 V68 S71 K83	D61-M65 WeakPolarHBondContact O-CB 3.42Å; D61-M65 WeakPolarHBondContact O-CG 3.14Å; D61-M65 PolarHBondContact O-N 2.93Å; M65-R67 VanDerWaalsContact C-N 3.28Å; M65-R67 PolarHBondContact O-N 2.91Å; M65-V68 WeakPolarHBondContact CA-O 3.3Å; M65-S71 WeakPolarHBondContact CG-O 3.37Å; M65-S71 PolarHBondContact N-OG 2.85Å; M65-K83 PolarHBondContact SD-NZ 3.28Å
66	R	87.4	Confident	87.3	Confident	181 Å²	181	65.9 Å²	65.9	68%	0.683	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.4	173.6	-76	167.2	-179.6	172.8	-5	113.9	E59 A62 C64	E59-R66 IonicContact OE2-CZ 2.65Å; E59-R66 IonicContact OE2-NH1 2.7Å; E59-R66 PolarHBondContact OE2-NH1 3.04Å; A62-R66 VanDerWaalsContact O-CB 3.29Å; A62-R66 WeakPolarHBondContact O-CB 3.4Å; A62-R66 VanDerWaalsContact O-CD 3.23Å; A62-R66 WeakPolarHBondContact O-CD 3.46Å; A62-R66 WeakPolarHBondContact O-CG 3.33Å; A62-R66 PolarHBondContact O-N 2.89Å; A62-R66 VanDerWaalsContact O-N 3.09Å; C64-R66 VanDerWaalsContact C-N 3.26Å; C64-R66 PolarHBondContact O-N 2.83Å
67	R	87.2	Confident	87	Confident	120 Å²	120	70.5 Å²	70.5	45%	0.453	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-43.1	-175.2	-70.7	172.1	175.4	74.1	-0.4	112.1	L53 Y63 C64 M65	L53-R67 HydrophobicContact CD1-CB 3.94Å; L53-R67 HydrophobicContact CD2-CB 4.34Å; Y63-R67 VanDerWaalsContact CD2-NH1 3.32Å; Y63-R67 VanDerWaalsContact CE2-CZ 3.5Å; Y63-R67 VanDerWaalsContact CE2-NH2 3.32Å; Y63-R67 PolarHBondContact O-NH1 3.15Å; C64-R67 PolarHBondContact O-N 2.73Å; M65-R67 VanDerWaalsContact C-N 3.28Å; M65-R67 PolarHBondContact O-N 2.91Å
68	V	88.2	Confident	87	Confident	15 Å²	15	68.6 Å²	68.6	9%	0.091	35%	0.345	C	S	.	.	S	Bend	trans	-135.5	114.7	177.6	177.1	0	0	0	0	107.8	L51 L53 C64 M65 S71 I95 C97	L51-V68 HydrophobicContact CD1-CB 4.33Å; L51-V68 HydrophobicContact CD1-CG1 4.23Å; L53-V68 HydrophobicContact CD1-CB 4.19Å; L53-V68 HydrophobicContact CD1-CG2 3.77Å; L53-V68 HydrophobicContact CD2-CG2 4.04Å; L53-V68 HydrophobicContact CG-CG2 4.48Å; C64-V68 PolarHBondContact O-N 2.89Å; M65-V68 WeakPolarHBondContact CA-O 3.3Å; V68-S71 WeakPolarHBondContact O-CB 3.2Å; V68-S71 PolarHBondContact O-N 3.35Å; V68-S71 PolarHBondContact O-OG 2.75Å; V68-I95 WeakPolarHBondContact CG2-O 3.45Å; V68-C97 HydrophobicContact CG1-CB 4.27Å
69	A	86.7	Confident	87.3	Confident	66 Å²	66	62.7 Å²	62.7	55%	0.545	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	149.9	174.7	0	0	0	0	0	110.9	S71 C97	A69-S71 VanDerWaalsContact C-N 3.25Å; A69-S71 PolarHBondContact O-N 3.12Å; A69-C97 WeakPolarHBondContact O-CB 3.28Å
70	N	87.6	Confident	87.6	Confident	58 Å²	58	58.5 Å²	58.5	31%	0.31	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	28.3	-178.4	-50.2	-38.2	0	0	0	115.2	K83 Y86 C97	N70-K83 WeakPolarHBondContact O-CB 3.47Å; N70-K83 WeakPolarHBondContact O-CG 3.38Å; N70-K83 PolarHBondContact O-N 2.84Å; N70-Y86 HydrophobicContact CB-CD1 3.58Å; N70-Y86 HydrophobicContact CB-CD2 4.2Å; N70-Y86 HydrophobicContact CB-CE1 3.6Å; N70-Y86 HydrophobicContact CB-CE2 4.21Å; N70-Y86 HydrophobicContact CB-CG 3.92Å; N70-Y86 VanDerWaalsContact CG-CE1 3.45Å; N70-Y86 WeakPolarHBondContact ND2-CE1 3.45Å; N70-C97 HydrophobicContact CB-CB 4.14Å
71	S	90.8	Very high	87.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	164.8	169.5	66.9	0	0	0	0	113	C64 M65 V68 A69 F81 K83	C64-S71 WeakPolarHBondContact CB-OG 3.07Å; C64-S71 PolarHBondContact O-OG 2.93Å; C64-S71 VanDerWaalsContact O-OG 3.1Å; M65-S71 WeakPolarHBondContact CG-O 3.37Å; M65-S71 PolarHBondContact N-OG 2.85Å; V68-S71 WeakPolarHBondContact O-CB 3.2Å; V68-S71 PolarHBondContact O-N 3.35Å; V68-S71 PolarHBondContact O-OG 2.75Å; A69-S71 VanDerWaalsContact C-N 3.25Å; A69-S71 PolarHBondContact O-N 3.12Å; S71-F81 CarbonylContact C-O 3.4Å; S71-F81 WeakPolarHBondContact CA-O 3.41Å; S71-F81 VanDerWaalsContact CB-O 3.23Å; S71-F81 WeakPolarHBondContact CB-O 3.3Å; S71-K83 WeakPolarHBondContact O-CE 3.46Å
72	M	91.1	Very high	88	Confident	45 Å²	45	54 Å²	54	22%	0.222	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	159.6	179.2	61.3	-179.2	-173.7	0	0	110.7	D61 C80 F81 K83 P84	D61-M72 WeakPolarHBondContact OD1-CA 3.38Å; D61-M72 WeakPolarHBondContact OD1-CB 3.44Å; M72-C80 WeakPolarHBondContact O-CA 3.35Å; M72-F81 PolarHBondContact N-O 3.39Å; M72-F81 PolarHBondContact O-N 2.99Å; M72-K83 HydrophobicContact CB-CG 3.99Å; M72-K83 HydrophobicContact CG-CG 4.08Å; M72-K83 HydrophobicContact SD-CG 4.2Å; M72-P84 HydrophobicContact CE-CG 4.38Å
73	C	90	Very high	88	Confident	14 Å²	14	54.9 Å²	54.9	10%	0.095	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.4	179.6	-176.4	0	0	0	0	111	C56 D61 I75	C56-C73 HydrophobicContact CB-CB 3.74Å; C56-C73 WeakPolarHBondContact CB-SG 3.08Å; C56-C73 WeakPolarHBondContact SG-CA 3.38Å; C56-C73 WeakPolarHBondContact SG-CB 3.43Å; C56-C73 CovalentContact SG-SG 2.03Å; C56-C73 PolarHBondContact SG-SG 3.36Å; D61-C73 PolarHBondContact OD1-N 3.28Å; C73-I75 PolarHBondContact O-N 3.21Å
74	S	86.5	Confident	87.6	Confident	28 Å²	28	57.8 Å²	57.8	20%	0.196	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	115.7	168.6	173.8	0	0	0	0	109.8	E76 K77 N78 E79 F81	S74-E76 PolarHBondContact O-N 2.91Å; S74-E76 PolarHBondContact OG-N 2.85Å; S74-K77 PolarHBondContact O-N 3.13Å; S74-K77 PolarHBondContact OG-N 3.46Å; S74-N78 WeakPolarHBondContact O-CA 3.16Å; S74-N78 PolarHBondContact O-N 3.37Å; S74-E79 PolarHBondContact N-O 2.68Å; S74-F81 VanDerWaalsContact CB-CE2 3.44Å
75	I	83.3	Confident	87.2	Confident	87 Å²	87	58.3 Å²	58.3	45%	0.446	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-33.3	174.4	-55.3	175	0	0	0	110.6	Q40 L57 C73	Q40-I75 HydrophobicContact CG-CD1 4.49Å; L57-I75 HydrophobicContact CD1-CG2 4.3Å; C73-I75 PolarHBondContact O-N 3.21Å
76	E	82.2	Confident	87.2	Confident	126 Å²	126	58 Å²	58	59%	0.589	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-36.7	-177.2	-62.5	-173.9	165	0	0	113.5	Q40 S74	Q40-E76 PolarHBondContact NE2-OE1 3.07Å; S74-E76 PolarHBondContact O-N 2.91Å; S74-E76 PolarHBondContact OG-N 2.85Å
77	K	83.4	Confident	87.3	Confident	97 Å²	97	49.8 Å²	49.8	42%	0.422	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-13.1	-174.7	-64.6	179.8	-179.4	174.7	0	113.6	S74 E79 F81	S74-K77 PolarHBondContact O-N 3.13Å; S74-K77 PolarHBondContact OG-N 3.46Å; K77-E79 HydrophobicContact CB-CB 4.07Å; K77-E79 HydrophobicContact CB-CG 4.41Å; K77-E79 PolarHBondContact O-N 2.74Å; K77-F81 HydrophobicContact CB-CE2 4.13Å; K77-F81 HydrophobicContact CB-CZ 4.35Å; K77-F81 HydrophobicContact CD-CE1 4.48Å; K77-F81 HydrophobicContact CD-CE2 3.92Å; K77-F81 HydrophobicContact CD-CZ 3.52Å
78	N	87	Confident	87.5	Confident	59 Å²	59	44.9 Å²	44.9	32%	0.316	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	36.6	-170	-172.3	19.1	0	0	0	112	P55 C56 L57 S74	P55-N78 WeakPolarHBondContact CA-O 3.32Å; P55-N78 WeakPolarHBondContact CB-ND2 3.28Å; C56-N78 PolarHBondContact N-OD1 3.2Å; L57-N78 HydrophobicContact CB-CB 4.47Å; L57-N78 WeakPolarHBondContact CB-OD1 3.32Å; L57-N78 PolarHBondContact N-OD1 3.16Å; S74-N78 WeakPolarHBondContact O-CA 3.16Å; S74-N78 PolarHBondContact O-N 3.37Å
79	E	87.8	Confident	87.5	Confident	77 Å²	77	45.1 Å²	45.1	36%	0.36	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.6	-173.9	-81.6	173.9	-154	0	0	110.3	S50 C56 S74 K77 F81	S50-E79 WeakPolarHBondContact CB-OE2 3.31Å; S50-E79 PolarHBondContact OG-OE2 2.97Å; C56-E79 VanDerWaalsContact SG-C 3.53Å; S74-E79 PolarHBondContact N-O 2.68Å; K77-E79 HydrophobicContact CB-CB 4.07Å; K77-E79 HydrophobicContact CB-CG 4.41Å; K77-E79 PolarHBondContact O-N 2.74Å; E79-F81 HydrophobicContact CB-CD2 4.46Å; E79-F81 HydrophobicContact CB-CE2 3.52Å; E79-F81 HydrophobicContact CB-CZ 3.81Å; E79-F81 VanDerWaalsContact O-CD2 3.3Å; E79-F81 WeakPolarHBondContact O-CD2 3.3Å; E79-F81 WeakPolarHBondContact O-CE2 3.32Å; E79-F81 WeakPolarHBondContact OE2-CZ 3.2Å
80	C	90.5	Very high	87.5	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	134.2	176.1	-63.9	0	0	0	0	111.8	L51 L53 C64 M72	L51-C80 HydrophobicContact CB-CB 4.22Å; L51-C80 WeakPolarHBondContact CB-O 3.25Å; L51-C80 HydrophobicContact CD1-CB 4.1Å; L51-C80 WeakPolarHBondContact CG-O 3.45Å; L51-C80 PolarHBondContact N-O 2.83Å; L53-C80 HydrophobicContact CB-CB 4.32Å; L53-C80 HydrophobicContact CD1-CB 3.79Å; L53-C80 HydrophobicContact CG-CB 4.34Å; C64-C80 VanDerWaalsContact CA-SG 3.51Å; C64-C80 HydrophobicContact CB-CB 3.7Å; C64-C80 WeakPolarHBondContact CB-SG 3.47Å; C64-C80 VanDerWaalsContact SG-CA 3.56Å; C64-C80 WeakPolarHBondContact SG-CB 3.48Å; C64-C80 CovalentContact SG-SG 2.04Å; C64-C80 PolarHBondContact SG-SG 2.72Å; M72-C80 WeakPolarHBondContact O-CA 3.35Å
81	F	89.8	Confident	87.4	Confident	10 Å²	10	46 Å²	46	4%	0.044	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	161.6	175.1	-62.2	-86.7	0	0	0	110.1	L48 S71 M72 S74 K77 E79	L48-F81 HydrophobicContact CB-CB 4.42Å; L48-F81 HydrophobicContact CB-CD1 3.74Å; L48-F81 HydrophobicContact CB-CG 4.39Å; L48-F81 WeakPolarHBondContact O-CD1 3.19Å; L48-F81 WeakPolarHBondContact O-CE1 3.36Å; S71-F81 CarbonylContact C-O 3.4Å; S71-F81 WeakPolarHBondContact CA-O 3.41Å; S71-F81 VanDerWaalsContact CB-O 3.23Å; S71-F81 WeakPolarHBondContact CB-O 3.3Å; M72-F81 PolarHBondContact N-O 3.39Å; M72-F81 PolarHBondContact O-N 2.99Å; S74-F81 VanDerWaalsContact CB-CE2 3.44Å; K77-F81 HydrophobicContact CB-CE2 4.13Å; K77-F81 HydrophobicContact CB-CZ 4.35Å; K77-F81 HydrophobicContact CD-CE1 4.48Å; K77-F81 HydrophobicContact CD-CE2 3.92Å; K77-F81 HydrophobicContact CD-CZ 3.52Å; E79-F81 HydrophobicContact CB-CD2 4.46Å; E79-F81 HydrophobicContact CB-CE2 3.52Å; E79-F81 HydrophobicContact CB-CZ 3.81Å; E79-F81 VanDerWaalsContact O-CD2 3.3Å; E79-F81 WeakPolarHBondContact O-CD2 3.3Å; E79-F81 WeakPolarHBondContact O-CE2 3.32Å; E79-F81 WeakPolarHBondContact OE2-CZ 3.2Å
82	C	90.9	Very high	87	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	148.4	167.5	-61.8	0	0	0	0	110.9	Y86 C97	C82-Y86 WeakPolarHBondContact CB-O 3.46Å; C82-C97 WeakPolarHBondContact CA-SG 3.49Å; C82-C97 HydrophobicContact CB-CB 3.78Å; C82-C97 WeakPolarHBondContact CB-SG 3.13Å; C82-C97 VanDerWaalsContact SG-CA 3.55Å; C82-C97 WeakPolarHBondContact SG-CB 3.47Å; C82-C97 CovalentContact SG-SG 2.04Å; C82-C97 PolarHBondContact SG-SG 3.24Å
83	K	87.9	Confident	86.5	Confident	59 Å²	59	56.7 Å²	56.7	26%	0.257	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-65.6	159.3	174.3	-71.4	-177.3	-175	-169.4	0	111	M65 N70 S71 M72 G85 Y86	M65-K83 PolarHBondContact SD-NZ 3.28Å; N70-K83 WeakPolarHBondContact O-CB 3.47Å; N70-K83 WeakPolarHBondContact O-CG 3.38Å; N70-K83 PolarHBondContact O-N 2.84Å; S71-K83 WeakPolarHBondContact O-CE 3.46Å; M72-K83 HydrophobicContact CB-CG 3.99Å; M72-K83 HydrophobicContact CG-CG 4.08Å; M72-K83 HydrophobicContact SD-CG 4.2Å; K83-G85 PolarHBondContact O-N 2.92Å; K83-Y86 HydrophobicContact CB-CD2 4.01Å; K83-Y86 WeakPolarHBondContact O-CB 3.38Å; K83-Y86 PolarHBondContact O-N 3.36Å
84	P	81.8	Confident	86.2	Confident	96 Å²	96	57.2 Å²	57.2	62%	0.623	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	139.3	171.9	-24.4	35.3	0	0	0	111.1	M72 Y86	M72-P84 HydrophobicContact CE-CG 4.38Å; P84-Y86 VanDerWaalsContact C-N 3.32Å; P84-Y86 WeakPolarHBondContact O-CD2 3.17Å
85	G	82.6	Confident	86.2	Confident	11 Å²	11	57.7 Å²	57.7	11%	0.113	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	6.8	-170.9	0	0	0	0	0	115.6	K83 T99 L100 H330	K83-G85 PolarHBondContact O-N 2.92Å; G85-T99 CarbonylContact O-C 3.5Å; G85-T99 WeakPolarHBondContact O-CA 3.29Å; G85-L100 PolarHBondContact O-N 2.72Å; G85-H330 VanDerWaalsContact CA-CD2 3.42Å; G85-H330 WeakPolarHBondContact CA-CD2 3.14Å
86	Y	88.6	Confident	86.5	Confident	67 Å²	67	54.7 Å²	54.7	26%	0.263	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144	175.1	-62.6	-99.5	0	0	0	112.6	N70 C82 K83 P84 K98	N70-Y86 HydrophobicContact CB-CD1 3.58Å; N70-Y86 HydrophobicContact CB-CD2 4.2Å; N70-Y86 HydrophobicContact CB-CE1 3.6Å; N70-Y86 HydrophobicContact CB-CE2 4.21Å; N70-Y86 HydrophobicContact CB-CG 3.92Å; N70-Y86 VanDerWaalsContact CG-CE1 3.45Å; N70-Y86 WeakPolarHBondContact ND2-CE1 3.45Å; C82-Y86 WeakPolarHBondContact CB-O 3.46Å; K83-Y86 HydrophobicContact CB-CD2 4.01Å; K83-Y86 WeakPolarHBondContact O-CB 3.38Å; K83-Y86 PolarHBondContact O-N 3.36Å; P84-Y86 VanDerWaalsContact C-N 3.32Å; P84-Y86 WeakPolarHBondContact O-CD2 3.17Å; Y86-K98 CarbonylContact C-O 3.56Å; Y86-K98 WeakPolarHBondContact CA-O 3.37Å
87	V	90	Very high	86.9	Confident	10 Å²	10	49.2 Å²	49.2	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.7	177.2	-72.2	0	0	0	0	112.1	I89 C97 K98 L100 A124 A128	V87-I89 HydrophobicContact CG2-CD1 4.12Å; V87-I89 HydrophobicContact CG2-CG1 4.25Å; V87-I89 PolarHBondContact O-N 2.89Å; V87-C97 WeakPolarHBondContact O-CA 3.04Å; V87-K98 PolarHBondContact N-O 2.96Å; V87-K98 PolarHBondContact O-N 3.21Å; V87-L100 HydrophobicContact CB-CD2 4.36Å; V87-L100 HydrophobicContact CG1-CD1 4.48Å; V87-L100 HydrophobicContact CG1-CD2 3.53Å; V87-L100 HydrophobicContact CG1-CG 4.13Å; V87-L100 HydrophobicContact CG2-CD2 3.9Å; V87-A124 HydrophobicContact CG1-CB 3.74Å; V87-A128 HydrophobicContact CG2-CB 3.9Å
88	S	90.1	Very high	87.2	Confident	17 Å²	17	46 Å²	46	12%	0.119	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	111	179.8	38.6	0	0	0	0	111.7	T96	S88-T96 CarbonylContact C-O 3.59Å; S88-T96 WeakPolarHBondContact CA-O 3.04Å
89	I	88.6	Confident	87.4	Confident	19 Å²	19	44.7 Å²	44.7	10%	0.097	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.7	-179.5	-65.6	-177	0	0	0	109.5	V87 T96 K98 A128 C129	V87-I89 HydrophobicContact CG2-CD1 4.12Å; V87-I89 HydrophobicContact CG2-CG1 4.25Å; V87-I89 PolarHBondContact O-N 2.89Å; I89-T96 PolarHBondContact N-O 3.32Å; I89-T96 PolarHBondContact O-N 2.87Å; I89-T96 PolarHBondContact O-OG1 3.22Å; I89-K98 HydrophobicContact CB-CG 4.43Å; I89-K98 HydrophobicContact CD1-CB 4.19Å; I89-K98 HydrophobicContact CD1-CD 4.07Å; I89-K98 HydrophobicContact CD1-CG 4.27Å; I89-A128 HydrophobicContact CD1-CB 4.12Å; I89-C129 VanDerWaalsContact CD1-O 3.31Å; I89-C129 WeakPolarHBondContact CD1-O 3.02Å
90	Q	87.1	Confident	87.5	Confident	117 Å²	117	41.6 Å²	41.6	55%	0.547	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	126.1	176.4	-177.4	66.7	60.7	0	0	110.1	G94	Q90-G94 PolarHBondContact NE2-O 3.14Å
91	E	85.4	Confident	87.5	Confident	26 Å²	26	41.7 Å²	41.7	12%	0.121	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	175.2	172	-50.5	-139.8	116.4	0	0	110.1	Y93 G94 T96 K98 G131 G132	E91-Y93 HydrophobicContact CB-CE1 4.43Å; E91-Y93 PolarHBondContact O-N 3.2Å; E91-Y93 PolarHBondContact OE2-OH 3.42Å; E91-G94 PolarHBondContact N-O 3.05Å; E91-G94 PolarHBondContact O-N 3.18Å; E91-T96 HydrophobicContact CG-CG2 3.95Å; E91-K98 WeakPolarHBondContact OE1-CE 3.43Å; E91-K98 IonicContact OE1-NZ 2.7Å; E91-K98 PolarHBondContact OE1-NZ 3.39Å; E91-G131 WeakPolarHBondContact OE1-CA 3.31Å; E91-G132 PolarHBondContact OE1-N 2.92Å
92	S	82	Confident	87.3	Confident	122 Å²	122	41.3 Å²	41.3	85%	0.853	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-26.2	-176.8	49.1	0	0	0	0	114
93	Y	80.3	Confident	86.9	Confident	147 Å²	147	43.2 Å²	43.2	58%	0.576	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-4	-177.5	55.5	-106.4	0	0	0	114.6	E91 T96	E91-Y93 HydrophobicContact CB-CE1 4.43Å; E91-Y93 PolarHBondContact O-N 3.2Å; E91-Y93 PolarHBondContact OE2-OH 3.42Å; Y93-T96 HydrophobicContact CE2-CG2 3.78Å
94	G	84.6	Confident	86.7	Confident	26 Å²	26	41 Å²	41	27%	0.268	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	155	-175.1	-178.6	0	0	0	0	0	114.1	Q90 E91	Q90-G94 PolarHBondContact NE2-O 3.14Å; E91-G94 PolarHBondContact N-O 3.05Å; E91-G94 PolarHBondContact O-N 3.18Å
95	I	86.3	Confident	86.9	Confident	38 Å²	38	39.4 Å²	39.4	20%	0.195	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.9	172.3	-54.1	172	0	0	0	108.8	L51 V68	L51-I95 HydrophobicContact CD2-CB 4.39Å; L51-I95 HydrophobicContact CD2-CG2 3.57Å; V68-I95 WeakPolarHBondContact CG2-O 3.45Å
96	T	89.1	Confident	87.1	Confident	23 Å²	23	39.2 Å²	39.2	14%	0.141	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150	176.9	63.4	0	0	0	0	110.8	S88 I89 E91 Y93	S88-T96 CarbonylContact C-O 3.59Å; S88-T96 WeakPolarHBondContact CA-O 3.04Å; I89-T96 PolarHBondContact N-O 3.32Å; I89-T96 PolarHBondContact O-N 2.87Å; I89-T96 PolarHBondContact O-OG1 3.22Å; E91-T96 HydrophobicContact CG-CG2 3.95Å; Y93-T96 HydrophobicContact CE2-CG2 3.78Å
97	C	91.2	Very high	86.9	Confident	11 Å²	11	41.2 Å²	41.2	7%	0.074	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	104.1	171.8	-68	0	0	0	0	109.9	V68 A69 N70 C82 V87	V68-C97 HydrophobicContact CG1-CB 4.27Å; A69-C97 WeakPolarHBondContact O-CB 3.28Å; N70-C97 HydrophobicContact CB-CB 4.14Å; C82-C97 WeakPolarHBondContact CA-SG 3.49Å; C82-C97 HydrophobicContact CB-CB 3.78Å; C82-C97 WeakPolarHBondContact CB-SG 3.13Å; C82-C97 VanDerWaalsContact SG-CA 3.55Å; C82-C97 WeakPolarHBondContact SG-CB 3.47Å; C82-C97 CovalentContact SG-SG 2.04Å; C82-C97 PolarHBondContact SG-SG 3.24Å; V87-C97 WeakPolarHBondContact O-CA 3.04Å
98	K	90.3	Very high	86.8	Confident	29 Å²	29	44.3 Å²	44.3	13%	0.126	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	147	177.9	-57.6	-160	-167.9	-178.5	0	111.1	Y86 V87 I89 E91 P130 T133	Y86-K98 CarbonylContact C-O 3.56Å; Y86-K98 WeakPolarHBondContact CA-O 3.37Å; V87-K98 PolarHBondContact N-O 2.96Å; V87-K98 PolarHBondContact O-N 3.21Å; I89-K98 HydrophobicContact CB-CG 4.43Å; I89-K98 HydrophobicContact CD1-CB 4.19Å; I89-K98 HydrophobicContact CD1-CD 4.07Å; I89-K98 HydrophobicContact CD1-CG 4.27Å; E91-K98 WeakPolarHBondContact OE1-CE 3.43Å; E91-K98 IonicContact OE1-NZ 2.7Å; E91-K98 PolarHBondContact OE1-NZ 3.39Å; K98-P130 PolarHBondContact NZ-O 3.23Å; K98-T133 PolarHBondContact NZ-O 3.42Å
99	T	89.7	Confident	86.7	Confident	33 Å²	33	48.4 Å²	48.4	20%	0.202	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	145.4	178.6	175.3	0	0	0	0	111.8	G85 H330 L331	G85-T99 CarbonylContact O-C 3.5Å; G85-T99 WeakPolarHBondContact O-CA 3.29Å; T99-H330 PolarHBondContact OG1-O 3.27Å; T99-L331 HydrophobicContact CG2-CD2 4.5Å
100	L	91.1	Very high	86.5	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.063	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-76.6	133.8	165.7	-70.2	-178	0	0	0	110.1	G85 V87 Y126 H330	G85-L100 PolarHBondContact O-N 2.72Å; V87-L100 HydrophobicContact CB-CD2 4.36Å; V87-L100 HydrophobicContact CG1-CD1 4.48Å; V87-L100 HydrophobicContact CG1-CD2 3.53Å; V87-L100 HydrophobicContact CG1-CG 4.13Å; V87-L100 HydrophobicContact CG2-CD2 3.9Å; L100-Y126 HydrophobicContact CD1-CD2 3.94Å; L100-Y126 HydrophobicContact CD1-CG 4.05Å; L100-Y126 HydrophobicContact CD2-CG 4.49Å; L100-H330 HydrophobicContact CB-CB 3.92Å; L100-H330 WeakPolarHBondContact O-CB 3.18Å
101	L	90	Very high	86.3	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	25%	0.253	C	S	.	.			trans	-89.7	-10.9	-170.1	-60.5	169.5	0	0	0	113.6	V115 S118 C127 Y135 L331	L101-V115 HydrophobicContact CB-CG2 3.98Å; L101-V115 HydrophobicContact CD1-CB 4.08Å; L101-V115 HydrophobicContact CD1-CG1 3.98Å; L101-V115 HydrophobicContact CD1-CG2 4.25Å; L101-S118 VanDerWaalsContact CD1-CB 3.43Å; L101-C127 HydrophobicContact CB-CB 4.41Å; L101-C127 WeakPolarHBondContact CB-O 3.41Å; L101-C127 PolarHBondContact N-O 3.14Å; L101-Y135 HydrophobicContact CD2-CD1 3.97Å; L101-Y135 HydrophobicContact CD2-CD2 3.7Å; L101-Y135 HydrophobicContact CD2-CE1 4.29Å; L101-Y135 HydrophobicContact CD2-CE2 4.06Å; L101-Y135 HydrophobicContact CD2-CG 3.67Å; L101-L331 VanDerWaalsContact O-CD1 3.32Å; L101-L331 WeakPolarHBondContact O-CD1 3.37Å
102	T	85.5	Confident	86.4	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.012	25%	0.249	C	C	.	.			trans	-146.6	148.9	-170.2	60.6	0	0	0	0	110.9	L104 C127 H330 M360	T102-L104 PolarHBondContact OG1-O 3.03Å; T102-C127 HydrophobicContact CG2-CB 4.04Å; T102-H330 PolarHBondContact O-ND1 2.69Å; T102-M360 HydrophobicContact CG2-CE 4.16Å; T102-M360 HydrophobicContact CG2-SD 3.35Å; T102-M360 WeakPolarHBondContact CG2-SD 3.34Å
103	N	83.6	Confident	86.5	Confident	39 Å²	39	42.8 Å²	42.8	21%	0.209	23%	0.228	C	C	.	.	S	Bend	trans	-80.7	-21.7	164.1	-82	10.7	0	0	0	112.2	Y126 Y327 N329	N103-Y126 WeakPolarHBondContact O-CE1 3.4Å; N103-Y327 PolarHBondContact ND2-O 3.3Å; N103-N329 PolarHBondContact ND2-N 3.27Å; N103-N329 PolarHBondContact ND2-ND2 2.99Å; N103-N329 WeakPolarHBondContact OD1-CB 3.47Å; N103-N329 PolarHBondContact OD1-N 3.43Å
104	L	84	Confident	86.6	Confident	14 Å²	14	36.7 Å²	36.7	7%	0.073	21%	0.205	C	C	.	.	S	Bend	trans	-87.6	143.6	179.2	-74.3	174.2	0	0	0	111.6	T102 Y126 Y358 M360	T102-L104 PolarHBondContact OG1-O 3.03Å; L104-Y126 WeakPolarHBondContact O-CD1 3.45Å; L104-Y358 HydrophobicContact CD1-CD2 3.93Å; L104-Y358 HydrophobicContact CD1-CE2 3.48Å; L104-Y358 VanDerWaalsContact CD1-CE2 3.48Å; L104-Y358 HydrophobicContact CD2-CE2 4.47Å; L104-Y358 HydrophobicContact CG-CE2 4.04Å; L104-M360 HydrophobicContact CB-CE 3.77Å; L104-M360 HydrophobicContact CB-CG 4.18Å; L104-M360 HydrophobicContact CB-SD 3.74Å; L104-M360 HydrophobicContact CD1-CG 3.61Å; L104-M360 HydrophobicContact CD1-SD 4.24Å
105	K	84.1	Confident	86.7	Confident	62 Å²	62	35.5 Å²	35.5	27%	0.27	19%	0.192	S	C	.	.	B	Isolated β-bridge	trans	-76	163.3	-177.1	-68.5	179.1	-176.5	176.4	0	111.9	G125 Y126 E429	K105-G125 CarbonylContact C-O 3.42Å; K105-G125 WeakPolarHBondContact CA-O 2.99Å; K105-G125 WeakPolarHBondContact CB-O 3.4Å; K105-Y126 HydrophobicContact CB-CE1 4.38Å; K105-Y126 VanDerWaalsContact CE-OH 3.32Å; K105-Y126 WeakPolarHBondContact CE-OH 3.5Å; K105-Y126 HydrophobicContact CG-CD1 4.32Å; K105-Y126 HydrophobicContact CG-CE1 3.57Å; K105-Y126 HydrophobicContact CG-CE2 4.38Å; K105-E429 IonicContact NZ-OE2 2.82Å; K105-E429 PolarHBondContact NZ-OE2 2.88Å
106	C	88	Confident	86.7	Confident	7 Å²	7	36 Å²	36	5%	0.047	20%	0.197	C	C	.	.			trans	-135.1	156.2	171	60.4	0	0	0	0	109.8	D111 C120 G125 Y126	C106-D111 HydrophobicContact CB-CB 3.73Å; C106-C120 HydrophobicContact CB-CB 3.81Å; C106-C120 WeakPolarHBondContact CB-SG 3.41Å; C106-C120 PolarHBondContact O-SG 3.14Å; C106-C120 VanDerWaalsContact O-SG 3.4Å; C106-C120 WeakPolarHBondContact SG-CA 3.49Å; C106-C120 WeakPolarHBondContact SG-CB 3.39Å; C106-C120 CovalentContact SG-SG 2.03Å; C106-C120 PolarHBondContact SG-SG 3.4Å; C106-G125 PolarHBondContact N-O 3.17Å; C106-G125 WeakPolarHBondContact O-CA 3.06Å; C106-Y126 WeakPolarHBondContact SG-CA 3.34Å; C106-Y126 PolarHBondContact SG-N 3.15Å; C106-Y126 VanDerWaalsContact SG-N 3.35Å
107	Q	84.9	Confident	86.7	Confident	108 Å²	108	38.5 Å²	38.5	51%	0.505	21%	0.21	S	C	.	.	S	Bend	trans	-113	-31.2	169.4	-59	-174	8.3	0	0	111.2	D111 M428	Q107-D111 PolarHBondContact N-OD2 3.29Å; Q107-M428 PolarHBondContact NE2-SD 3.46Å; Q107-M428 VanDerWaalsContact NE2-SD 3.37Å
108	V	86.9	Confident	86.7	Confident	76 Å²	76	38.6 Å²	38.6	46%	0.461	21%	0.21	S	C	.	.	S	Bend	trans	-136.8	159	-177.2	-71.6	0	0	0	0	111.3	S110 D111	V108-S110 WeakPolarHBondContact CG2-OG 3.04Å; V108-S110 PolarHBondContact O-N 3.24Å; V108-D111 WeakPolarHBondContact CG2-OD1 3.26Å; V108-D111 PolarHBondContact N-OD2 3.4Å; V108-D111 VanDerWaalsContact N-OD2 3.14Å; V108-D111 WeakPolarHBondContact O-CB 3.02Å; V108-D111 PolarHBondContact O-N 2.76Å
109	D	88.1	Confident	86.8	Confident	102 Å²	102	38.3 Å²	38.3	55%	0.545	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-58.8	-29.2	179.5	-65.2	-27.7	0	0	0	112.9	D111 C112 A119 C120	D109-D111 PolarHBondContact O-N 3.5Å; D109-C112 PolarHBondContact O-N 3.02Å; D109-C112 VanDerWaalsContact O-N 3.15Å; D109-A119 WeakPolarHBondContact OD1-CB 3.48Å; D109-C120 PolarHBondContact OD1-N 3.08Å
110	S	83.8	Confident	86.9	Confident	78 Å²	78	37.4 Å²	37.4	55%	0.545	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-68	-11.9	175	53.6	0	0	0	0	114.3	V108 C112 I113	V108-S110 WeakPolarHBondContact CG2-OG 3.04Å; V108-S110 PolarHBondContact O-N 3.24Å; S110-C112 VanDerWaalsContact C-N 3.27Å; S110-I113 VanDerWaalsContact O-CG2 3.22Å; S110-I113 WeakPolarHBondContact O-CG2 3.28Å
111	D	83.7	Confident	86.9	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.016	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-80.4	-10.4	173.8	-58.6	-24	0	0	0	112.3	C106 Q107 V108 D109 N361 I365	C106-D111 HydrophobicContact CB-CB 3.73Å; Q107-D111 PolarHBondContact N-OD2 3.29Å; V108-D111 WeakPolarHBondContact CG2-OD1 3.26Å; V108-D111 PolarHBondContact N-OD2 3.4Å; V108-D111 VanDerWaalsContact N-OD2 3.14Å; V108-D111 WeakPolarHBondContact O-CB 3.02Å; V108-D111 PolarHBondContact O-N 2.76Å; D109-D111 PolarHBondContact O-N 3.5Å; D111-N361 WeakPolarHBondContact CA-ND2 3.06Å; D111-N361 PolarHBondContact O-ND2 2.95Å; D111-N361 VanDerWaalsContact O-ND2 3.13Å; D111-N361 PolarHBondContact O-OD1 3.29Å; D111-N361 VanDerWaalsContact O-OD1 3.07Å; D111-I365 WeakPolarHBondContact OD1-CD1 3.21Å
112	C	87.4	Confident	86.7	Confident	4 Å²	4	44.7 Å²	44.7	3%	0.027	25%	0.253	C	S	.	.			trans	-101.3	34.4	-171.2	-67.4	0	0	0	0	113.7	D109 S110 H114 S118 C127	D109-C112 PolarHBondContact O-N 3.02Å; D109-C112 VanDerWaalsContact O-N 3.15Å; S110-C112 VanDerWaalsContact C-N 3.27Å; C112-H114 VanDerWaalsContact C-N 3.29Å; C112-H114 PolarHBondContact O-N 2.79Å; C112-S118 WeakPolarHBondContact CB-OG 3.47Å; C112-S118 PolarHBondContact O-OG 2.92Å; C112-C127 WeakPolarHBondContact CA-SG 3.41Å; C112-C127 HydrophobicContact CB-CB 3.78Å; C112-C127 WeakPolarHBondContact CB-SG 3.28Å; C112-C127 VanDerWaalsContact SG-CA 3.5Å; C112-C127 WeakPolarHBondContact SG-CB 3.01Å; C112-C127 CovalentContact SG-SG 2.04Å; C112-C127 PolarHBondContact SG-SG 3.46Å
113	I	84.6	Confident	86.5	Confident	82 Å²	82	47 Å²	47	42%	0.421	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-22.2	-174.7	83.9	-176.1	0	0	0	113.7	S110 V115 N361	S110-I113 VanDerWaalsContact O-CG2 3.22Å; S110-I113 WeakPolarHBondContact O-CG2 3.28Å; I113-V115 VanDerWaalsContact C-N 3.32Å; I113-V115 PolarHBondContact O-N 2.89Å; I113-N361 HydrophobicContact CD1-CB 4.36Å; I113-N361 WeakPolarHBondContact CG1-OD1 2.93Å
114	H	82.7	Confident	86.5	Confident	18 Å²	18	46.2 Å²	46.2	8%	0.083	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-41.2	-175.3	177.9	-94.2	0	0	0	112.7	C112 N140 E335 F337 M360	C112-H114 VanDerWaalsContact C-N 3.29Å; C112-H114 PolarHBondContact O-N 2.79Å; H114-N140 PolarHBondContact CE1-ND2 3.34Å; H114-N140 PolarHBondContact O-ND2 3.26Å; H114-E335 WeakPolarHBondContact CE1-CG 3.41Å; H114-E335 IonicContact CE1-OE2 2.72Å; H114-F337 AromaticContact CD2-CE1 3.91Å; H114-F337 AromaticContact CG-CE1 4Å; H114-M360 HydrophobicContact CB-CB 4.17Å
115	V	86.8	Confident	86.7	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.006	28%	0.283	C	S	.	.	S	Bend	trans	-105.8	116	173.1	-173.7	0	0	0	0	109	L101 I113 N117 S118 Y135 N140	L101-V115 HydrophobicContact CB-CG2 3.98Å; L101-V115 HydrophobicContact CD1-CB 4.08Å; L101-V115 HydrophobicContact CD1-CG1 3.98Å; L101-V115 HydrophobicContact CD1-CG2 4.25Å; I113-V115 VanDerWaalsContact C-N 3.32Å; I113-V115 PolarHBondContact O-N 2.89Å; V115-N117 PolarHBondContact O-N 3.07Å; V115-S118 WeakPolarHBondContact O-CB 3.31Å; V115-S118 PolarHBondContact O-N 3.24Å; V115-S118 PolarHBondContact O-OG 2.86Å; V115-Y135 HydrophobicContact CG1-CD2 3.9Å; V115-Y135 HydrophobicContact CG1-CE2 3.64Å; V115-N140 VanDerWaalsContact CG2-OD1 3.28Å; V115-N140 WeakPolarHBondContact CG2-OD1 3.1Å
116	V	86	Confident	87	Confident	49 Å²	49	44.5 Å²	44.5	30%	0.297	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-63.4	132.1	-171	-175.6	0	0	0	0	110.5	S118 N140 A141 C142	V116-S118 PolarHBondContact O-N 2.68Å; V116-N140 PolarHBondContact N-O 3.08Å; V116-A141 HydrophobicContact CB-CB 3.87Å; V116-A141 CarbonylContact O-C 3.6Å; V116-A141 WeakPolarHBondContact O-CA 3.41Å; V116-C142 PolarHBondContact O-N 2.89Å
117	N	88.8	Confident	87.1	Confident	75 Å²	75	44.2 Å²	44.2	40%	0.401	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	18	-174	-42.9	-36	0	0	0	115.6	V115 P130 C142	V115-N117 PolarHBondContact O-N 3.07Å; N117-P130 WeakPolarHBondContact O-CD 3.46Å; N117-C142 HydrophobicContact CB-CB 4.2Å; N117-C142 PolarHBondContact ND2-O 3.13Å
118	S	91.3	Very high	87.5	Confident	13 Å²	13	39.3 Å²	39.3	9%	0.091	25%	0.25	C	C	.	.			trans	-79.2	160.6	166.7	72.5	0	0	0	0	111.6	L101 C112 V115 V116	L101-S118 VanDerWaalsContact CD1-CB 3.43Å; C112-S118 WeakPolarHBondContact CB-OG 3.47Å; C112-S118 PolarHBondContact O-OG 2.92Å; V115-S118 WeakPolarHBondContact O-CB 3.31Å; V115-S118 PolarHBondContact O-N 3.24Å; V115-S118 PolarHBondContact O-OG 2.86Å; V116-S118 PolarHBondContact O-N 2.68Å
119	A	92.1	Very high	87.9	Confident	24 Å²	24	35.9 Å²	35.9	20%	0.198	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	156.9	-176.4	0	0	0	0	0	110.4	D109 C127 A128	D109-A119 WeakPolarHBondContact OD1-CB 3.48Å; A119-C127 WeakPolarHBondContact O-CA 3.5Å; A119-A128 PolarHBondContact N-O 3.33Å; A119-A128 PolarHBondContact O-N 2.04Å
120	C	92.2	Very high	88.1	Confident	14 Å²	14	33.3 Å²	33.3	10%	0.095	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.9	-180	-171.9	0	0	0	0	110.4	C106 D109 P122	C106-C120 HydrophobicContact CB-CB 3.81Å; C106-C120 WeakPolarHBondContact CB-SG 3.41Å; C106-C120 PolarHBondContact O-SG 3.14Å; C106-C120 VanDerWaalsContact O-SG 3.4Å; C106-C120 WeakPolarHBondContact SG-CA 3.49Å; C106-C120 WeakPolarHBondContact SG-CB 3.39Å; C106-C120 CovalentContact SG-SG 2.03Å; C106-C120 PolarHBondContact SG-SG 3.4Å; D109-C120 PolarHBondContact OD1-N 3.08Å; C120-P122 VanDerWaalsContact O-CD 3.28Å; C120-P122 WeakPolarHBondContact O-CD 3.47Å
121	H	91.3	Very high	88.3	Confident	39 Å²	39	31.6 Å²	31.6	18%	0.181	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	112.6	-177.7	-177.5	-97.3	0	0	0	111.1	G123 A124 G125 Y126 A128	H121-G123 PolarHBondContact O-N 3.14Å; H121-G123 VanDerWaalsContact O-N 3.09Å; H121-A124 HydrophobicContact CB-CB 4.3Å; H121-A124 VanDerWaalsContact ND1-CB 3.32Å; H121-A124 WeakPolarHBondContact ND1-CB 3.49Å; H121-A124 PolarHBondContact ND1-N 3.37Å; H121-A124 PolarHBondContact O-N 3.36Å; H121-G125 PolarHBondContact O-N 2.77Å; H121-Y126 WeakPolarHBondContact CB-O 3.03Å; H121-Y126 PolarHBondContact N-O 2.75Å; H121-A128 HydrophobicContact CB-CB 4.42Å
122	P	85.4	Confident	88.5	Confident	129 Å²	129	32.7 Å²	32.7	84%	0.838	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-18.5	-165	27.2	-36.4	0	0	0	114.2	C120	C120-P122 VanDerWaalsContact O-CD 3.28Å; C120-P122 WeakPolarHBondContact O-CD 3.47Å
123	G	81.8	Confident	88.7	Confident	50 Å²	50	33.2 Å²	33.2	52%	0.515	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-6.2	174.2	0	0	0	0	0	114.9	H121	H121-G123 PolarHBondContact O-N 3.14Å; H121-G123 VanDerWaalsContact O-N 3.09Å
124	A	83.8	Confident	88.9	Confident	23 Å²	23	31 Å²	31	19%	0.19	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-28.2	-175.1	0	0	0	0	0	114	V87 H121 Y126	V87-A124 HydrophobicContact CG1-CB 3.74Å; H121-A124 HydrophobicContact CB-CB 4.3Å; H121-A124 VanDerWaalsContact ND1-CB 3.32Å; H121-A124 WeakPolarHBondContact ND1-CB 3.49Å; H121-A124 PolarHBondContact ND1-N 3.37Å; H121-A124 PolarHBondContact O-N 3.36Å; A124-Y126 HydrophobicContact CB-CD2 4.33Å; A124-Y126 VanDerWaalsContact O-CD2 3.23Å; A124-Y126 WeakPolarHBondContact O-CD2 3.48Å
125	G	87.6	Confident	89.2	Confident	21 Å²	21	32.2 Å²	32.2	22%	0.216	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	32.5	-175.4	0	0	0	0	0	113.4	K105 C106 H121	K105-G125 CarbonylContact C-O 3.42Å; K105-G125 WeakPolarHBondContact CA-O 2.99Å; K105-G125 WeakPolarHBondContact CB-O 3.4Å; C106-G125 PolarHBondContact N-O 3.17Å; C106-G125 WeakPolarHBondContact O-CA 3.06Å; H121-G125 PolarHBondContact O-N 2.77Å
126	Y	89	Confident	89.2	Confident	19 Å²	19	32.1 Å²	32.1	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	154.1	177.8	-69.7	-75.2	0	0	0	111.5	W46 L100 N103 L104 K105 C106 H121 A124	W46-Y126 AromaticContact CH2-CE2 3.51Å; W46-Y126 HydrophobicContact CH2-CE2 3.51Å; W46-Y126 AromaticContact CH2-CZ 3.94Å; W46-Y126 WeakPolarHBondContact CH2-OH 3.43Å; W46-Y126 HydrophobicContact CZ2-CE2 4.28Å; W46-Y126 AromaticContact CZ3-CE2 3.64Å; W46-Y126 HydrophobicContact CZ3-CE2 3.64Å; L100-Y126 HydrophobicContact CD1-CD2 3.94Å; L100-Y126 HydrophobicContact CD1-CG 4.05Å; L100-Y126 HydrophobicContact CD2-CG 4.49Å; N103-Y126 WeakPolarHBondContact O-CE1 3.4Å; L104-Y126 WeakPolarHBondContact O-CD1 3.45Å; K105-Y126 HydrophobicContact CB-CE1 4.38Å; K105-Y126 VanDerWaalsContact CE-OH 3.32Å; K105-Y126 WeakPolarHBondContact CE-OH 3.5Å; K105-Y126 HydrophobicContact CG-CD1 4.32Å; K105-Y126 HydrophobicContact CG-CE1 3.57Å; K105-Y126 HydrophobicContact CG-CE2 4.38Å; C106-Y126 WeakPolarHBondContact SG-CA 3.34Å; C106-Y126 PolarHBondContact SG-N 3.15Å; C106-Y126 VanDerWaalsContact SG-N 3.35Å; H121-Y126 WeakPolarHBondContact CB-O 3.03Å; H121-Y126 PolarHBondContact N-O 2.75Å; A124-Y126 HydrophobicContact CB-CD2 4.33Å; A124-Y126 VanDerWaalsContact O-CD2 3.23Å; A124-Y126 WeakPolarHBondContact O-CD2 3.48Å
127	C	92	Very high	89	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	132.8	-179.3	-57	0	0	0	0	111.7	L101 T102 C112 A119	L101-C127 HydrophobicContact CB-CB 4.41Å; L101-C127 WeakPolarHBondContact CB-O 3.41Å; L101-C127 PolarHBondContact N-O 3.14Å; T102-C127 HydrophobicContact CG2-CB 4.04Å; C112-C127 WeakPolarHBondContact CA-SG 3.41Å; C112-C127 HydrophobicContact CB-CB 3.78Å; C112-C127 WeakPolarHBondContact CB-SG 3.28Å; C112-C127 VanDerWaalsContact SG-CA 3.5Å; C112-C127 WeakPolarHBondContact SG-CB 3.01Å; C112-C127 CovalentContact SG-SG 2.04Å; C112-C127 PolarHBondContact SG-SG 3.46Å; A119-C127 WeakPolarHBondContact O-CA 3.5Å
128	A	93.3	Very high	88.4	Confident	4 Å²	4	27.6 Å²	27.6	3%	0.033	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	160.3	178.8	0	0	0	0	0	111.2	V87 I89 A119 H121	V87-A128 HydrophobicContact CG2-CB 3.9Å; I89-A128 HydrophobicContact CD1-CB 4.12Å; A119-A128 PolarHBondContact N-O 3.33Å; A119-A128 PolarHBondContact O-N 2.04Å; H121-A128 HydrophobicContact CB-CB 4.42Å
129	C	93.7	Very high	87.7	Confident	4 Å²	4	28.3 Å²	28.3	3%	0.027	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-78.8	127.3	174.4	-70.7	0	0	0	0	111.4	I89 T133 C142	I89-C129 VanDerWaalsContact CD1-O 3.31Å; I89-C129 WeakPolarHBondContact CD1-O 3.02Å; C129-T133 WeakPolarHBondContact CB-OG1 3.43Å; C129-C142 WeakPolarHBondContact CA-SG 3.34Å; C129-C142 HydrophobicContact CB-CB 3.76Å; C129-C142 WeakPolarHBondContact CB-SG 3.01Å; C129-C142 WeakPolarHBondContact SG-CB 3.08Å; C129-C142 CovalentContact SG-SG 2.04Å; C129-C142 PolarHBondContact SG-SG 2.03Å
130	P	92.2	Very high	87.3	Confident	48 Å²	48	27.2 Å²	27.2	31%	0.312	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-63.3	168.1	-178	25	-34.1	0	0	0	113.6	K98 N117 T133	K98-P130 PolarHBondContact NZ-O 3.23Å; N117-P130 WeakPolarHBondContact O-CD 3.46Å; P130-T133 VanDerWaalsContact CD-OG1 3.3Å; P130-T133 WeakPolarHBondContact CD-OG1 3.19Å; P130-T133 HydrophobicContact CG-CG2 4.11Å; P130-T133 PolarHBondContact O-N 3.4Å; P130-T133 VanDerWaalsContact O-N 3.12Å; P130-T133 PolarHBondContact O-OG1 3.3Å
131	G	89.5	Confident	87	Confident	42 Å²	42	26.6 Å²	26.6	43%	0.433	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	139.7	178.1	0	0	0	0	0	112.8	E91 T133	E91-G131 WeakPolarHBondContact OE1-CA 3.31Å; G131-T133 PolarHBondContact O-N 3.16Å
132	G	87.3	Confident	87	Confident	26 Å²	26	24.8 Å²	24.8	27%	0.268	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	-11.6	-174.6	0	0	0	0	0	115.3	E91 Q144 S145	E91-G132 PolarHBondContact OE1-N 2.92Å; G132-Q144 PolarHBondContact O-NE2 3.1Å; G132-Q144 PolarHBondContact O-OE1 3.06Å; G132-S145 WeakPolarHBondContact O-CB 3.42Å; G132-S145 PolarHBondContact O-N 2.04Å
133	T	90.3	Very high	87.2	Confident	16 Å²	16	19.9 Å²	19.9	10%	0.098	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	149.3	177.3	72.4	0	0	0	0	112.7	K98 C129 P130 G131 R143	K98-T133 PolarHBondContact NZ-O 3.42Å; C129-T133 WeakPolarHBondContact CB-OG1 3.43Å; P130-T133 VanDerWaalsContact CD-OG1 3.3Å; P130-T133 WeakPolarHBondContact CD-OG1 3.19Å; P130-T133 HydrophobicContact CG-CG2 4.11Å; P130-T133 PolarHBondContact O-N 3.4Å; P130-T133 VanDerWaalsContact O-N 3.12Å; P130-T133 PolarHBondContact O-OG1 3.3Å; G131-T133 PolarHBondContact O-N 3.16Å; T133-R143 CarbonylContact C-O 3.55Å; T133-R143 WeakPolarHBondContact CA-O 3.29Å; T133-R143 WeakPolarHBondContact CB-O 3.43Å
134	I	88.9	Confident	87.6	Confident	36 Å²	36	22.4 Å²	22.4	19%	0.185	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	148.8	172.5	58.9	174.9	0	0	0	110.1	V136 C142 R143 V163 Y165	I134-V136 HydrophobicContact CD1-CG2 4.42Å; I134-V136 HydrophobicContact CG1-CG2 4.08Å; I134-C142 CarbonylContact O-C 3.57Å; I134-C142 WeakPolarHBondContact O-CA 3.39Å; I134-R143 PolarHBondContact N-O 2.88Å; I134-R143 PolarHBondContact O-N 3.35Å; I134-V163 HydrophobicContact CD1-CB 3.78Å; I134-V163 HydrophobicContact CD1-CG1 3.7Å; I134-V163 HydrophobicContact CG2-CG1 4.45Å; I134-Y165 HydrophobicContact CD1-CD1 4.38Å
135	Y	89.2	Confident	87.7	Confident	42 Å²	42	22.8 Å²	22.8	17%	0.165	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134.2	167.4	-176.9	-133.8	0	0	0	109.5	L101 V115 N140 S219 L331 Y333	L101-Y135 HydrophobicContact CD2-CD1 3.97Å; L101-Y135 HydrophobicContact CD2-CD2 3.7Å; L101-Y135 HydrophobicContact CD2-CE1 4.29Å; L101-Y135 HydrophobicContact CD2-CE2 4.06Å; L101-Y135 HydrophobicContact CD2-CG 3.67Å; V115-Y135 HydrophobicContact CG1-CD2 3.9Å; V115-Y135 HydrophobicContact CG1-CE2 3.64Å; Y135-N140 PolarHBondContact OH-OD1 3.08Å; Y135-S219 PolarHBondContact O-OG 2.86Å; Y135-S219 VanDerWaalsContact O-OG 3.06Å; Y135-L331 HydrophobicContact CE1-CD2 4.37Å; Y135-Y333 PolarHBondContact OH-OH 3.46Å
136	V	87.3	Confident	87.6	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	97.5	177.2	-173.8	0	0	0	0	107.2	I134 Q138 D139 N140 A141 R143 Y165	I134-V136 HydrophobicContact CD1-CG2 4.42Å; I134-V136 HydrophobicContact CG1-CG2 4.08Å; V136-Q138 HydrophobicContact CG1-CG 4.01Å; V136-Q138 PolarHBondContact O-N 3.44Å; V136-D139 HydrophobicContact CB-CB 4.18Å; V136-D139 HydrophobicContact CG1-CB 4Å; V136-D139 VanDerWaalsContact CG1-OD1 3.25Å; V136-D139 WeakPolarHBondContact CG1-OD1 3.25Å; V136-D139 PolarHBondContact O-N 3.08Å; V136-D139 VanDerWaalsContact O-N 3.16Å; V136-N140 WeakPolarHBondContact O-CA 3.17Å; V136-N140 PolarHBondContact O-N 3.41Å; V136-A141 PolarHBondContact N-O 2.89Å; V136-A141 PolarHBondContact O-N 3.4Å; V136-R143 HydrophobicContact CB-CG 4.07Å; V136-R143 HydrophobicContact CG2-CB 3.71Å; V136-R143 HydrophobicContact CG2-CG 3.54Å; V136-Y165 HydrophobicContact CB-CE1 4.32Å; V136-Y165 HydrophobicContact CG1-CD1 4.28Å; V136-Y165 HydrophobicContact CG1-CE1 3.52Å; V136-Y165 HydrophobicContact CG2-CD1 3.67Å; V136-Y165 HydrophobicContact CG2-CE1 3.78Å; V136-Y165 HydrophobicContact CG2-CG 4.15Å
137	S	82.6	Confident	86.9	Confident	17 Å²	17	27.7 Å²	27.7	12%	0.119	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-40.5	-174.9	48.8	0	0	0	0	113.7	D139 N140 M282	S137-D139 PolarHBondContact O-N 3.04Å; S137-N140 PolarHBondContact O-N 3.43Å; S137-N140 VanDerWaalsContact O-N 3.1Å; S137-M282 WeakPolarHBondContact OG-CE 3.28Å; S137-M282 PolarHBondContact OG-SD 2.9Å
138	Q	76.1	Confident	85.6	Confident	11 Å²	11	31.2 Å²	31.2	5%	0.051	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-27.5	178.9	79.9	-143.5	-26	0	0	112.1	V136 Y165 R181 C218 M282	V136-Q138 HydrophobicContact CG1-CG 4.01Å; V136-Q138 PolarHBondContact O-N 3.44Å; Q138-Y165 PolarHBondContact NE2-OH 2.92Å; Q138-R181 PolarHBondContact O-NH1 3.08Å; Q138-C218 PolarHBondContact NE2-O 3.07Å; Q138-M282 HydrophobicContact CB-SD 4.46Å
139	D	75.7	Confident	84.2	Confident	28 Å²	28	36.8 Å²	36.8	15%	0.15	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-22	174.8	-68.4	45.9	0	0	0	112.1	V136 S137 A141 R143 Y165	V136-D139 HydrophobicContact CB-CB 4.18Å; V136-D139 HydrophobicContact CG1-CB 4Å; V136-D139 VanDerWaalsContact CG1-OD1 3.25Å; V136-D139 WeakPolarHBondContact CG1-OD1 3.25Å; V136-D139 PolarHBondContact O-N 3.08Å; V136-D139 VanDerWaalsContact O-N 3.16Å; S137-D139 PolarHBondContact O-N 3.04Å; D139-A141 VanDerWaalsContact C-N 3.32Å; D139-A141 HydrophobicContact CB-CB 3.77Å; D139-R143 IonicContact OD2-CZ 3.17Å; D139-R143 IonicContact OD2-NE 2.8Å; D139-R143 PolarHBondContact OD2-NE 2.04Å; D139-R143 IonicContact OD2-NH2 2.69Å; D139-R143 PolarHBondContact OD2-NH2 2.82Å; D139-Y165 PolarHBondContact OD1-OH 3.46Å
140	N	83.9	Confident	83.1	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.3	56	-157.8	-172.5	10.4	0	0	0	111.7	H114 V115 V116 Y135 V136 S137 K299	H114-N140 PolarHBondContact CE1-ND2 3.34Å; H114-N140 PolarHBondContact O-ND2 3.26Å; V115-N140 VanDerWaalsContact CG2-OD1 3.28Å; V115-N140 WeakPolarHBondContact CG2-OD1 3.1Å; V116-N140 PolarHBondContact N-O 3.08Å; Y135-N140 PolarHBondContact OH-OD1 3.08Å; V136-N140 WeakPolarHBondContact O-CA 3.17Å; V136-N140 PolarHBondContact O-N 3.41Å; S137-N140 PolarHBondContact O-N 3.43Å; S137-N140 VanDerWaalsContact O-N 3.1Å; N140-K299 HydrophobicContact CB-CB 3.9Å; N140-K299 HydrophobicContact CB-CD 4.05Å; N140-K299 HydrophobicContact CB-CG 4.22Å
141	A	86.5	Confident	82.4	Confident	2 Å²	2	43.5 Å²	43.5	2%	0.017	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	151.6	-175.8	0	0	0	0	0	112.5	V116 V136 D139 R143	V116-A141 HydrophobicContact CB-CB 3.87Å; V116-A141 CarbonylContact O-C 3.6Å; V116-A141 WeakPolarHBondContact O-CA 3.41Å; V136-A141 PolarHBondContact N-O 2.89Å; V136-A141 PolarHBondContact O-N 3.4Å; D139-A141 VanDerWaalsContact C-N 3.32Å; D139-A141 HydrophobicContact CB-CB 3.77Å; A141-R143 HydrophobicContact CB-CG 4.45Å
142	C	91.5	Very high	81.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	121.6	162.1	-55.8	0	0	0	0	109	V116 N117 C129 I134	V116-C142 PolarHBondContact O-N 2.89Å; N117-C142 HydrophobicContact CB-CB 4.2Å; N117-C142 PolarHBondContact ND2-O 3.13Å; C129-C142 WeakPolarHBondContact CA-SG 3.34Å; C129-C142 HydrophobicContact CB-CB 3.76Å; C129-C142 WeakPolarHBondContact CB-SG 3.01Å; C129-C142 WeakPolarHBondContact SG-CB 3.08Å; C129-C142 CovalentContact SG-SG 2.04Å; C129-C142 PolarHBondContact SG-SG 2.03Å; I134-C142 CarbonylContact O-C 3.57Å; I134-C142 WeakPolarHBondContact O-CA 3.39Å
143	R	89.3	Confident	81.6	Confident	26 Å²	26	42.4 Å²	42.4	10%	0.098	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.9	-178.8	-60	-64.7	-161.9	-176.4	2.4	110.7	T133 I134 V136 D139 A141 S145 Y165	T133-R143 CarbonylContact C-O 3.55Å; T133-R143 WeakPolarHBondContact CA-O 3.29Å; T133-R143 WeakPolarHBondContact CB-O 3.43Å; I134-R143 PolarHBondContact N-O 2.88Å; I134-R143 PolarHBondContact O-N 3.35Å; V136-R143 HydrophobicContact CB-CG 4.07Å; V136-R143 HydrophobicContact CG2-CB 3.71Å; V136-R143 HydrophobicContact CG2-CG 3.54Å; D139-R143 IonicContact OD2-CZ 3.17Å; D139-R143 IonicContact OD2-NE 2.8Å; D139-R143 PolarHBondContact OD2-NE 2.04Å; D139-R143 IonicContact OD2-NH2 2.69Å; D139-R143 PolarHBondContact OD2-NH2 2.82Å; A141-R143 HydrophobicContact CB-CG 4.45Å; R143-S145 PolarHBondContact O-N 2.85Å; R143-Y165 HydrophobicContact CB-CD2 3.61Å; R143-Y165 HydrophobicContact CB-CE2 4.36Å; R143-Y165 HydrophobicContact CB-CG 3.75Å; R143-Y165 HydrophobicContact CG-CD2 3.76Å; R143-Y165 HydrophobicContact CG-CE2 4Å; R143-Y165 HydrophobicContact CG-CG 4.22Å
144	Q	88.9	Confident	81.3	Confident	103 Å²	103	41.6 Å²	41.6	48%	0.481	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	124.2	179.8	-175	62.4	28.2	0	0	110.8	G132 Y165 H166	G132-Q144 PolarHBondContact O-NE2 3.1Å; G132-Q144 PolarHBondContact O-OE1 3.06Å; Q144-Y165 CarbonylContact O-C 3.6Å; Q144-Y165 WeakPolarHBondContact O-CA 3.33Å; Q144-Y165 VanDerWaalsContact O-CB 3.27Å; Q144-Y165 WeakPolarHBondContact O-CB 3.21Å; Q144-H166 PolarHBondContact O-N 3.32Å
145	S	87.3	Confident	81.1	Confident	32 Å²	32	44.2 Å²	44.2	22%	0.224	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	145.2	177.6	-168.3	0	0	0	0	111.6	G132 R143	G132-S145 WeakPolarHBondContact O-CB 3.42Å; G132-S145 PolarHBondContact O-N 2.04Å; R143-S145 PolarHBondContact O-N 2.85Å
146	V	84.3	Confident	80.7	Confident	18 Å²	18	44.1 Å²	44.1	11%	0.109	23%	0.225	C	C	.	.			trans	-120.5	104.5	-179.8	178.3	0	0	0	0	111	N148 R158 C164 H166 Y216	V146-N148 HydrophobicContact CG1-CB 3.95Å; V146-R158 PolarHBondContact O-NH2 2.88Å; V146-C164 HydrophobicContact CB-CB 4.24Å; V146-C164 PolarHBondContact N-O 2.84Å; V146-H166 HydrophobicContact CG2-CB 3.71Å; V146-Y216 HydrophobicContact CB-CE1 4.48Å; V146-Y216 HydrophobicContact CG1-CD1 4.28Å; V146-Y216 HydrophobicContact CG1-CE1 3.88Å; V146-Y216 HydrophobicContact CG2-CD1 4.09Å; V146-Y216 HydrophobicContact CG2-CE1 3.97Å
147	E	74	Confident	80.7	Confident	125 Å²	125	44.1 Å²	44.1	58%	0.584	23%	0.225	S	C	*	.			trans	-82	-10.2	174.7	-70.4	-175.8	-168.2	0	0	113.7	N149 R158	E147-N149 PolarHBondContact O-N 3.08Å; E147-N149 VanDerWaalsContact O-N 3.07Å; E147-N149 PolarHBondContact O-OD1 2.03Å; E147-R158 VanDerWaalsContact CA-NH2 3.25Å; E147-R158 PolarHBondContact O-NH2 2.87Å
148	N	66.2	Low	80.8	Confident	75 Å²	75	47.4 Å²	47.4	40%	0.401	24%	0.235	S	C	.	.			trans	-58.1	113.6	-175.7	-172.8	-3.4	0	0	0	113.3	V146 Q150	V146-N148 HydrophobicContact CG1-CB 3.95Å; N148-Q150 VanDerWaalsContact C-N 3.28Å; N148-Q150 PolarHBondContact O-N 2.92Å; N148-Q150 WeakPolarHBondContact OD1-CB 3.02Å; N148-Q150 PolarHBondContact OD1-N 2.85Å
149	N	62.7	Low	81.2	Confident	120 Å²	120	52.4 Å²	52.4	64%	0.642	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.3	-178.7	-65.6	-27.7	0	0	0	114.3	E147 R158	E147-N149 PolarHBondContact O-N 3.08Å; E147-N149 VanDerWaalsContact O-N 3.07Å; E147-N149 PolarHBondContact O-OD1 2.03Å; N149-R158 PolarHBondContact OD1-NH1 2.99Å
150	Q	71	Confident	81.2	Confident	172 Å²	172	52.2 Å²	52.2	80%	0.804	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-15.5	-173	-63.3	-178.9	-13.4	0	0	114.3	N148 P152	N148-Q150 VanDerWaalsContact C-N 3.28Å; N148-Q150 PolarHBondContact O-N 2.92Å; N148-Q150 WeakPolarHBondContact OD1-CB 3.02Å; N148-Q150 PolarHBondContact OD1-N 2.85Å; Q150-P152 WeakPolarHBondContact O-CD 3.27Å
151	N	76.7	Confident	81.2	Confident	21 Å²	21	58.6 Å²	58.6	11%	0.112	30%	0.295	C	S	.	.			trans	-82.9	118.9	179.6	-176.4	-16.6	0	0	0	110.8	F153 C154 L155 Y216	N151-F153 VanDerWaalsContact C-N 3.26Å; N151-F153 PolarHBondContact O-N 2.87Å; N151-F153 WeakPolarHBondContact OD1-CB 3.44Å; N151-F153 PolarHBondContact OD1-N 2.94Å; N151-C154 HydrophobicContact CB-CB 4.17Å; N151-C154 PolarHBondContact O-N 2.93Å; N151-C154 VanDerWaalsContact O-N 3.13Å; N151-L155 PolarHBondContact O-N 3.09Å; N151-Y216 WeakPolarHBondContact ND2-CD2 3.19Å; N151-Y216 VanDerWaalsContact ND2-CE2 3.28Å; N151-Y216 WeakPolarHBondContact ND2-CE2 3.39Å
152	P	79.1	Confident	81.1	Confident	39 Å²	39	58.8 Å²	58.8	25%	0.253	30%	0.296	S	S	.	.	H	α-helix	trans	-65.1	-23.8	179.8	26.4	-34.1	0	0	0	114.1	Q150 K156	Q150-P152 WeakPolarHBondContact O-CD 3.27Å; P152-K156 WeakPolarHBondContact O-CG 3.35Å; P152-K156 PolarHBondContact O-N 3.46Å; P152-K156 VanDerWaalsContact O-N 3.16Å
153	F	81.8	Confident	80.9	Confident	6 Å²	6	62 Å²	62	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-65.3	-50.8	169.4	179.6	-81.2	0	0	0	110.7	N151 L155 K156 C157 C218 M226 F272 Y276 F277	N151-F153 VanDerWaalsContact C-N 3.26Å; N151-F153 PolarHBondContact O-N 2.87Å; N151-F153 WeakPolarHBondContact OD1-CB 3.44Å; N151-F153 PolarHBondContact OD1-N 2.94Å; F153-L155 VanDerWaalsContact C-N 3.29Å; F153-L155 PolarHBondContact O-N 2.81Å; F153-K156 PolarHBondContact O-N 3.2Å; F153-C157 PolarHBondContact O-N 3.5Å; F153-C218 HydrophobicContact CE1-CB 4.49Å; F153-M226 HydrophobicContact CE2-SD 4.47Å; F153-M226 HydrophobicContact CZ-CE 4.17Å; F153-M226 HydrophobicContact CZ-SD 3.83Å; F153-F272 HydrophobicContact CB-CE2 4.38Å; F153-F272 HydrophobicContact CD2-CD2 4.24Å; F153-F272 AromaticContact CD2-CE2 3.89Å; F153-F272 HydrophobicContact CD2-CE2 3.89Å; F153-F272 HydrophobicContact CD2-CZ 4.13Å; F153-Y276 HydrophobicContact CE2-CE1 4.35Å; F153-F277 HydrophobicContact CD1-CE1 4.29Å; F153-F277 AromaticContact CD2-CE1 3.88Å; F153-F277 HydrophobicContact CD2-CE1 3.88Å; F153-F277 AromaticContact CD2-CZ 3.93Å; F153-F277 HydrophobicContact CD2-CZ 3.93Å; F153-F277 HydrophobicContact CE1-CE1 4.03Å; F153-F277 AromaticContact CE2-CE1 3.6Å; F153-F277 HydrophobicContact CE2-CE1 3.6Å; F153-F277 AromaticContact CE2-CZ 3.97Å; F153-F277 HydrophobicContact CE2-CZ 3.97Å; F153-F277 HydrophobicContact CG-CE1 4.21Å; F153-F277 HydrophobicContact CG-CZ 4.42Å; F153-F277 AromaticContact CZ-CE1 3.68Å; F153-F277 HydrophobicContact CZ-CE1 3.68Å; F153-F277 HydrophobicContact CZ-CZ 4.49Å
154	C	84.7	Confident	80.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-34.6	177.9	-68.2	0	0	0	0	112.4	N151 C157 R158 C164	N151-C154 HydrophobicContact CB-CB 4.17Å; N151-C154 PolarHBondContact O-N 2.93Å; N151-C154 VanDerWaalsContact O-N 3.13Å; C154-C157 PolarHBondContact O-N 3.5Å; C154-R158 WeakPolarHBondContact O-CG 3.41Å; C154-R158 PolarHBondContact O-N 3.05Å; C154-C164 WeakPolarHBondContact CA-SG 3.04Å; C154-C164 HydrophobicContact CB-CB 3.51Å; C154-C164 WeakPolarHBondContact CB-SG 2.97Å; C154-C164 WeakPolarHBondContact SG-CB 3.27Å; C154-C164 CovalentContact SG-SG 2.04Å; C154-C164 PolarHBondContact SG-SG 3.13Å
155	L	83.9	Confident	80.8	Confident	91 Å²	91	55.9 Å²	55.9	48%	0.476	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-46.4	173.9	-169.1	71.1	0	0	0	111.4	N151 F153 R158 Q159	N151-L155 PolarHBondContact O-N 3.09Å; F153-L155 VanDerWaalsContact C-N 3.29Å; F153-L155 PolarHBondContact O-N 2.81Å; L155-R158 PolarHBondContact O-N 2.84Å; L155-Q159 VanDerWaalsContact O-CG 3.32Å; L155-Q159 WeakPolarHBondContact O-CG 3.43Å; L155-Q159 PolarHBondContact O-N 3.24Å
156	K	81.9	Confident	80.5	Confident	40 Å²	40	57.3 Å²	57.3	17%	0.174	29%	0.292	C	S	.	.	H	α-helix	trans	-69	-37.5	177.7	-71.5	174.4	-176.2	-178.4	0	113.3	P152 F153 R158 Q159 A160 Q270 F272 F277	P152-K156 WeakPolarHBondContact O-CG 3.35Å; P152-K156 PolarHBondContact O-N 3.46Å; P152-K156 VanDerWaalsContact O-N 3.16Å; F153-K156 PolarHBondContact O-N 3.2Å; K156-R158 VanDerWaalsContact C-N 3.33Å; K156-R158 PolarHBondContact O-N 3.19Å; K156-Q159 WeakPolarHBondContact O-CB 3.18Å; K156-Q159 PolarHBondContact O-N 3.38Å; K156-A160 PolarHBondContact O-N 2.86Å; K156-A160 VanDerWaalsContact O-N 3.13Å; K156-Q270 PolarHBondContact NZ-O 2.78Å; K156-F272 HydrophobicContact CD-CB 4.15Å; K156-F272 PolarHBondContact NZ-O 3.13Å; K156-F277 HydrophobicContact CB-CD2 4.13Å; K156-F277 HydrophobicContact CB-CE1 4.42Å; K156-F277 HydrophobicContact CB-CE2 3.6Å; K156-F277 HydrophobicContact CB-CZ 3.77Å; K156-F277 HydrophobicContact CD-CE2 4.13Å; K156-F277 HydrophobicContact CD-CZ 4.45Å
157	C	85.7	Confident	79.9	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-55.4	-48.1	171.5	175.1	0	0	0	0	111.2	F153 C154 Q159 A160 N161 G162 V163 C218 F277	F153-C157 PolarHBondContact O-N 3.5Å; C154-C157 PolarHBondContact O-N 3.5Å; C157-Q159 PolarHBondContact O-N 3.22Å; C157-A160 CarbonylContact O-C 3.5Å; C157-A160 WeakPolarHBondContact O-CA 3.43Å; C157-A160 PolarHBondContact O-N 3.21Å; C157-N161 PolarHBondContact O-N 3.47Å; C157-G162 WeakPolarHBondContact O-CA 3.41Å; C157-G162 PolarHBondContact O-N 3.01Å; C157-V163 VanDerWaalsContact SG-C 3.57Å; C157-C218 WeakPolarHBondContact CA-SG 3.46Å; C157-C218 HydrophobicContact CB-CB 3.79Å; C157-C218 WeakPolarHBondContact CB-SG 3.45Å; C157-C218 WeakPolarHBondContact SG-CA 3.04Å; C157-C218 WeakPolarHBondContact SG-CB 3.44Å; C157-C218 CovalentContact SG-SG 2.03Å; C157-C218 PolarHBondContact SG-SG 2.84Å; C157-F277 HydrophobicContact CB-CD1 4.01Å; C157-F277 HydrophobicContact CB-CE1 4.23Å
158	R	85.2	Confident	79.3	Confident	85 Å²	85	53.1 Å²	53.1	32%	0.321	28%	0.275	S	S	.	.	H	α-helix	trans	-68.4	-32.8	176.5	-66.1	-178.3	-162.4	163.3	9.3	113.5	V146 E147 N149 C154 L155 K156 A160 N161 G162	V146-R158 PolarHBondContact O-NH2 2.88Å; E147-R158 VanDerWaalsContact CA-NH2 3.25Å; E147-R158 PolarHBondContact O-NH2 2.87Å; N149-R158 PolarHBondContact OD1-NH1 2.99Å; C154-R158 WeakPolarHBondContact O-CG 3.41Å; C154-R158 PolarHBondContact O-N 3.05Å; L155-R158 PolarHBondContact O-N 2.84Å; K156-R158 VanDerWaalsContact C-N 3.33Å; K156-R158 PolarHBondContact O-N 3.19Å; R158-A160 PolarHBondContact O-N 3.05Å; R158-N161 PolarHBondContact O-N 2.61Å; R158-G162 WeakPolarHBondContact CA-O 3.14Å
159	Q	84.4	Confident	78.6	Confident	117 Å²	117	54 Å²	54	55%	0.547	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-14.6	170.5	-71.9	169.1	-8.8	0	0	113.4	L155 K156 C157	L155-Q159 VanDerWaalsContact O-CG 3.32Å; L155-Q159 WeakPolarHBondContact O-CG 3.43Å; L155-Q159 PolarHBondContact O-N 3.24Å; K156-Q159 WeakPolarHBondContact O-CB 3.18Å; K156-Q159 PolarHBondContact O-N 3.38Å; C157-Q159 PolarHBondContact O-N 3.22Å
160	A	77	Confident	77.7	Confident	24 Å²	24	52.8 Å²	52.8	20%	0.198	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	19	170.4	0	0	0	0	0	112.7	K156 C157 R158 G162 F277 C278	K156-A160 PolarHBondContact O-N 2.86Å; K156-A160 VanDerWaalsContact O-N 3.13Å; C157-A160 CarbonylContact O-C 3.5Å; C157-A160 WeakPolarHBondContact O-CA 3.43Å; C157-A160 PolarHBondContact O-N 3.21Å; R158-A160 PolarHBondContact O-N 3.05Å; A160-G162 PolarHBondContact O-N 2.96Å; A160-F277 HydrophobicContact CB-CB 3.64Å; A160-C278 HydrophobicContact CB-CB 4.34Å
161	N	82.2	Confident	76.5	Confident	135 Å²	135	47.1 Å²	47.1	72%	0.722	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	18.7	-175	-63.2	-15.1	0	0	0	115.2	C157 R158	C157-N161 PolarHBondContact O-N 3.47Å; R158-N161 PolarHBondContact O-N 2.61Å
162	G	84.5	Confident	74.7	Confident	5 Å²	5	49 Å²	49	5%	0.052	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-91.9	158.9	175.2	0	0	0	0	0	114	C157 R158 A160 S219	C157-G162 WeakPolarHBondContact O-CA 3.41Å; C157-G162 PolarHBondContact O-N 3.01Å; R158-G162 WeakPolarHBondContact CA-O 3.14Å; A160-G162 PolarHBondContact O-N 2.96Å; G162-S219 CarbonylContact C-O 3.59Å; G162-S219 WeakPolarHBondContact CA-O 3.36Å
163	V	87.7	Confident	72.7	Confident	68 Å²	68	54.6 Å²	54.6	41%	0.412	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.6	174.6	-169.7	0	0	0	0	109.4	I134 C157 S219	I134-V163 HydrophobicContact CD1-CB 3.78Å; I134-V163 HydrophobicContact CD1-CG1 3.7Å; I134-V163 HydrophobicContact CG2-CG1 4.45Å; C157-V163 VanDerWaalsContact SG-C 3.57Å; V163-S219 PolarHBondContact N-O 2.98Å; V163-S219 PolarHBondContact O-N 2.85Å
164	C	89.9	Confident	70.9	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	140.3	179.7	-156.7	0	0	0	0	110.9	V146 C154 G217	V146-C164 HydrophobicContact CB-CB 4.24Å; V146-C164 PolarHBondContact N-O 2.84Å; C154-C164 WeakPolarHBondContact CA-SG 3.04Å; C154-C164 HydrophobicContact CB-CB 3.51Å; C154-C164 WeakPolarHBondContact CB-SG 2.97Å; C154-C164 WeakPolarHBondContact SG-CB 3.27Å; C154-C164 CovalentContact SG-SG 2.04Å; C154-C164 PolarHBondContact SG-SG 3.13Å; C164-G217 WeakPolarHBondContact CA-O 3.38Å
165	Y	87.6	Confident	68.9	Low	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	165.9	174.3	65.2	-99.2	0	0	0	111.9	I134 V136 Q138 D139 R143 Q144 Y167 Y216 G217 C218	I134-Y165 HydrophobicContact CD1-CD1 4.38Å; V136-Y165 HydrophobicContact CB-CE1 4.32Å; V136-Y165 HydrophobicContact CG1-CD1 4.28Å; V136-Y165 HydrophobicContact CG1-CE1 3.52Å; V136-Y165 HydrophobicContact CG2-CD1 3.67Å; V136-Y165 HydrophobicContact CG2-CE1 3.78Å; V136-Y165 HydrophobicContact CG2-CG 4.15Å; Q138-Y165 PolarHBondContact NE2-OH 2.92Å; D139-Y165 PolarHBondContact OD1-OH 3.46Å; R143-Y165 HydrophobicContact CB-CD2 3.61Å; R143-Y165 HydrophobicContact CB-CE2 4.36Å; R143-Y165 HydrophobicContact CB-CG 3.75Å; R143-Y165 HydrophobicContact CG-CD2 3.76Å; R143-Y165 HydrophobicContact CG-CE2 4Å; R143-Y165 HydrophobicContact CG-CG 4.22Å; Q144-Y165 CarbonylContact O-C 3.6Å; Q144-Y165 WeakPolarHBondContact O-CA 3.33Å; Q144-Y165 VanDerWaalsContact O-CB 3.27Å; Q144-Y165 WeakPolarHBondContact O-CB 3.21Å; Y165-Y167 HydrophobicContact CE2-CD1 4.48Å; Y165-Y167 HydrophobicContact CE2-CD2 4.38Å; Y165-Y167 HydrophobicContact CE2-CE1 4.02Å; Y165-Y167 AromaticContact CE2-CE2 3.92Å; Y165-Y167 HydrophobicContact CE2-CE2 3.92Å; Y165-Y167 AromaticContact CE2-CZ 3.73Å; Y165-Y167 PolarHBondContact OH-OH 3.14Å; Y165-Y216 VanDerWaalsContact O-CA 3.31Å; Y165-Y216 WeakPolarHBondContact O-CA 3.45Å; Y165-G217 WeakPolarHBondContact CD1-O 3.43Å; Y165-G217 VanDerWaalsContact CZ-CA 3.47Å; Y165-G217 PolarHBondContact N-O 3.32Å; Y165-G217 PolarHBondContact O-N 2.71Å; Y165-C218 VanDerWaalsContact CE1-C 3.45Å
166	H	80.5	Confident	66.9	Low	63 Å²	63	62.7 Å²	62.7	29%	0.292	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.7	178.9	-171.2	-95.9	0	0	0	112.3	Q144 V146 T215 Y216	Q144-H166 PolarHBondContact O-N 3.32Å; V146-H166 HydrophobicContact CG2-CB 3.71Å; H166-T215 CarbonylContact C-O 3.55Å; H166-T215 WeakPolarHBondContact CA-O 3.32Å; H166-T215 PolarHBondContact CD2-O 3.43Å; H166-T215 PolarHBondContact CD2-OG1 3.19Å; H166-T215 WeakPolarHBondContact NE2-CB 3.48Å; H166-T215 PolarHBondContact NE2-OG1 2.9Å; H166-Y216 AromaticContact CD2-CE1 3.71Å; H166-Y216 AromaticContact CD2-CZ 3.79Å
167	Y	72.4	Confident	65.3	Low	11 Å²	11	64.2 Å²	64.2	4%	0.043	36%	0.355	C	S	.	.			trans	-85.1	113.2	168.5	-67.1	-82.4	0	0	0	110	Y165 T215	Y165-Y167 HydrophobicContact CE2-CD1 4.48Å; Y165-Y167 HydrophobicContact CE2-CD2 4.38Å; Y165-Y167 HydrophobicContact CE2-CE1 4.02Å; Y165-Y167 AromaticContact CE2-CE2 3.92Å; Y165-Y167 HydrophobicContact CE2-CE2 3.92Å; Y165-Y167 AromaticContact CE2-CZ 3.73Å; Y165-Y167 PolarHBondContact OH-OH 3.14Å; Y167-T215 PolarHBondContact N-O 3.1Å
168	S	61.2	Low	63.7	Low	44 Å²	44	67.1 Å²	67.1	31%	0.308	37%	0.37	S	S	.	.			trans	-64.4	133.5	172.6	49.1	0	0	0	0	111.1	S170 N171	S168-S170 PolarHBondContact O-N 2.95Å; S168-S170 PolarHBondContact OG-OG 2.84Å; S168-N171 PolarHBondContact O-N 3.04Å; S168-N171 PolarHBondContact OG-OD1 2.98Å
169	S	49.7	Very low	62.1	Low	92 Å²	92	67.1 Å²	67.1	64%	0.643	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-63	-22.1	-180	43	0	0	0	0	113.6	N171 Q172	S169-N171 PolarHBondContact O-N 2.73Å; S169-Q172 PolarHBondContact O-N 3.26Å
170	S	45.8	Very low	60.8	Low	95 Å²	95	66 Å²	66	66%	0.664	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-60.2	-23.2	170	55.8	0	0	0	0	114.2	S168	S168-S170 PolarHBondContact O-N 2.95Å; S168-S170 PolarHBondContact OG-OG 2.84Å
171	N	44.7	Very low	60	Low	54 Å²	54	66.8 Å²	66.8	29%	0.289	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-111.7	21.1	-174.8	-61.8	51.7	0	0	0	111.7	S168 S169 I173	S168-N171 PolarHBondContact O-N 3.04Å; S168-N171 PolarHBondContact OG-OD1 2.98Å; S169-N171 PolarHBondContact O-N 2.73Å; N171-I173 PolarHBondContact O-N 3.45Å
172	Q	39.9	Very low	59	Low	61 Å²	61	61.7 Å²	61.7	29%	0.285	34%	0.338	S	S	.	.			trans	-73.2	-10.3	179.3	-81.9	174.5	-33.6	0	0	114.2	S169 L174	S169-Q172 PolarHBondContact O-N 3.26Å; Q172-L174 PolarHBondContact O-N 3Å
173	I	36.5	Very low	58	Low	155 Å²	155	65.7 Å²	65.7	80%	0.795	35%	0.354	S	S	*	.			trans	-79.9	70.2	168.1	-47.1	177.6	0	0	0	109	N171	N171-I173 PolarHBondContact O-N 3.45Å
174	L	43.2	Very low	57	Low	68 Å²	68	63.2 Å²	63.2	36%	0.356	34%	0.337	S	S	.	.			trans	-66.3	133.1	163.8	-92.7	79.1	0	0	0	108.5	Q172 D178	Q172-L174 PolarHBondContact O-N 3Å; L174-D178 HydrophobicContact CD2-CB 4.18Å
175	N	43.5	Very low	56	Low	98 Å²	98	63.8 Å²	63.8	52%	0.524	34%	0.339	S	S	.	.			trans	-79.9	156.7	-172.3	-161.2	-25.8	0	0	0	109.1	N177 D178	N175-N177 HydrophobicContact CB-CB 4.48Å; N175-N177 PolarHBondContact O-N 3.01Å; N175-D178 PolarHBondContact N-OD2 3.47Å; N175-D178 VanDerWaalsContact N-OD2 3.14Å; N175-D178 PolarHBondContact O-N 2.83Å
176	V	42.2	Very low	55.4	Low	102 Å²	102	66.2 Å²	66.2	62%	0.618	35%	0.351	S	S	*	.	H	α-helix	trans	-55.5	-20.6	176.3	-178.3	0	0	0	0	111.5	D178 K180	V176-D178 VanDerWaalsContact C-N 3.31Å; V176-D178 PolarHBondContact O-N 2.95Å; V176-K180 WeakPolarHBondContact O-CG 3.27Å; V176-K180 PolarHBondContact O-N 2.74Å
177	N	47.9	Very low	54.8	Low	72 Å²	72	67 Å²	67	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-66.1	-19.2	174.2	-64.1	-24.6	0	0	0	115.7	N175 K180 R302	N175-N177 HydrophobicContact CB-CB 4.48Å; N175-N177 PolarHBondContact O-N 3.01Å; N177-K180 WeakPolarHBondContact O-CB 3.37Å; N177-K180 WeakPolarHBondContact OD1-CE 3.38Å; N177-K180 PolarHBondContact OD1-NZ 3.38Å; N177-R302 PolarHBondContact O-NH2 3.38Å
178	D	51.6	Low	54.4	Low	60 Å²	60	70.3 Å²	70.3	32%	0.321	37%	0.366	S	S	.	.	H	α-helix	trans	-83.6	-39.2	179	-61.4	-48.7	0	0	0	111.2	L174 N175 V176 K180 R181	L174-D178 HydrophobicContact CD2-CB 4.18Å; N175-D178 PolarHBondContact N-OD2 3.47Å; N175-D178 VanDerWaalsContact N-OD2 3.14Å; N175-D178 PolarHBondContact O-N 2.83Å; V176-D178 VanDerWaalsContact C-N 3.31Å; V176-D178 PolarHBondContact O-N 2.95Å; D178-K180 PolarHBondContact O-N 2.89Å; D178-R181 VanDerWaalsContact O-CB 3.31Å; D178-R181 WeakPolarHBondContact O-CB 3.48Å; D178-R181 PolarHBondContact O-N 3.26Å
179	I	52.5	Low	54.5	Low	86 Å²	86	74.6 Å²	74.6	44%	0.441	39%	0.386	S	S	.	.	H	α-helix	trans	-58.6	-31.5	167.6	-60	173.7	0	0	0	110.6	R181	I179-R181 PolarHBondContact O-N 3.02Å
180	K	57.1	Low	55.1	Low	92 Å²	92	78.6 Å²	78.6	40%	0.4	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-64.6	-17.8	173.5	-68	179	-163.7	167.4	0	113.7	V176 N177 D178 Y185 R302	V176-K180 WeakPolarHBondContact O-CG 3.27Å; V176-K180 PolarHBondContact O-N 2.74Å; N177-K180 WeakPolarHBondContact O-CB 3.37Å; N177-K180 WeakPolarHBondContact OD1-CE 3.38Å; N177-K180 PolarHBondContact OD1-NZ 3.38Å; D178-K180 PolarHBondContact O-N 2.89Å; K180-Y185 WeakPolarHBondContact CA-OH 3.1Å; K180-Y185 VanDerWaalsContact CB-OH 3.23Å; K180-Y185 WeakPolarHBondContact CB-OH 3.35Å; K180-Y185 VanDerWaalsContact O-CE2 3.3Å; K180-Y185 WeakPolarHBondContact O-CE2 3.17Å; K180-Y185 PolarHBondContact O-OH 2.04Å; K180-R302 WeakPolarHBondContact O-CD 3.48Å; K180-R302 PolarHBondContact O-NE 3.04Å
181	R	59.1	Low	55.8	Low	41 Å²	41	79.6 Å²	79.6	16%	0.155	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-71.7	-31.7	180	-167.5	172.5	-175.5	177.5	-2	113.2	Q138 D178 I179 K183 C296 R297 S298	Q138-R181 PolarHBondContact O-NH1 3.08Å; D178-R181 VanDerWaalsContact O-CB 3.31Å; D178-R181 WeakPolarHBondContact O-CB 3.48Å; D178-R181 PolarHBondContact O-N 3.26Å; I179-R181 PolarHBondContact O-N 3.02Å; R181-K183 VanDerWaalsContact C-N 3.34Å; R181-K183 PolarHBondContact O-N 2.94Å; R181-C296 PolarHBondContact NH2-O 2.01Å; R181-R297 PolarHBondContact NH2-O 2.85Å; R181-S298 PolarHBondContact NH2-O 3.5Å
182	Y	60.6	Low	56.9	Low	28 Å²	28	78.9 Å²	78.9	11%	0.11	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-93.3	13.5	-176	-55	-87.9	0	0	0	113.8	S229 F230 N291 L295	Y182-S229 PolarHBondContact OH-OG 2.74Å; Y182-F230 HydrophobicContact CD1-CZ 4.4Å; Y182-F230 AromaticContact CD2-CE1 3.85Å; Y182-F230 HydrophobicContact CD2-CE1 3.85Å; Y182-F230 AromaticContact CD2-CZ 3.64Å; Y182-F230 HydrophobicContact CD2-CZ 3.64Å; Y182-F230 HydrophobicContact CE1-CZ 4.34Å; Y182-F230 AromaticContact CE2-CE1 3.59Å; Y182-F230 HydrophobicContact CE2-CE1 3.59Å; Y182-F230 AromaticContact CE2-CZ 3.59Å; Y182-F230 HydrophobicContact CE2-CZ 3.59Å; Y182-F230 HydrophobicContact CG-CZ 4.06Å; Y182-F230 AromaticContact CZ-CZ 3.95Å; Y182-N291 VanDerWaalsContact O-CB 3.3Å; Y182-N291 WeakPolarHBondContact O-CB 3.28Å; Y182-L295 HydrophobicContact CD1-CD2 4.32Å; Y182-L295 HydrophobicContact CE1-CD1 4.41Å
183	K	63.6	Low	58.4	Low	90 Å²	90	79.4 Å²	79.4	39%	0.391	39%	0.392	S	S	.	.	S	Bend	trans	-103	149.3	173.4	-68.5	-168.8	175.1	-166.9	0	110.8	R181 Y185 P194	R181-K183 VanDerWaalsContact C-N 3.34Å; R181-K183 PolarHBondContact O-N 2.94Å; K183-Y185 HydrophobicContact CB-CE2 3.75Å; K183-Y185 VanDerWaalsContact O-CD2 3.32Å; K183-Y185 WeakPolarHBondContact O-CD2 3.23Å; K183-Y185 WeakPolarHBondContact O-CE2 3.38Å; K183-P194 HydrophobicContact CD-CB 4.36Å
184	R	67.5	Low	59.9	Low	15 Å²	15	74.3 Å²	74.3	6%	0.057	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	153.7	163.6	-70.9	175.1	-65.5	173	2	110.1	F195 S197 D200 C303 F315	R184-F195 HydrophobicContact CB-CB 3.99Å; R184-F195 PolarHBondContact O-N 2.9Å; R184-S197 PolarHBondContact NH2-OG 2.82Å; R184-D200 IonicContact CZ-OD2 2.67Å; R184-D200 IonicContact NE-OD1 2.68Å; R184-D200 IonicContact NE-OD2 2.93Å; R184-D200 IonicContact NH2-OD1 2.68Å; R184-D200 IonicContact NH2-OD2 3.73Å; R184-D200 PolarHBondContact NH2-OD2 2.03Å; R184-C303 WeakPolarHBondContact CA-O 3.35Å; R184-C303 HydrophobicContact CG-CB 4.42Å; R184-F315 HydrophobicContact CB-CD1 3.95Å; R184-F315 HydrophobicContact CB-CE1 3.71Å; R184-F315 HydrophobicContact CB-CZ 4.34Å; R184-F315 HydrophobicContact CG-CD1 3.97Å; R184-F315 HydrophobicContact CG-CE1 4.1Å; R184-F315 HydrophobicContact CG-CG 4.35Å
185	Y	68.9	Low	60.9	Low	12 Å²	12	73 Å²	73	5%	0.047	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	160.6	-179	-66.1	-95.7	0	0	0	111.8	K180 K183 L192 I193 P194 R302 C303 I304 K305	K180-Y185 WeakPolarHBondContact CA-OH 3.1Å; K180-Y185 VanDerWaalsContact CB-OH 3.23Å; K180-Y185 WeakPolarHBondContact CB-OH 3.35Å; K180-Y185 VanDerWaalsContact O-CE2 3.3Å; K180-Y185 WeakPolarHBondContact O-CE2 3.17Å; K180-Y185 PolarHBondContact O-OH 2.04Å; K183-Y185 HydrophobicContact CB-CE2 3.75Å; K183-Y185 VanDerWaalsContact O-CD2 3.32Å; K183-Y185 WeakPolarHBondContact O-CD2 3.23Å; K183-Y185 WeakPolarHBondContact O-CE2 3.38Å; Y185-L192 HydrophobicContact CD1-CB 3.97Å; Y185-L192 HydrophobicContact CD1-CD2 4.07Å; Y185-L192 HydrophobicContact CD1-CG 4.07Å; Y185-L192 HydrophobicContact CG-CD2 4.02Å; Y185-L192 HydrophobicContact CG-CG 4.18Å; Y185-I193 CarbonylContact C-O 3.54Å; Y185-I193 VanDerWaalsContact CA-O 3.28Å; Y185-I193 WeakPolarHBondContact CA-O 3.15Å; Y185-P194 HydrophobicContact CD1-CG 4.4Å; Y185-P194 HydrophobicContact CE1-CB 4.31Å; Y185-P194 HydrophobicContact CE1-CG 3.94Å; Y185-R302 HydrophobicContact CD2-CB 3.85Å; Y185-R302 HydrophobicContact CD2-CG 4.24Å; Y185-R302 HydrophobicContact CE2-CB 4.16Å; Y185-R302 HydrophobicContact CE2-CG 4.08Å; Y185-C303 PolarHBondContact N-O 2.85Å; Y185-I304 CarbonylContact O-C 3.56Å; Y185-I304 WeakPolarHBondContact O-CA 3.28Å; Y185-K305 PolarHBondContact O-N 3.3Å
186	E	74.4	Confident	61.7	Low	52 Å²	52	75.3 Å²	75.3	24%	0.243	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.2	170.1	178.8	159.9	164.3	0	0	108.5	I193 F195 K305	E186-I193 PolarHBondContact N-O 3.4Å; E186-I193 PolarHBondContact O-N 2.83Å; E186-F195 HydrophobicContact CB-CD2 4.37Å; E186-F195 WeakPolarHBondContact OE2-CD2 3.12Å; E186-K305 HydrophobicContact CB-CB 4.42Å; E186-K305 HydrophobicContact CB-CD 4.31Å; E186-K305 VanDerWaalsContact CD-CD 3.45Å; E186-K305 HydrophobicContact CG-CD 3.87Å; E186-K305 IonicContact OE1-NZ 3.75Å; E186-K305 PolarHBondContact OE1-NZ 2.75Å; E186-K305 WeakPolarHBondContact OE2-CD 3.33Å; E186-K305 WeakPolarHBondContact OE2-CE 3.32Å; E186-K305 IonicContact OE2-NZ 3.76Å; E186-K305 PolarHBondContact OE2-NZ 3.49Å
187	Y	68.9	Low	62.5	Low	78 Å²	78	71.3 Å²	71.3	31%	0.306	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	120.3	171.1	-93.3	-66.3	0	0	0	108.8	L192 I304 C319 P321	Y187-L192 HydrophobicContact CD1-CD1 3.78Å; Y187-L192 HydrophobicContact CE1-CD1 3.28Å; Y187-L192 HydrophobicContact CE2-CD1 4.16Å; Y187-L192 HydrophobicContact CG-CD1 4.39Å; Y187-L192 VanDerWaalsContact CZ-CD1 3.48Å; Y187-I304 HydrophobicContact CD2-CD1 4.34Å; Y187-I304 HydrophobicContact CD2-CG2 3.67Å; Y187-I304 HydrophobicContact CE2-CD1 3.67Å; Y187-I304 HydrophobicContact CE2-CG2 4Å; Y187-C319 PolarHBondContact OH-O 2.98Å; Y187-P321 HydrophobicContact CE1-CG 3.73Å; Y187-P321 WeakPolarHBondContact OH-CD 3.37Å; Y187-P321 WeakPolarHBondContact OH-CG 3.47Å
188	K	64.2	Low	62.7	Low	81 Å²	81	70.4 Å²	70.4	35%	0.352	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	131.5	174.7	-168.1	-174.2	177.6	-174.4	0	109.5	H190 D191 I193 E666	K188-H190 PolarHBondContact O-N 2.56Å; K188-H190 VanDerWaalsContact O-N 3.14Å; K188-D191 PolarHBondContact N-O 3.24Å; K188-D191 PolarHBondContact O-N 3.15Å; K188-I193 HydrophobicContact CB-CD1 3.8Å; K188-I193 HydrophobicContact CB-CG1 4.23Å; K188-I193 HydrophobicContact CD-CD1 3.89Å; K188-I193 HydrophobicContact CG-CD1 4.32Å; K188-E666 IonicContact NZ-OE1 2.84Å; K188-E666 PolarHBondContact NZ-OE1 2.89Å
189	D	62.6	Low	62.8	Low	134 Å²	134	69.1 Å²	69.1	72%	0.717	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	36.5	178.8	-53.3	-43.2	0	0	0	113.6	D191	D189-D191 PolarHBondContact O-N 3.12Å
190	H	61.6	Low	62.8	Low	177 Å²	177	66.3 Å²	66.3	82%	0.819	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	-7.3	-172	-60.8	-75.3	0	0	0	117.3	K188	K188-H190 PolarHBondContact O-N 2.56Å; K188-H190 VanDerWaalsContact O-N 3.14Å
191	D	61.1	Low	62.4	Low	116 Å²	116	67.8 Å²	67.8	62%	0.62	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	159.8	176.2	-82.8	-36.7	0	0	0	113.5	K188 D189	K188-D191 PolarHBondContact N-O 3.24Å; K188-D191 PolarHBondContact O-N 3.15Å; D189-D191 PolarHBondContact O-N 3.12Å
192	L	68.3	Low	61.9	Low	39 Å²	39	69 Å²	69	20%	0.204	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	104	168.1	-112.3	68.4	0	0	0	110.1	Y185 Y187 R302 I304 I320 P321	Y185-L192 HydrophobicContact CD1-CB 3.97Å; Y185-L192 HydrophobicContact CD1-CD2 4.07Å; Y185-L192 HydrophobicContact CD1-CG 4.07Å; Y185-L192 HydrophobicContact CG-CD2 4.02Å; Y185-L192 HydrophobicContact CG-CG 4.18Å; Y187-L192 HydrophobicContact CD1-CD1 3.78Å; Y187-L192 HydrophobicContact CE1-CD1 3.28Å; Y187-L192 HydrophobicContact CE2-CD1 4.16Å; Y187-L192 HydrophobicContact CG-CD1 4.39Å; Y187-L192 VanDerWaalsContact CZ-CD1 3.48Å; L192-R302 HydrophobicContact CD2-CB 4.33Å; L192-R302 HydrophobicContact CD2-CG 4.31Å; L192-I304 HydrophobicContact CD1-CD1 3.91Å; L192-I304 HydrophobicContact CD2-CD1 4.04Å; L192-I304 HydrophobicContact CG-CD1 4.2Å; L192-I320 HydrophobicContact CD2-CG1 4.39Å; L192-P321 HydrophobicContact CD1-CG 3.92Å
193	I	71.5	Confident	61.5	Low	72 Å²	72	68.7 Å²	68.7	37%	0.369	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132	175.1	-56.2	-167.3	0	0	0	109.5	Y185 E186 K188 F195	Y185-I193 CarbonylContact C-O 3.54Å; Y185-I193 VanDerWaalsContact CA-O 3.28Å; Y185-I193 WeakPolarHBondContact CA-O 3.15Å; E186-I193 PolarHBondContact N-O 3.4Å; E186-I193 PolarHBondContact O-N 2.83Å; K188-I193 HydrophobicContact CB-CD1 3.8Å; K188-I193 HydrophobicContact CB-CG1 4.23Å; K188-I193 HydrophobicContact CD-CD1 3.89Å; K188-I193 HydrophobicContact CG-CD1 4.32Å; I193-F195 PolarHBondContact O-N 3.13Å
194	P	68	Low	60.9	Low	48 Å²	48	70.3 Å²	70.3	31%	0.312	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	126.7	173.4	-22.5	32.8	0	0	0	111.6	K183 Y185 N196	K183-P194 HydrophobicContact CD-CB 4.36Å; Y185-P194 HydrophobicContact CD1-CG 4.4Å; Y185-P194 HydrophobicContact CE1-CB 4.31Å; Y185-P194 HydrophobicContact CE1-CG 3.94Å; P194-N196 PolarHBondContact O-N 2.96Å
195	F	63.8	Low	59.8	Low	39 Å²	39	75.9 Å²	75.9	17%	0.171	38%	0.379	C	S	.	.			trans	-74.4	107.6	176.7	-171.1	-96.8	0	0	0	109.4	R184 E186 I193 S197 K305 I313 F315	R184-F195 HydrophobicContact CB-CB 3.99Å; R184-F195 PolarHBondContact O-N 2.9Å; E186-F195 HydrophobicContact CB-CD2 4.37Å; E186-F195 WeakPolarHBondContact OE2-CD2 3.12Å; I193-F195 PolarHBondContact O-N 3.13Å; F195-S197 PolarHBondContact O-N 3.43Å; F195-K305 HydrophobicContact CE2-CD 4.36Å; F195-I313 HydrophobicContact CZ-CD1 4.28Å; F195-F315 HydrophobicContact CB-CE1 4.37Å; F195-F315 HydrophobicContact CD1-CE1 4.25Å; F195-F315 AromaticContact CD1-CZ 3.72Å; F195-F315 HydrophobicContact CD1-CZ 3.72Å; F195-F315 HydrophobicContact CD2-CE1 4.42Å; F195-F315 HydrophobicContact CD2-CZ 4.23Å; F195-F315 AromaticContact CE1-CZ 3.77Å; F195-F315 HydrophobicContact CE1-CZ 3.77Å; F195-F315 HydrophobicContact CE2-CZ 4.28Å; F195-F315 HydrophobicContact CG-CE1 4.11Å; F195-F315 AromaticContact CG-CZ 3.95Å; F195-F315 HydrophobicContact CG-CZ 3.95Å; F195-F315 HydrophobicContact CZ-CZ 4.05Å
196	N	61.4	Low	58.7	Low	147 Å²	147	77.6 Å²	77.6	79%	0.786	39%	0.389	S	S	*	.			trans	-89.5	84.4	-175.3	-69.2	-43	0	0	0	111	P194	P194-N196 PolarHBondContact O-N 2.96Å
197	S	58.2	Low	57.4	Low	18 Å²	18	77.6 Å²	77.6	13%	0.126	39%	0.39	C	S	.	.			trans	-99.8	163.2	171.6	98.9	0	0	0	0	112.3	R184 F195 I199 D200	R184-S197 PolarHBondContact NH2-OG 2.82Å; F195-S197 PolarHBondContact O-N 3.43Å; S197-I199 PolarHBondContact O-N 3.33Å; S197-I199 VanDerWaalsContact O-N 3.17Å; S197-I199 WeakPolarHBondContact OG-CB 3.34Å; S197-I199 PolarHBondContact OG-N 3.38Å; S197-I199 VanDerWaalsContact OG-N 3.14Å; S197-D200 VanDerWaalsContact CB-OD2 3.31Å; S197-D200 WeakPolarHBondContact CB-OD2 3.34Å; S197-D200 PolarHBondContact N-OD2 2.91Å; S197-D200 PolarHBondContact O-N 3.45Å; S197-D200 PolarHBondContact OG-OD2 2.86Å
198	P	53.1	Low	56.2	Low	54 Å²	54	80 Å²	80	35%	0.351	40%	0.404	S	S	.	.	H	α-helix	trans	-57.7	-27.8	174	-24	35.2	0	0	0	113.7	D200 L201 I202 L688	P198-D200 VanDerWaalsContact C-N 3.28Å; P198-D200 PolarHBondContact O-N 2.51Å; P198-L201 WeakPolarHBondContact O-CB 3.37Å; P198-L201 PolarHBondContact O-N 2.96Å; P198-I202 WeakPolarHBondContact O-CG1 3.41Å; P198-I202 PolarHBondContact O-N 2.99Å; P198-I202 VanDerWaalsContact O-N 3.15Å; P198-L688 HydrophobicContact CB-CD2 3.67Å; P198-L688 HydrophobicContact CG-CD2 3.34Å
199	I	53.3	Low	55.1	Low	32 Å²	32	85.8 Å²	85.8	16%	0.164	43%	0.425	C	S	.	.	H	α-helix	trans	-63.7	-36.5	177.1	-55.3	171.4	0	0	0	110.2	S197 L201 I202 F203 L672	S197-I199 PolarHBondContact O-N 3.33Å; S197-I199 VanDerWaalsContact O-N 3.17Å; S197-I199 WeakPolarHBondContact OG-CB 3.34Å; S197-I199 PolarHBondContact OG-N 3.38Å; S197-I199 VanDerWaalsContact OG-N 3.14Å; I199-L201 VanDerWaalsContact C-N 3.31Å; I199-L201 PolarHBondContact O-N 2.84Å; I199-I202 PolarHBondContact O-N 3.39Å; I199-F203 WeakPolarHBondContact O-CB 3.19Å; I199-F203 PolarHBondContact O-N 3.39Å; I199-L672 HydrophobicContact CD1-CD2 4.19Å
200	D	51.3	Low	54.1	Low	28 Å²	28	82.2 Å²	82.2	15%	0.15	41%	0.409	C	S	.	.	H	α-helix	trans	-76	-21.8	-177	-51.2	-89.4	0	0	0	112	R184 S197 P198 K204 N291	R184-D200 IonicContact CZ-OD2 2.67Å; R184-D200 IonicContact NE-OD1 2.68Å; R184-D200 IonicContact NE-OD2 2.93Å; R184-D200 IonicContact NH2-OD1 2.68Å; R184-D200 IonicContact NH2-OD2 3.73Å; R184-D200 PolarHBondContact NH2-OD2 2.03Å; S197-D200 VanDerWaalsContact CB-OD2 3.31Å; S197-D200 WeakPolarHBondContact CB-OD2 3.34Å; S197-D200 PolarHBondContact N-OD2 2.91Å; S197-D200 PolarHBondContact O-N 3.45Å; S197-D200 PolarHBondContact OG-OD2 2.86Å; P198-D200 VanDerWaalsContact C-N 3.28Å; P198-D200 PolarHBondContact O-N 2.51Å; D200-K204 WeakPolarHBondContact O-CB 3.17Å; D200-K204 PolarHBondContact O-N 3.24Å; D200-K204 VanDerWaalsContact O-N 3.14Å; D200-N291 PolarHBondContact OD1-ND2 3.14Å
201	L	49.3	Very low	52.9	Low	123 Å²	123	82.1 Å²	82.1	64%	0.644	41%	0.409	S	S	*	.	H	α-helix	trans	-71.8	-49.5	166	-91.6	160.3	0	0	0	111.5	P198 I199 F203 K204 E205	P198-L201 WeakPolarHBondContact O-CB 3.37Å; P198-L201 PolarHBondContact O-N 2.96Å; I199-L201 VanDerWaalsContact C-N 3.31Å; I199-L201 PolarHBondContact O-N 2.84Å; L201-F203 VanDerWaalsContact C-N 3.28Å; L201-F203 PolarHBondContact O-N 2.66Å; L201-K204 WeakPolarHBondContact O-CB 3.38Å; L201-K204 PolarHBondContact O-N 3.23Å; L201-K204 VanDerWaalsContact O-N 3.11Å; L201-E205 PolarHBondContact O-N 2.79Å; L201-E205 VanDerWaalsContact O-N 3.13Å
202	I	49.5	Very low	52.1	Low	66 Å²	66	81.1 Å²	81.1	34%	0.338	40%	0.403	S	S	.	.	H	α-helix	trans	-57.7	-44.6	174.8	-66.3	165.7	0	0	0	110.1	P198 I199 K204 E205 I206 L684	P198-I202 WeakPolarHBondContact O-CG1 3.41Å; P198-I202 PolarHBondContact O-N 2.99Å; P198-I202 VanDerWaalsContact O-N 3.15Å; I199-I202 PolarHBondContact O-N 3.39Å; I202-K204 VanDerWaalsContact C-N 3.3Å; I202-K204 PolarHBondContact O-N 2.99Å; I202-E205 PolarHBondContact O-N 2.88Å; I202-E205 VanDerWaalsContact O-N 3.16Å; I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.41Å; I202-I206 VanDerWaalsContact O-CG1 3.31Å; I202-I206 WeakPolarHBondContact O-CG1 3.42Å; I202-I206 PolarHBondContact O-N 3.27Å; I202-L684 HydrophobicContact CD1-CD1 4.47Å; I202-L684 HydrophobicContact CD1-CD2 4.01Å
203	F	50.9	Low	51	Low	22 Å²	22	85.5 Å²	85.5	10%	0.096	43%	0.432	C	S	.	.	H	α-helix	trans	-64	-35.3	178.4	-142	-106.8	0	0	0	111.9	I199 L201 I206 L207 N291 I292	I199-F203 WeakPolarHBondContact O-CB 3.19Å; I199-F203 PolarHBondContact O-N 3.39Å; L201-F203 VanDerWaalsContact C-N 3.28Å; L201-F203 PolarHBondContact O-N 2.66Å; F203-I206 HydrophobicContact CD2-CD1 4.35Å; F203-I206 PolarHBondContact O-N 3.18Å; F203-L207 HydrophobicContact CD1-CD1 3.86Å; F203-L207 HydrophobicContact CD1-CG 4.1Å; F203-L207 HydrophobicContact CE1-CD1 4.41Å; F203-L207 HydrophobicContact CE1-CD2 4.45Å; F203-L207 HydrophobicContact CE1-CG 4.41Å; F203-L207 WeakPolarHBondContact O-CB 3.12Å; F203-L207 WeakPolarHBondContact O-CD1 3.32Å; F203-L207 WeakPolarHBondContact O-CG 3.02Å; F203-L207 PolarHBondContact O-N 3.35Å; F203-N291 WeakPolarHBondContact CE1-O 3.35Å; F203-N291 WeakPolarHBondContact CZ-O 3.47Å; F203-I292 HydrophobicContact CD2-CG1 4.44Å; F203-I292 HydrophobicContact CE2-CB 4.46Å; F203-I292 HydrophobicContact CE2-CD1 4.39Å; F203-I292 HydrophobicContact CE2-CG1 3.8Å; F203-I292 HydrophobicContact CE2-CG2 4.45Å; F203-I292 HydrophobicContact CZ-CG1 4.37Å
204	K	50.5	Low	50.2	Low	124 Å²	124	84.4 Å²	84.4	54%	0.539	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-40.5	173.2	-171.5	-173.5	173.5	-166.8	0	112.2	D200 L201 I202 L207 Q208	D200-K204 WeakPolarHBondContact O-CB 3.17Å; D200-K204 PolarHBondContact O-N 3.24Å; D200-K204 VanDerWaalsContact O-N 3.14Å; L201-K204 WeakPolarHBondContact O-CB 3.38Å; L201-K204 PolarHBondContact O-N 3.23Å; L201-K204 VanDerWaalsContact O-N 3.11Å; I202-K204 VanDerWaalsContact C-N 3.3Å; I202-K204 PolarHBondContact O-N 2.99Å; K204-L207 PolarHBondContact O-N 2.84Å; K204-Q208 WeakPolarHBondContact O-CG 3.5Å; K204-Q208 PolarHBondContact O-N 3.33Å; K204-Q208 VanDerWaalsContact O-N 3.08Å
205	E	44.2	Very low	50.1	Low	131 Å²	131	84 Å²	84	61%	0.612	42%	0.422	S	S	*	.	H	α-helix	trans	-66.8	-43.1	174.2	-67.8	-175	135.6	0	0	111.5	L201 I202 L207 Q208 Y209	L201-E205 PolarHBondContact O-N 2.79Å; L201-E205 VanDerWaalsContact O-N 3.13Å; I202-E205 PolarHBondContact O-N 2.88Å; I202-E205 VanDerWaalsContact O-N 3.16Å; E205-L207 VanDerWaalsContact C-N 3.31Å; E205-L207 PolarHBondContact O-N 2.88Å; E205-Q208 PolarHBondContact O-N 2.85Å; E205-Q208 VanDerWaalsContact O-N 3.09Å; E205-Y209 WeakPolarHBondContact O-CD2 3.02Å; E205-Y209 PolarHBondContact O-N 3.11Å; E205-Y209 VanDerWaalsContact O-N 3.08Å
206	I	46.9	Very low	50.7	Low	49 Å²	49	85 Å²	85	25%	0.251	43%	0.425	S	S	.	.	H	α-helix	trans	-58.3	-43.2	174.7	-65.1	168.5	0	0	0	111.3	I202 F203 Q208 Y209 L828	I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 HydrophobicContact CG2-CG1 4.41Å; I202-I206 VanDerWaalsContact O-CG1 3.31Å; I202-I206 WeakPolarHBondContact O-CG1 3.42Å; I202-I206 PolarHBondContact O-N 3.27Å; F203-I206 HydrophobicContact CD2-CD1 4.35Å; F203-I206 PolarHBondContact O-N 3.18Å; I206-Q208 VanDerWaalsContact C-N 3.32Å; I206-Q208 PolarHBondContact O-N 2.87Å; I206-Y209 PolarHBondContact O-N 2.79Å; I206-Y209 VanDerWaalsContact O-N 3.1Å; I206-L828 HydrophobicContact CD1-CD2 3.6Å; I206-L828 HydrophobicContact CG1-CD2 3.53Å; I206-L828 HydrophobicContact CG2-CD2 4.44Å
207	L	47.4	Very low	51.6	Low	51 Å²	51	78 Å²	78	27%	0.267	39%	0.387	S	S	.	.	H	α-helix	trans	-62.9	-36.2	176.1	-72.4	167.5	0	0	0	112	F203 K204 E205 Y209 T210 F230	F203-L207 HydrophobicContact CD1-CD1 3.86Å; F203-L207 HydrophobicContact CD1-CG 4.1Å; F203-L207 HydrophobicContact CE1-CD1 4.41Å; F203-L207 HydrophobicContact CE1-CD2 4.45Å; F203-L207 HydrophobicContact CE1-CG 4.41Å; F203-L207 WeakPolarHBondContact O-CB 3.12Å; F203-L207 WeakPolarHBondContact O-CD1 3.32Å; F203-L207 WeakPolarHBondContact O-CG 3.02Å; F203-L207 PolarHBondContact O-N 3.35Å; K204-L207 PolarHBondContact O-N 2.84Å; E205-L207 VanDerWaalsContact C-N 3.31Å; E205-L207 PolarHBondContact O-N 2.88Å; L207-Y209 VanDerWaalsContact C-N 3.31Å; L207-Y209 PolarHBondContact O-N 3.31Å; L207-T210 PolarHBondContact O-N 3Å; L207-T210 PolarHBondContact O-OG1 2.84Å; L207-F230 HydrophobicContact CD2-CD2 3.86Å; L207-F230 HydrophobicContact CD2-CE2 3.17Å; L207-F230 HydrophobicContact CD2-CZ 3.74Å
208	Q	44.2	Very low	52.9	Low	128 Å²	128	77.1 Å²	77.1	60%	0.598	38%	0.381	S	S	*	.	H	α-helix	trans	-71.1	-22.1	173.3	-71.5	-174	-110.3	0	0	113.5	K204 E205 I206 T210	K204-Q208 WeakPolarHBondContact O-CG 3.5Å; K204-Q208 PolarHBondContact O-N 3.33Å; K204-Q208 VanDerWaalsContact O-N 3.08Å; E205-Q208 PolarHBondContact O-N 2.85Å; E205-Q208 VanDerWaalsContact O-N 3.09Å; I206-Q208 VanDerWaalsContact C-N 3.32Å; I206-Q208 PolarHBondContact O-N 2.87Å; Q208-T210 PolarHBondContact O-N 3.43Å
209	Y	40	Very low	54.6	Low	203 Å²	203	75.2 Å²	75.2	80%	0.796	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-6.5	172	-89.8	-77.4	0	0	0	114.2	E205 I206 L207 E211	E205-Y209 WeakPolarHBondContact O-CD2 3.02Å; E205-Y209 PolarHBondContact O-N 3.11Å; E205-Y209 VanDerWaalsContact O-N 3.08Å; I206-Y209 PolarHBondContact O-N 2.79Å; I206-Y209 VanDerWaalsContact O-N 3.1Å; L207-Y209 VanDerWaalsContact C-N 3.31Å; L207-Y209 PolarHBondContact O-N 3.31Å; Y209-E211 VanDerWaalsContact C-N 3.25Å; Y209-E211 PolarHBondContact O-N 2.82Å
210	T	42.7	Very low	56.1	Low	60 Å²	60	74.5 Å²	74.5	37%	0.368	37%	0.367	S	S	.	.			trans	-89.4	33.7	176.9	58.2	0	0	0	0	114.2	L207 Q208 N212 V228	L207-T210 PolarHBondContact O-N 3Å; L207-T210 PolarHBondContact O-OG1 2.84Å; Q208-T210 PolarHBondContact O-N 3.43Å; T210-N212 VanDerWaalsContact C-N 3.35Å; T210-N212 PolarHBondContact O-N 3.04Å; T210-V228 HydrophobicContact CG2-CG1 4.2Å
211	E	35.9	Very low	57.5	Low	175 Å²	175	75.4 Å²	75.4	82%	0.818	38%	0.376	S	S	*	.			trans	-71.2	83.3	167.1	-72.5	-168.4	165.2	0	0	111.3	Y209	Y209-E211 VanDerWaalsContact C-N 3.25Å; Y209-E211 PolarHBondContact O-N 2.82Å
212	N	43.3	Very low	58.6	Low	95 Å²	95	77.2 Å²	77.2	51%	0.508	38%	0.381	S	S	.	.			trans	-134.7	132.5	164.6	-90.3	-64.4	0	0	0	111.2	T210 E214	T210-N212 VanDerWaalsContact C-N 3.35Å; T210-N212 PolarHBondContact O-N 3.04Å; N212-E214 VanDerWaalsContact C-N 3.26Å; N212-E214 PolarHBondContact O-N 3.16Å
213	T	46.6	Very low	59.7	Low	131 Å²	131	77.6 Å²	77.6	80%	0.804	38%	0.383	S	S	*	.			trans	-87.8	41	-163.9	58.1	0	0	0	0	113.6
214	E	53.4	Low	61.1	Low	49 Å²	49	76.9 Å²	76.9	23%	0.229	38%	0.381	C	S	.	.			trans	-101.4	123.9	-175	-64.5	-167.9	174.1	0	0	111.6	N212 Y216	N212-E214 VanDerWaalsContact C-N 3.26Å; N212-E214 PolarHBondContact O-N 3.16Å; E214-Y216 PolarHBondContact O-N 2.89Å; E214-Y216 VanDerWaalsContact O-N 3.07Å
215	T	67.2	Low	62.2	Low	40 Å²	40	71.1 Å²	71.1	25%	0.245	36%	0.356	C	S	.	.			trans	-82.7	31.4	-176.2	51.4	0	0	0	0	113.5	H166 Y167	H166-T215 CarbonylContact C-O 3.55Å; H166-T215 WeakPolarHBondContact CA-O 3.32Å; H166-T215 PolarHBondContact CD2-O 3.43Å; H166-T215 PolarHBondContact CD2-OG1 3.19Å; H166-T215 WeakPolarHBondContact NE2-CB 3.48Å; H166-T215 PolarHBondContact NE2-OG1 2.9Å; Y167-T215 PolarHBondContact N-O 3.1Å
216	Y	75.8	Confident	63.6	Low	58 Å²	58	65.1 Å²	65.1	23%	0.227	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	151.4	-170.9	-62.1	-89.5	0	0	0	112.5	V146 N151 Y165 H166 E214	V146-Y216 HydrophobicContact CB-CE1 4.48Å; V146-Y216 HydrophobicContact CG1-CD1 4.28Å; V146-Y216 HydrophobicContact CG1-CE1 3.88Å; V146-Y216 HydrophobicContact CG2-CD1 4.09Å; V146-Y216 HydrophobicContact CG2-CE1 3.97Å; N151-Y216 WeakPolarHBondContact ND2-CD2 3.19Å; N151-Y216 VanDerWaalsContact ND2-CE2 3.28Å; N151-Y216 WeakPolarHBondContact ND2-CE2 3.39Å; Y165-Y216 VanDerWaalsContact O-CA 3.31Å; Y165-Y216 WeakPolarHBondContact O-CA 3.45Å; H166-Y216 AromaticContact CD2-CE1 3.71Å; H166-Y216 AromaticContact CD2-CZ 3.79Å; E214-Y216 PolarHBondContact O-N 2.89Å; E214-Y216 VanDerWaalsContact O-N 3.07Å
217	G	80.7	Confident	64.2	Low	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	169.3	174.6	0	0	0	0	0	112	C164 Y165	C164-G217 WeakPolarHBondContact CA-O 3.38Å; Y165-G217 WeakPolarHBondContact CD1-O 3.43Å; Y165-G217 VanDerWaalsContact CZ-CA 3.47Å; Y165-G217 PolarHBondContact N-O 3.32Å; Y165-G217 PolarHBondContact O-N 2.71Å
218	C	85.3	Confident	64.6	Low	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.1	-177.3	-166.3	0	0	0	0	110.2	Q138 F153 C157 Y165 M226 F277	Q138-C218 PolarHBondContact NE2-O 3.07Å; F153-C218 HydrophobicContact CE1-CB 4.49Å; C157-C218 WeakPolarHBondContact CA-SG 3.46Å; C157-C218 HydrophobicContact CB-CB 3.79Å; C157-C218 WeakPolarHBondContact CB-SG 3.45Å; C157-C218 WeakPolarHBondContact SG-CA 3.04Å; C157-C218 WeakPolarHBondContact SG-CB 3.44Å; C157-C218 CovalentContact SG-SG 2.03Å; C157-C218 PolarHBondContact SG-SG 2.84Å; Y165-C218 VanDerWaalsContact CE1-C 3.45Å; C218-M226 HydrophobicContact CB-SD 3.76Å; C218-F277 HydrophobicContact CB-CD1 3.97Å
219	S	87.9	Confident	64.6	Low	14 Å²	14	56.2 Å²	56.2	10%	0.098	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	136.5	171.5	-163	0	0	0	0	109	Y135 G162 V163	Y135-S219 PolarHBondContact O-OG 2.86Å; Y135-S219 VanDerWaalsContact O-OG 3.06Å; G162-S219 CarbonylContact C-O 3.59Å; G162-S219 WeakPolarHBondContact CA-O 3.36Å; V163-S219 PolarHBondContact N-O 2.98Å; V163-S219 PolarHBondContact O-N 2.85Å
220	C	85.4	Confident	64.7	Low	17 Å²	17	49.3 Å²	49.3	12%	0.115	26%	0.261	C	S	.	.			trans	-127.2	152.3	-162.9	-63	0	0	0	0	111.8	T224 C278	C220-T224 WeakPolarHBondContact CB-O 3.16Å; C220-T224 WeakPolarHBondContact CB-OG1 3.3Å; C220-C278 HydrophobicContact CB-CB 3.55Å; C220-C278 WeakPolarHBondContact CB-SG 3.25Å; C220-C278 WeakPolarHBondContact SG-CA 3.41Å; C220-C278 WeakPolarHBondContact SG-CB 3.27Å; C220-C278 CovalentContact SG-SG 2.04Å; C220-C278 PolarHBondContact SG-SG 2.94Å
221	S	80.6	Confident	64.4	Low	48 Å²	48	47.4 Å²	47.4	34%	0.336	25%	0.25	S	S	.	.	S	Bend	trans	-91.4	174.1	-177.6	53.8	0	0	0	0	112.8	N223 T224	S221-N223 PolarHBondContact O-N 3Å; S221-T224 WeakPolarHBondContact O-CB 3.44Å; S221-T224 PolarHBondContact O-N 3.24Å; S221-T224 PolarHBondContact O-OG1 2.8Å
222	H	71.2	Confident	64.4	Low	161 Å²	161	44.6 Å²	44.6	75%	0.745	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	45.9	171.8	-50.7	-74.6	0	0	0	114.7	T224	H222-T224 PolarHBondContact O-N 3.36Å; H222-T224 VanDerWaalsContact O-N 3.1Å
223	N	74	Confident	63.8	Low	73 Å²	73	45.2 Å²	45.2	39%	0.39	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	23	-176.7	-62	-11.1	0	0	0	114.8	S221 M282 R297	S221-N223 PolarHBondContact O-N 3Å; N223-M282 VanDerWaalsContact C-CE 3.48Å; N223-M282 HydrophobicContact CB-CE 4.43Å; N223-M282 WeakPolarHBondContact O-CB 3.26Å; N223-M282 PolarHBondContact O-N 2.88Å; N223-R297 PolarHBondContact ND2-NH1 2.04Å; N223-R297 VanDerWaalsContact OD1-CZ 3.23Å; N223-R297 PolarHBondContact OD1-NH1 3.38Å; N223-R297 PolarHBondContact OD1-NH2 2.97Å
224	T	80.3	Confident	63	Low	8 Å²	8	44.7 Å²	44.7	5%	0.049	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	162	171.2	66.1	0	0	0	0	112.3	C220 S221 H222 A280 M282 F835	C220-T224 WeakPolarHBondContact CB-O 3.16Å; C220-T224 WeakPolarHBondContact CB-OG1 3.3Å; S221-T224 WeakPolarHBondContact O-CB 3.44Å; S221-T224 PolarHBondContact O-N 3.24Å; S221-T224 PolarHBondContact O-OG1 2.8Å; H222-T224 PolarHBondContact O-N 3.36Å; H222-T224 VanDerWaalsContact O-N 3.1Å; T224-A280 CarbonylContact C-O 3.59Å; T224-A280 WeakPolarHBondContact CA-O 3.34Å; T224-M282 WeakPolarHBondContact O-CE 3.36Å; T224-F835 HydrophobicContact CG2-CE2 3.99Å
225	G	74	Confident	62	Low	2 Å²	2	49.9 Å²	49.9	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	171.2	177.3	0	0	0	0	0	112.7	C278 K279 A280	G225-C278 CarbonylContact O-C 3.46Å; G225-C278 WeakPolarHBondContact O-CA 3.43Å; G225-K279 PolarHBondContact O-N 2.88Å; G225-A280 PolarHBondContact N-O 2.83Å; G225-A280 PolarHBondContact O-N 2.72Å
226	M	72.8	Confident	60.2	Low	6 Å²	6	57.4 Å²	57.4	3%	0.03	29%	0.291	C	S	.	.			trans	-75.2	135.6	171.9	-154.9	157.3	75.8	0	0	109	F153 C218 V228 Y276 F277	F153-M226 HydrophobicContact CE2-SD 4.47Å; F153-M226 HydrophobicContact CZ-CE 4.17Å; F153-M226 HydrophobicContact CZ-SD 3.83Å; C218-M226 HydrophobicContact CB-SD 3.76Å; M226-V228 WeakPolarHBondContact CE-O 3.16Å; M226-V228 PolarHBondContact O-N 3.16Å; M226-V228 VanDerWaalsContact O-N 3.14Å; M226-Y276 HydrophobicContact CE-CE1 4.14Å; M226-Y276 HydrophobicContact CG-CD1 3.92Å; M226-Y276 HydrophobicContact CG-CE1 3.69Å; M226-Y276 HydrophobicContact SD-CD1 4.1Å; M226-Y276 HydrophobicContact SD-CE1 3.66Å; M226-F277 HydrophobicContact SD-CD1 4.35Å
227	L	59.8	Low	58	Low	16 Å²	16	59.9 Å²	59.9	8%	0.084	31%	0.313	C	S	.	.	S	Bend	trans	-62.5	-23.9	-176.2	-67.3	161	0	0	0	113	W275 K279 A280 I292 D293	L227-W275 HydrophobicContact CD1-CE3 3.71Å; L227-W275 HydrophobicContact CD1-CZ3 4.04Å; L227-W275 WeakPolarHBondContact CD1-O 3.5Å; L227-K279 HydrophobicContact CG-CB 4.48Å; L227-A280 HydrophobicContact CD2-CB 4.03Å; L227-I292 WeakPolarHBondContact CD2-O 3.11Å; L227-D293 HydrophobicContact CD2-CB 4.22Å
228	V	56	Low	55.6	Low	15 Å²	15	67.6 Å²	67.6	9%	0.091	35%	0.354	C	S	.	.			trans	-148.7	120.7	-171.2	170.5	0	0	0	0	106.7	T210 M226 F230 Y276	T210-V228 HydrophobicContact CG2-CG1 4.2Å; M226-V228 WeakPolarHBondContact CE-O 3.16Å; M226-V228 PolarHBondContact O-N 3.16Å; M226-V228 VanDerWaalsContact O-N 3.14Å; V228-F230 HydrophobicContact CB-CE2 4.44Å; V228-F230 HydrophobicContact CG1-CD2 3.46Å; V228-F230 VanDerWaalsContact CG1-CD2 3.46Å; V228-F230 HydrophobicContact CG1-CE2 3.71Å; V228-Y276 HydrophobicContact CB-CE2 3.98Å; V228-Y276 HydrophobicContact CG1-CE2 4.44Å; V228-Y276 PolarHBondContact O-OH 3.04Å; V228-Y276 VanDerWaalsContact O-OH 3.11Å
229	S	44.5	Very low	53	Low	9 Å²	9	73.8 Å²	73.8	6%	0.063	39%	0.392	C	S	.	.			trans	-133.7	79.4	179.1	55.7	0	0	0	0	110.4	Y182	Y182-S229 PolarHBondContact OH-OG 2.74Å
230	F	41	Very low	50.2	Low	59 Å²	59	80.7 Å²	80.7	26%	0.259	43%	0.428	S	S	.	.			trans	-122.5	135.6	178.8	-56.3	-70.2	0	0	0	111.2	Y182 L207 V228	Y182-F230 HydrophobicContact CD1-CZ 4.4Å; Y182-F230 AromaticContact CD2-CE1 3.85Å; Y182-F230 HydrophobicContact CD2-CE1 3.85Å; Y182-F230 AromaticContact CD2-CZ 3.64Å; Y182-F230 HydrophobicContact CD2-CZ 3.64Å; Y182-F230 HydrophobicContact CE1-CZ 4.34Å; Y182-F230 AromaticContact CE2-CE1 3.59Å; Y182-F230 HydrophobicContact CE2-CE1 3.59Å; Y182-F230 AromaticContact CE2-CZ 3.59Å; Y182-F230 HydrophobicContact CE2-CZ 3.59Å; Y182-F230 HydrophobicContact CG-CZ 4.06Å; Y182-F230 AromaticContact CZ-CZ 3.95Å; L207-F230 HydrophobicContact CD2-CD2 3.86Å; L207-F230 HydrophobicContact CD2-CE2 3.17Å; L207-F230 HydrophobicContact CD2-CZ 3.74Å; V228-F230 HydrophobicContact CB-CE2 4.44Å; V228-F230 HydrophobicContact CG1-CD2 3.46Å; V228-F230 VanDerWaalsContact CG1-CD2 3.46Å; V228-F230 HydrophobicContact CG1-CE2 3.71Å
231	S	37.3	Very low	47.8	Very low	20 Å²	20	88.9 Å²	88.9	14%	0.14	46%	0.464	C	S	.	.			trans	-120	100.3	158.3	-164.4	0	0	0	0	106.1
232	M	35.4	Very low	45.4	Very low	116 Å²	116	91 Å²	91	57%	0.571	48%	0.479	S	S	*	.			trans	-109.4	107.7	-177	-85.4	-71	-82.1	0	0	109.7
233	N	30	Very low	43.6	Very low	107 Å²	107	91.5 Å²	91.5	57%	0.572	48%	0.481	S	S	*	.			trans	-134.4	46.6	178.9	-126.1	6.6	0	0	0	111.1
234	D	30.5	Very low	41.7	Very low	120 Å²	120	96.6 Å²	96.6	64%	0.642	51%	0.508	S	S	*	.			trans	-149.9	77.3	166.6	-116	-27.2	0	0	0	112.5
235	L	31.6	Very low	39.7	Very low	159 Å²	159	103.3 Å²	103.3	83%	0.832	54%	0.538	S	S	*	.			trans	-145.2	30.9	168.9	-133.4	149.2	0	0	0	111.6
236	K	30.7	Very low	37.8	Very low	197 Å²	197	112 Å²	112	86%	0.857	58%	0.575	S	S	*	*			trans	-123	36.5	-176.5	-81.9	-173.4	175	171.9	0	114.3
237	T	29.9	Very low	36	Very low	110 Å²	110	116.5 Å²	116.5	68%	0.675	61%	0.606	S	S	*	*	S	Bend	trans	-137.7	54.1	178.6	42.4	0	0	0	0	113.4
238	N	29.1	Very low	34.9	Very low	162 Å²	162	122.8 Å²	122.8	87%	0.866	63%	0.634	S	S	*	*	S	Bend	trans	-161.8	38.5	156	-107	-29.7	0	0	0	116.3
239	T	31	Very low	34	Very low	130 Å²	130	130 Å²	130	80%	0.798	67%	0.667	S	S	*	*	S	Bend	trans	-132.4	50.3	173.7	42.1	0	0	0	0	112.6
240	N	29.3	Very low	33.6	Very low	159 Å²	159	133.8 Å²	133.8	85%	0.85	69%	0.693	S	S	*	*			trans	-159.8	74.7	164.8	-101.8	-33.2	0	0	0	112.2
241	H	34.6	Very low	33.3	Very low	189 Å²	189	137.2 Å²	137.2	88%	0.875	72%	0.719	S	S	*	*			trans	-131	113.5	153	-101.9	-69.3	0	0	0	110.3
242	S	31.4	Very low	33.3	Very low	93 Å²	93	141 Å²	141	65%	0.65	75%	0.745	S	S	*	*			trans	-73.2	172	169.4	50	0	0	0	0	111.1
243	H	32.1	Very low	33.3	Very low	171 Å²	171	145.4 Å²	145.4	79%	0.792	76%	0.762	S	S	*	*			trans	74.3	83.1	-177.7	-59.6	-96.9	0	0	0	116.5
244	L	34.6	Very low	33.4	Very low	181 Å²	181	148.2 Å²	148.2	95%	0.948	78%	0.777	S	S	*	*				-151.1	152.9	99.9	-104.4	156	0	0	0	110.5
245	Q	37.3	Very low	33.6	Very low	148 Å²	148	152.4 Å²	152.4	69%	0.692	79%	0.789	S	S	*	*			trans	-113.9	150.1	-164	-81	-167.5	0.3	0	0	114.1
246	K	34.6	Very low	33.8	Very low	184 Å²	184	152.4 Å²	152.4	80%	0.8	79%	0.789	S	S	*	*			trans	86.9	150.6	155.6	-73.6	160.6	-177.9	174	0	118.5
247	P	35	Very low	33.9	Very low	102 Å²	102	148.9 Å²	148.9	66%	0.662	78%	0.779	S	S	*	*			trans	-123.6	-169.8	-156.2	42.3	-26.1	0	0	0	112.7
248	H	36.2	Very low	34.1	Very low	148 Å²	148	152.5 Å²	152.5	69%	0.685	79%	0.788	S	S	*	*				175.1	140.1	119.3	-104.8	-86.1	0	0	0	113.1
249	H	37.5	Very low	34.3	Very low	166 Å²	166	151.2 Å²	151.2	77%	0.769	78%	0.781	S	S	*	*			trans	61.5	145	164.1	-63.2	-66.2	0	0	0	119.2
250	S	36.7	Very low	34.4	Very low	88 Å²	88	151.6 Å²	151.6	62%	0.615	78%	0.777	S	S	*	*			cis	-168.7	142.4	-14.3	46.1	0	0	0	0	111.8
251	T	35.1	Very low	34.4	Very low	132 Å²	132	148.3 Å²	148.3	81%	0.81	77%	0.767	S	S	*	*			trans	49.1	130.5	149.1	54.8	0	0	0	0	119.5
252	S	36.5	Very low	34.3	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	77%	0.765	S	S	*	*			cis	-169.9	137.9	21.4	49.2	0	0	0	0	112.3
253	F	35.4	Very low	34.3	Very low	209 Å²	209	146.1 Å²	146.1	92%	0.917	76%	0.759	S	S	*	*			trans	-177.3	86.5	140.4	-108.5	-69.2	0	0	0	109.9
254	N	32.4	Very low	34.3	Very low	166 Å²	166	142.3 Å²	142.3	89%	0.888	75%	0.748	S	S	*	*			trans	-128.1	104.9	175.4	-102.8	10.6	0	0	0	110.3
255	K	34.3	Very low	34.1	Very low	207 Å²	207	144.2 Å²	144.2	90%	0.9	74%	0.744	S	S	*	*			trans	-179.9	100.9	155.8	-108	172.9	-178.6	-179.5	0	110.3
256	I	35.7	Very low	33.9	Very low	160 Å²	160	145.3 Å²	145.3	82%	0.821	75%	0.749	S	S	*	*	S	Bend	trans	-171.7	105.5	137.6	-94.2	150.4	0	0	0	108.4
257	N	34.3	Very low	33.7	Very low	122 Å²	122	144.1 Å²	144.1	65%	0.652	75%	0.751	S	S	*	*			trans	52.1	97.8	149.9	-54.3	-6.3	0	0	0	120.8	N259	N257-N259 PolarHBondContact O-N 2.86Å
258	E	32.8	Very low	33.5	Very low	186 Å²	186	143.4 Å²	143.4	87%	0.869	75%	0.745	S	S	*	*	S	Bend	trans	-70.5	25.5	164.6	-63.3	166	109.9	0	0	114.1	S261	E258-S261 PolarHBondContact O-OG 3Å; E258-S261 VanDerWaalsContact O-OG 3.07Å
259	N	33.8	Very low	33.4	Very low	135 Å²	135	144.8 Å²	144.8	72%	0.722	75%	0.751	S	S	*	*			trans	-95.9	5.6	-171.3	-75.3	5.8	0	0	0	114.5	N257	N257-N259 PolarHBondContact O-N 2.86Å
260	I	33.4	Very low	33.7	Very low	138 Å²	138	141.3 Å²	141.3	71%	0.708	74%	0.736	S	S	*	*			trans	-105.9	53.5	-178.6	-43.9	-178.3	0	0	0	109.8
261	S	29.6	Very low	34.3	Very low	91 Å²	91	145.5 Å²	145.5	64%	0.636	75%	0.745	S	S	*	*	S	Bend	trans	-135.6	20.9	-166.3	51.3	0	0	0	0	114.2	E258	E258-S261 PolarHBondContact O-OG 3Å; E258-S261 VanDerWaalsContact O-OG 3.07Å
262	L	31.5	Very low	35.1	Very low	159 Å²	159	141.2 Å²	141.2	83%	0.832	72%	0.715	S	S	*	*	S	Bend	trans	-153.6	-15.3	166.7	-140.7	70.2	0	0	0	116.5
263	S	30.8	Very low	36	Very low	77 Å²	77	138.7 Å²	138.7	54%	0.538	70%	0.697	S	S	.	*	S	Bend	trans	-84.2	-24	-174	47.2	0	0	0	0	115.2	Y265 Q266	S263-Y265 VanDerWaalsContact C-N 3.3Å; S263-Y265 PolarHBondContact O-N 3.45Å; S263-Q266 PolarHBondContact O-N 3.02Å
264	T	32.2	Very low	37	Very low	90 Å²	90	135 Å²	135	55%	0.552	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-66.4	-28.8	-171.5	-34.2	0	0	0	0	113.4	Q266	T264-Q266 VanDerWaalsContact C-N 3.27Å; T264-Q266 PolarHBondContact O-N 2.83Å
265	Y	31.9	Very low	38.3	Very low	221 Å²	221	129.2 Å²	129.2	87%	0.867	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-74	-8.3	-175.2	-108.3	-81.3	0	0	0	115.1	S263	S263-Y265 VanDerWaalsContact C-N 3.3Å; S263-Y265 PolarHBondContact O-N 3.45Å
266	Q	31.3	Very low	39.7	Very low	172 Å²	172	120.7 Å²	120.7	80%	0.804	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-106.9	2	-179	-68.1	-171.3	-69	0	0	114.7	S263 T264	S263-Q266 PolarHBondContact O-N 3.02Å; T264-Q266 VanDerWaalsContact C-N 3.27Å; T264-Q266 PolarHBondContact O-N 2.83Å
267	L	31.2	Very low	41.5	Very low	158 Å²	158	113.2 Å²	113.2	83%	0.827	57%	0.572	S	S	*	*	S	Bend	trans	-97.2	4.9	174.5	-71.6	169.2	0	0	0	113.7	Q269	L267-Q269 PolarHBondContact O-N 3.07Å
268	V	31.9	Very low	43.5	Very low	88 Å²	88	108 Å²	108	53%	0.533	55%	0.545	S	S	.	.			trans	-91.2	10.6	-170.5	-170.4	0	0	0	0	113.1	Q270	V268-Q270 VanDerWaalsContact C-N 3.33Å; V268-Q270 PolarHBondContact O-N 3.03Å
269	Q	33.7	Very low	45.5	Very low	176 Å²	176	100.5 Å²	100.5	82%	0.822	51%	0.51	S	S	*	.	S	Bend	trans	-76.5	79.7	174.9	-77	-155.6	-16.3	0	0	113.6	L267 Q271	L267-Q269 PolarHBondContact O-N 3.07Å; Q269-Q271 PolarHBondContact O-N 2.55Å
270	Q	42.3	Very low	47.3	Very low	94 Å²	94	94.1 Å²	94.1	44%	0.439	48%	0.475	S	S	.	.			trans	56.2	35.3	136.4	-64.7	-177.9	-38.9	0	0	118.5	K156 V268	K156-Q270 PolarHBondContact NZ-O 2.78Å; V268-Q270 VanDerWaalsContact C-N 3.33Å; V268-Q270 PolarHBondContact O-N 3.03Å
271	Q	50.1	Low	49.5	Very low	176 Å²	176	89.5 Å²	89.5	82%	0.822	45%	0.452	S	S	*	.			trans	-98.5	62.2	160.6	-76	-164.2	-16.4	0	0	113.4	Q269 P273	Q269-Q271 PolarHBondContact O-N 2.55Å; Q271-P273 WeakPolarHBondContact O-CD 3.06Å; Q271-P273 WeakPolarHBondContact O-CG 3.37Å; Q271-P273 VanDerWaalsContact O-N 3.12Å
272	F	52.9	Low	52	Low	41 Å²	41	85.8 Å²	85.8	18%	0.18	42%	0.424	C	S	.	.			trans	-47.4	115.1	145.1	-60.9	-67.9	0	0	0	108	F153 K156 F277	F153-F272 HydrophobicContact CB-CE2 4.38Å; F153-F272 HydrophobicContact CD2-CD2 4.24Å; F153-F272 AromaticContact CD2-CE2 3.89Å; F153-F272 HydrophobicContact CD2-CE2 3.89Å; F153-F272 HydrophobicContact CD2-CZ 4.13Å; K156-F272 HydrophobicContact CD-CB 4.15Å; K156-F272 PolarHBondContact NZ-O 3.13Å; F272-F277 HydrophobicContact CB-CE2 3.99Å; F272-F277 HydrophobicContact CB-CZ 4.19Å; F272-F277 HydrophobicContact CG-CZ 4.49Å
273	P	55.3	Low	54.4	Low	46 Å²	46	78.8 Å²	78.8	30%	0.299	39%	0.388	S	S	.	.			trans	-85.9	159.5	-174.8	-4.9	24.3	0	0	0	110.4	Q271 W275 Y276	Q271-P273 WeakPolarHBondContact O-CD 3.06Å; Q271-P273 WeakPolarHBondContact O-CG 3.37Å; Q271-P273 VanDerWaalsContact O-N 3.12Å; P273-W275 HydrophobicContact CG-CZ2 3.86Å; P273-W275 PolarHBondContact O-N 3.23Å; P273-Y276 PolarHBondContact O-N 2.98Å; P273-Y276 VanDerWaalsContact O-N 3.08Å
274	Q	56.6	Low	56.9	Low	132 Å²	132	76.5 Å²	76.5	62%	0.617	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-15.2	-166.9	-157	-170.7	5.7	0	0	114	Y276 K279	Q274-Y276 VanDerWaalsContact C-N 3.28Å; Q274-Y276 PolarHBondContact O-N 3.04Å; Q274-K279 WeakPolarHBondContact O-CE 3.46Å; Q274-K279 PolarHBondContact O-NZ 2.87Å
275	W	59.1	Low	59.4	Low	44 Å²	44	72.7 Å²	72.7	17%	0.167	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.3	176.4	57.9	-111.7	0	0	0	114.5	L227 P273 K279 N829 P831 I833	L227-W275 HydrophobicContact CD1-CE3 3.71Å; L227-W275 HydrophobicContact CD1-CZ3 4.04Å; L227-W275 WeakPolarHBondContact CD1-O 3.5Å; P273-W275 HydrophobicContact CG-CZ2 3.86Å; P273-W275 PolarHBondContact O-N 3.23Å; W275-K279 VanDerWaalsContact O-CD 3.29Å; W275-K279 WeakPolarHBondContact O-CD 3.38Å; W275-K279 WeakPolarHBondContact O-CG 3.43Å; W275-N829 PolarHBondContact NE1-O 2.7Å; W275-N829 VanDerWaalsContact NE1-O 3.07Å; W275-P831 WeakPolarHBondContact CB-O 3.41Å; W275-P831 HydrophobicContact CD2-CB 3.6Å; W275-P831 HydrophobicContact CD2-CG 3.82Å; W275-P831 VanDerWaalsContact CE2-CD 3.46Å; W275-P831 HydrophobicContact CE3-CB 3.57Å; W275-P831 HydrophobicContact CE3-CG 3.81Å; W275-P831 HydrophobicContact CG-CB 4.02Å; W275-P831 HydrophobicContact CH2-CB 4.46Å; W275-P831 HydrophobicContact CH2-CG 3.78Å; W275-P831 HydrophobicContact CZ2-CB 4.45Å; W275-P831 HydrophobicContact CZ2-CG 3.73Å; W275-P831 HydrophobicContact CZ3-CB 4.02Å; W275-P831 HydrophobicContact CZ3-CG 3.79Å; W275-I833 HydrophobicContact CB-CG1 4.03Å
276	Y	64.3	Low	61.7	Low	29 Å²	29	65.8 Å²	65.8	11%	0.114	32%	0.318	C	S	.	.	S	Bend	trans	-72.7	-33.8	-172.6	-169.5	-95	0	0	0	113.9	F153 M226 V228 P273 Q274	F153-Y276 HydrophobicContact CE2-CE1 4.35Å; M226-Y276 HydrophobicContact CE-CE1 4.14Å; M226-Y276 HydrophobicContact CG-CD1 3.92Å; M226-Y276 HydrophobicContact CG-CE1 3.69Å; M226-Y276 HydrophobicContact SD-CD1 4.1Å; M226-Y276 HydrophobicContact SD-CE1 3.66Å; V228-Y276 HydrophobicContact CB-CE2 3.98Å; V228-Y276 HydrophobicContact CG1-CE2 4.44Å; V228-Y276 PolarHBondContact O-OH 3.04Å; V228-Y276 VanDerWaalsContact O-OH 3.11Å; P273-Y276 PolarHBondContact O-N 2.98Å; P273-Y276 VanDerWaalsContact O-N 3.08Å; Q274-Y276 VanDerWaalsContact C-N 3.28Å; Q274-Y276 PolarHBondContact O-N 3.04Å
277	F	72.5	Confident	63.8	Low	2 Å²	2	62.4 Å²	62.4	1%	0.009	30%	0.302	C	S	.	.	S	Bend	trans	-99.8	127.3	-168.5	-56.2	-92.5	0	0	0	112.2	F153 K156 C157 A160 C218 M226 F272 K279	F153-F277 HydrophobicContact CD1-CE1 4.29Å; F153-F277 AromaticContact CD2-CE1 3.88Å; F153-F277 HydrophobicContact CD2-CE1 3.88Å; F153-F277 AromaticContact CD2-CZ 3.93Å; F153-F277 HydrophobicContact CD2-CZ 3.93Å; F153-F277 HydrophobicContact CE1-CE1 4.03Å; F153-F277 AromaticContact CE2-CE1 3.6Å; F153-F277 HydrophobicContact CE2-CE1 3.6Å; F153-F277 AromaticContact CE2-CZ 3.97Å; F153-F277 HydrophobicContact CE2-CZ 3.97Å; F153-F277 HydrophobicContact CG-CE1 4.21Å; F153-F277 HydrophobicContact CG-CZ 4.42Å; F153-F277 AromaticContact CZ-CE1 3.68Å; F153-F277 HydrophobicContact CZ-CE1 3.68Å; F153-F277 HydrophobicContact CZ-CZ 4.49Å; K156-F277 HydrophobicContact CB-CD2 4.13Å; K156-F277 HydrophobicContact CB-CE1 4.42Å; K156-F277 HydrophobicContact CB-CE2 3.6Å; K156-F277 HydrophobicContact CB-CZ 3.77Å; K156-F277 HydrophobicContact CD-CE2 4.13Å; K156-F277 HydrophobicContact CD-CZ 4.45Å; C157-F277 HydrophobicContact CB-CD1 4.01Å; C157-F277 HydrophobicContact CB-CE1 4.23Å; A160-F277 HydrophobicContact CB-CB 3.64Å; C218-F277 HydrophobicContact CB-CD1 3.97Å; M226-F277 HydrophobicContact SD-CD1 4.35Å; F272-F277 HydrophobicContact CB-CE2 3.99Å; F272-F277 HydrophobicContact CB-CZ 4.19Å; F272-F277 HydrophobicContact CG-CZ 4.49Å; F277-K279 WeakPolarHBondContact O-CE 3.24Å; F277-K279 WeakPolarHBondContact O-CG 3.39Å
278	C	77.1	Confident	65.9	Low	14 Å²	14	59.1 Å²	59.1	10%	0.095	28%	0.28	C	S	.	.	S	Bend	trans	59.9	50.8	171.1	-51.6	0	0	0	0	115.3	A160 C220 G225	A160-C278 HydrophobicContact CB-CB 4.34Å; C220-C278 HydrophobicContact CB-CB 3.55Å; C220-C278 WeakPolarHBondContact CB-SG 3.25Å; C220-C278 WeakPolarHBondContact SG-CA 3.41Å; C220-C278 WeakPolarHBondContact SG-CB 3.27Å; C220-C278 CovalentContact SG-SG 2.04Å; C220-C278 PolarHBondContact SG-SG 2.94Å; G225-C278 CarbonylContact O-C 3.46Å; G225-C278 WeakPolarHBondContact O-CA 3.43Å
279	K	74.5	Confident	68.1	Low	28 Å²	28	55.4 Å²	55.4	12%	0.122	26%	0.258	C	S	.	.			trans	-137.7	-22.9	-168.6	-47.1	-130.9	176.5	-174.2	0	116	G225 L227 Q274 W275 F277 I833	G225-K279 PolarHBondContact O-N 2.88Å; L227-K279 HydrophobicContact CG-CB 4.48Å; Q274-K279 WeakPolarHBondContact O-CE 3.46Å; Q274-K279 PolarHBondContact O-NZ 2.87Å; W275-K279 VanDerWaalsContact O-CD 3.29Å; W275-K279 WeakPolarHBondContact O-CD 3.38Å; W275-K279 WeakPolarHBondContact O-CG 3.43Å; F277-K279 WeakPolarHBondContact O-CE 3.24Å; F277-K279 WeakPolarHBondContact O-CG 3.39Å; K279-I833 HydrophobicContact CD-CB 4.04Å; K279-I833 HydrophobicContact CD-CG1 3.75Å; K279-I833 HydrophobicContact CD-CG2 3.62Å
280	A	72	Confident	69.9	Low	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	141.9	159.1	0	0	0	0	0	107.5	T224 G225 L227 L295	T224-A280 CarbonylContact C-O 3.59Å; T224-A280 WeakPolarHBondContact CA-O 3.34Å; G225-A280 PolarHBondContact N-O 2.83Å; G225-A280 PolarHBondContact O-N 2.72Å; L227-A280 HydrophobicContact CD2-CB 4.03Å; A280-L295 HydrophobicContact CB-CD1 3.72Å; A280-L295 HydrophobicContact CB-CG 4.09Å
281	M	79.3	Confident	71	Confident	42 Å²	42	44.8 Å²	44.8	21%	0.207	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	134.3	165	-66.8	-179.2	60.6	0	0	108.8	V283 D293 L294 L295 L836	M281-V283 PolarHBondContact O-N 3.11Å; M281-D293 PolarHBondContact N-O 3.11Å; M281-L294 HydrophobicContact CB-CD2 4.25Å; M281-L294 CarbonylContact O-C 3.4Å; M281-L295 PolarHBondContact O-N 3.25Å; M281-L836 HydrophobicContact CE-CB 4.01Å; M281-L836 HydrophobicContact SD-CB 3.63Å; M281-L836 HydrophobicContact SD-CD1 3.99Å; M281-L836 HydrophobicContact SD-CG 4.33Å; M281-L836 PolarHBondContact SD-N 3.38Å
282	M	81.1	Confident	71.6	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.059	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	91.5	171.8	-63.8	-179.5	-59.9	0	0	108	S137 Q138 N223 T224 L295 R297	S137-M282 WeakPolarHBondContact OG-CE 3.28Å; S137-M282 PolarHBondContact OG-SD 2.9Å; Q138-M282 HydrophobicContact CB-SD 4.46Å; N223-M282 VanDerWaalsContact C-CE 3.48Å; N223-M282 HydrophobicContact CB-CE 4.43Å; N223-M282 WeakPolarHBondContact O-CB 3.26Å; N223-M282 PolarHBondContact O-N 2.88Å; T224-M282 WeakPolarHBondContact O-CE 3.36Å; M282-L295 CarbonylContact C-O 3.57Å; M282-L295 VanDerWaalsContact CA-O 3.23Å; M282-L295 WeakPolarHBondContact CA-O 3.31Å; M282-R297 HydrophobicContact CB-CB 3.91Å; M282-R297 HydrophobicContact CB-CG 3.98Å
283	V	81.7	Confident	72.2	Confident	12 Å²	12	37.2 Å²	37.2	7%	0.073	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	143.3	177.6	-66.6	0	0	0	0	110.2	M281 E287 C289 L294 L295 R297 C317	M281-V283 PolarHBondContact O-N 3.11Å; V283-E287 WeakPolarHBondContact CA-OE2 3.48Å; V283-E287 HydrophobicContact CB-CB 3.92Å; V283-E287 WeakPolarHBondContact CB-OE2 3.02Å; V283-C289 HydrophobicContact CG2-CB 4.16Å; V283-L294 HydrophobicContact CG1-CB 4.23Å; V283-L294 HydrophobicContact CG1-CD2 3.98Å; V283-L294 HydrophobicContact CG2-CB 4.48Å; V283-L295 WeakPolarHBondContact CG2-O 3.45Å; V283-L295 PolarHBondContact N-O 3.12Å; V283-R297 VanDerWaalsContact O-CB 3.3Å; V283-R297 WeakPolarHBondContact O-CB 3.29Å; V283-R297 PolarHBondContact O-N 2.97Å; V283-C317 VanDerWaalsContact CG2-SG 3.59Å
284	D	85	Confident	73	Confident	29 Å²	29	35.9 Å²	35.9	16%	0.155	17%	0.166	C	C	.	.			trans	-77.6	-179.4	-179.8	-157.8	4.1	0	0	0	111.3	E287 C317 Y333 Y334	D284-E287 PolarHBondContact N-OE2 2.84Å; D284-E287 PolarHBondContact O-N 3.01Å; D284-C317 WeakPolarHBondContact O-CB 3.23Å; D284-Y333 WeakPolarHBondContact OD2-CA 3.3Å; D284-Y333 WeakPolarHBondContact OD2-CB 2.92Å; D284-Y334 PolarHBondContact OD1-N 3.27Å; D284-Y334 VanDerWaalsContact OD1-N 3.17Å; D284-Y334 PolarHBondContact OD2-N 3.47Å; D284-Y334 VanDerWaalsContact OD2-N 3.08Å
285	L	84.3	Confident	74	Confident	10 Å²	10	30.7 Å²	30.7	5%	0.052	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	142.7	174.7	-60	-171.5	0	0	0	112.1	E287 A301 P325 C336	L285-E287 PolarHBondContact O-N 2.8Å; L285-A301 HydrophobicContact CD2-CB 3.49Å; L285-A301 VanDerWaalsContact CD2-CB 3.49Å; L285-P325 HydrophobicContact CD1-CB 3.52Å; L285-C336 VanDerWaalsContact CD1-SG 3.56Å
286	W	78.8	Confident	75.3	Confident	76 Å²	76	29.1 Å²	29.1	29%	0.288	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	-8.3	-177	-33.8	149.6	0	0	0	116	T316 C317 Q318 P325 E565	W286-T316 WeakPolarHBondContact O-CB 3.47Å; W286-T316 VanDerWaalsContact O-CG2 3.28Å; W286-T316 WeakPolarHBondContact O-CG2 3.44Å; W286-C317 VanDerWaalsContact CA-O 3.31Å; W286-C317 WeakPolarHBondContact CA-O 3.42Å; W286-C317 PolarHBondContact N-O 2.87Å; W286-Q318 HydrophobicContact CE3-CB 4.25Å; W286-Q318 HydrophobicContact CE3-CG 3.83Å; W286-Q318 HydrophobicContact CZ3-CB 4.07Å; W286-Q318 HydrophobicContact CZ3-CG 4.05Å; W286-P325 HydrophobicContact CH2-CB 4.23Å; W286-P325 HydrophobicContact CH2-CG 3.92Å; W286-P325 HydrophobicContact CZ2-CB 4.18Å; W286-P325 HydrophobicContact CZ2-CG 3.72Å; W286-E565 WeakPolarHBondContact CB-OE2 3.24Å; W286-E565 VanDerWaalsContact CD1-CD 3.41Å; W286-E565 HydrophobicContact CG-CB 4.39Å; W286-E565 HydrophobicContact CG-CG 4.1Å
287	E	75.7	Confident	76.3	Confident	101 Å²	101	29 Å²	29	47%	0.472	14%	0.138	S	C	.	.	S	Bend	trans	-66.2	158.8	169.7	-64.7	-164.2	129.6	0	0	112.4	V283 D284 L285 T316 C317	V283-E287 WeakPolarHBondContact CA-OE2 3.48Å; V283-E287 HydrophobicContact CB-CB 3.92Å; V283-E287 WeakPolarHBondContact CB-OE2 3.02Å; D284-E287 PolarHBondContact N-OE2 2.84Å; D284-E287 PolarHBondContact O-N 3.01Å; L285-E287 PolarHBondContact O-N 2.8Å; E287-T316 CarbonylContact O-C 3.6Å; E287-T316 WeakPolarHBondContact O-CA 3.43Å; E287-T316 WeakPolarHBondContact O-CB 3.32Å; E287-C317 PolarHBondContact O-N 3.45Å
288	Y	75.8	Confident	77.1	Confident	89 Å²	89	29 Å²	29	35%	0.349	14%	0.137	S	C	.	.	B	Isolated β-bridge	trans	-66.2	134.7	178.8	-71.5	-81.6	0	0	0	112.1	R314	Y288-R314 HydrophobicContact CE1-CB 4.18Å; Y288-R314 HydrophobicContact CE1-CG 4.07Å; Y288-R314 PolarHBondContact OH-NH1 2.97Å; Y288-R314 VanDerWaalsContact OH-NH1 3.07Å
289	C	78.4	Confident	77.4	Confident	11 Å²	11	31 Å²	31	7%	0.074	15%	0.145	C	C	.	.			trans	-132.7	163	-173.9	66.3	0	0	0	0	113.4	V283 L294 C303 F315 C317	V283-C289 HydrophobicContact CG2-CB 4.16Å; C289-L294 WeakPolarHBondContact CA-O 3.08Å; C289-L294 WeakPolarHBondContact CB-O 3.41Å; C289-C303 HydrophobicContact CB-CB 3.96Å; C289-C303 WeakPolarHBondContact CB-SG 3.28Å; C289-C303 PolarHBondContact O-SG 2.84Å; C289-C303 WeakPolarHBondContact SG-CA 3.34Å; C289-C303 WeakPolarHBondContact SG-CB 3.48Å; C289-C303 CovalentContact SG-SG 2.04Å; C289-C303 PolarHBondContact SG-SG 2.88Å; C289-F315 PolarHBondContact N-O 3.2Å; C289-F315 VanDerWaalsContact N-O 3.12Å; C289-F315 VanDerWaalsContact SG-C 3.5Å; C289-C317 WeakPolarHBondContact CB-SG 3.21Å; C289-C317 PolarHBondContact SG-N 2.81Å
290	N	71.6	Confident	78	Confident	39 Å²	39	30.9 Å²	30.9	21%	0.209	15%	0.146	C	C	.	.			trans	-150.4	-177.9	166.2	66.4	37.1	0	0	0	109.8	I292 D293 L294	N290-I292 WeakPolarHBondContact OD1-CA 3.27Å; N290-I292 PolarHBondContact OD1-N 3.11Å; N290-D293 PolarHBondContact ND2-OD1 2.95Å; N290-D293 PolarHBondContact OD1-N 2.6Å; N290-D293 PolarHBondContact OD1-OD1 3.33Å; N290-L294 PolarHBondContact N-O 3.26Å; N290-L294 PolarHBondContact OD1-N 2.78Å
291	N	65.2	Low	78.7	Confident	8 Å²	8	30.9 Å²	30.9	4%	0.043	15%	0.146	C	C	.	.	S	Bend	trans	-92.9	9.7	179	56.3	-16.8	0	0	0	114.1	Y182 D200 F203	Y182-N291 VanDerWaalsContact O-CB 3.3Å; Y182-N291 WeakPolarHBondContact O-CB 3.28Å; D200-N291 PolarHBondContact OD1-ND2 3.14Å; F203-N291 WeakPolarHBondContact CE1-O 3.35Å; F203-N291 WeakPolarHBondContact CZ-O 3.47Å
292	I	61.7	Low	78.9	Confident	47 Å²	47	29.9 Å²	29.9	24%	0.241	14%	0.139	C	C	.	.	S	Bend	trans	-120	-70.9	-171.1	-45.2	-176	0	0	0	111.6	F203 L227 N290	F203-I292 HydrophobicContact CD2-CG1 4.44Å; F203-I292 HydrophobicContact CE2-CB 4.46Å; F203-I292 HydrophobicContact CE2-CD1 4.39Å; F203-I292 HydrophobicContact CE2-CG1 3.8Å; F203-I292 HydrophobicContact CE2-CG2 4.45Å; F203-I292 HydrophobicContact CZ-CG1 4.37Å; L227-I292 WeakPolarHBondContact CD2-O 3.11Å; N290-I292 WeakPolarHBondContact OD1-CA 3.27Å; N290-I292 PolarHBondContact OD1-N 3.11Å
293	D	66.7	Low	79.1	Confident	10 Å²	10	29.6 Å²	29.6	5%	0.053	14%	0.139	C	C	.	.	S	Bend	trans	-120.2	-3.8	-171.6	57.5	-4.8	0	0	0	114.5	L227 M281 N290 K676 T834	L227-D293 HydrophobicContact CD2-CB 4.22Å; M281-D293 PolarHBondContact N-O 3.11Å; N290-D293 PolarHBondContact ND2-OD1 2.95Å; N290-D293 PolarHBondContact OD1-N 2.6Å; N290-D293 PolarHBondContact OD1-OD1 3.33Å; D293-K676 IonicContact OD1-NZ 3.7Å; D293-K676 IonicContact OD2-NZ 3.97Å; D293-K676 PolarHBondContact OD2-NZ 2.88Å; D293-T834 PolarHBondContact OD2-OG1 2.76Å
294	L	72	Confident	79.1	Confident	18 Å²	18	29 Å²	29	9%	0.094	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	77.3	177.2	-59	176.4	0	0	0	111.2	M281 V283 C289 N290 L836	M281-L294 HydrophobicContact CB-CD2 4.25Å; M281-L294 CarbonylContact O-C 3.4Å; V283-L294 HydrophobicContact CG1-CB 4.23Å; V283-L294 HydrophobicContact CG1-CD2 3.98Å; V283-L294 HydrophobicContact CG2-CB 4.48Å; C289-L294 WeakPolarHBondContact CA-O 3.08Å; C289-L294 WeakPolarHBondContact CB-O 3.41Å; N290-L294 PolarHBondContact N-O 3.26Å; N290-L294 PolarHBondContact OD1-N 2.78Å; L294-L836 HydrophobicContact CD2-CD1 4.18Å; L294-L836 HydrophobicContact CD2-CD2 4.25Å
295	L	77.4	Confident	78.7	Confident	23 Å²	23	29.1 Å²	29.1	12%	0.12	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	144.5	-173.3	-58.4	177.3	0	0	0	111.9	Y182 A280 M281 M282 V283 R297	Y182-L295 HydrophobicContact CD1-CD2 4.32Å; Y182-L295 HydrophobicContact CE1-CD1 4.41Å; A280-L295 HydrophobicContact CB-CD1 3.72Å; A280-L295 HydrophobicContact CB-CG 4.09Å; M281-L295 PolarHBondContact O-N 3.25Å; M282-L295 CarbonylContact C-O 3.57Å; M282-L295 VanDerWaalsContact CA-O 3.23Å; M282-L295 WeakPolarHBondContact CA-O 3.31Å; V283-L295 WeakPolarHBondContact CG2-O 3.45Å; V283-L295 PolarHBondContact N-O 3.12Å; L295-R297 PolarHBondContact O-N 3.15Å
296	C	85.6	Confident	77.8	Confident	11 Å²	11	29.7 Å²	29.7	7%	0.074	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	123.5	177.5	-54.3	0	0	0	0	112.4	R181 A301 C317	R181-C296 PolarHBondContact NH2-O 2.01Å; C296-A301 HydrophobicContact CB-CB 4.05Å; C296-C317 WeakPolarHBondContact CA-SG 3.19Å; C296-C317 HydrophobicContact CB-CB 3.79Å; C296-C317 WeakPolarHBondContact CB-SG 3.48Å; C296-C317 VanDerWaalsContact SG-CA 3.52Å; C296-C317 WeakPolarHBondContact SG-CB 3.33Å; C296-C317 CovalentContact SG-SG 2.03Å; C296-C317 PolarHBondContact SG-SG 3.18Å
297	R	87	Confident	76.7	Confident	28 Å²	28	30.4 Å²	30.4	11%	0.106	15%	0.148	C	C	.	.	S	Bend	trans	-60.9	-51.8	-179.4	-168.2	168.4	179.1	-163.9	-10.1	111.8	R181 N223 M282 V283 L295 L331 D332 Y333	R181-R297 PolarHBondContact NH2-O 2.85Å; N223-R297 PolarHBondContact ND2-NH1 2.04Å; N223-R297 VanDerWaalsContact OD1-CZ 3.23Å; N223-R297 PolarHBondContact OD1-NH1 3.38Å; N223-R297 PolarHBondContact OD1-NH2 2.97Å; M282-R297 HydrophobicContact CB-CB 3.91Å; M282-R297 HydrophobicContact CB-CG 3.98Å; V283-R297 VanDerWaalsContact O-CB 3.3Å; V283-R297 WeakPolarHBondContact O-CB 3.29Å; V283-R297 PolarHBondContact O-N 2.97Å; L295-R297 PolarHBondContact O-N 3.15Å; R297-L331 PolarHBondContact NH2-O 3.31Å; R297-D332 PolarHBondContact NH1-O 2.74Å; R297-Y333 HydrophobicContact CB-CD2 4.37Å; R297-Y333 HydrophobicContact CG-CD1 4.43Å; R297-Y333 HydrophobicContact CG-CD2 3.89Å; R297-Y333 HydrophobicContact CG-CE1 4.42Å; R297-Y333 HydrophobicContact CG-CE2 3.98Å; R297-Y333 HydrophobicContact CG-CG 4.16Å; R297-Y333 VanDerWaalsContact NE-CD1 3.34Å
298	S	87.4	Confident	75.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	-59.4	139.1	173.7	168.8	0	0	0	0	112.7	R181 N300 E335 C336	R181-S298 PolarHBondContact NH2-O 3.5Å; S298-N300 PolarHBondContact OG-N 2.71Å; S298-E335 VanDerWaalsContact CA-OE1 3.28Å; S298-E335 WeakPolarHBondContact CA-OE1 3.49Å; S298-E335 WeakPolarHBondContact CB-OE1 3.12Å; S298-E335 PolarHBondContact OG-OE1 2.89Å; S298-C336 WeakPolarHBondContact OG-CB 3.04Å; S298-C336 PolarHBondContact OG-N 3.3Å; S298-C336 PolarHBondContact OG-SG 3.12Å
299	K	83.5	Confident	74.1	Confident	57 Å²	57	28.6 Å²	28.6	25%	0.248	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-39.9	177.9	-176.5	-169	-175.7	177.5	0	112.4	N140 A301 R302 E335	N140-K299 HydrophobicContact CB-CB 3.9Å; N140-K299 HydrophobicContact CB-CD 4.05Å; N140-K299 HydrophobicContact CB-CG 4.22Å; K299-A301 VanDerWaalsContact C-N 3.29Å; K299-R302 PolarHBondContact O-NH1 2.99Å; K299-E335 PolarHBondContact N-OE1 2.04Å
300	N	87	Confident	72.6	Confident	26 Å²	26	31.1 Å²	31.1	14%	0.139	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	18.4	-175.1	-48.2	-39.8	0	0	0	111.9	S298 I320 Y323 C336	S298-N300 PolarHBondContact OG-N 2.71Å; N300-I320 WeakPolarHBondContact O-CD1 3.43Å; N300-I320 VanDerWaalsContact O-CG1 3.25Å; N300-I320 WeakPolarHBondContact O-CG1 3.37Å; N300-I320 PolarHBondContact O-N 2.9Å; N300-Y323 HydrophobicContact CB-CD1 3.77Å; N300-Y323 HydrophobicContact CB-CE1 3.96Å; N300-Y323 HydrophobicContact CB-CG 4.1Å; N300-Y323 WeakPolarHBondContact ND2-CE1 3.23Å; N300-C336 HydrophobicContact CB-CB 3.81Å; N300-C336 PolarHBondContact ND2-O 2.81Å
301	A	87.3	Confident	71.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	153	169.1	0	0	0	0	0	112.2	L285 C296 K299 Q318	L285-A301 HydrophobicContact CD2-CB 3.49Å; L285-A301 VanDerWaalsContact CD2-CB 3.49Å; C296-A301 HydrophobicContact CB-CB 4.05Å; K299-A301 VanDerWaalsContact C-N 3.29Å; A301-Q318 CarbonylContact C-O 3.43Å; A301-Q318 WeakPolarHBondContact CA-O 3.45Å
302	R	84.8	Confident	70.6	Confident	21 Å²	21	33.2 Å²	33.2	8%	0.079	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	161.8	174.1	-65.8	-63.7	178.3	-96.2	9.1	110.1	N177 K180 Y185 L192 K299 I304 C317 Q318 I320	N177-R302 PolarHBondContact O-NH2 3.38Å; K180-R302 WeakPolarHBondContact O-CD 3.48Å; K180-R302 PolarHBondContact O-NE 3.04Å; Y185-R302 HydrophobicContact CD2-CB 3.85Å; Y185-R302 HydrophobicContact CD2-CG 4.24Å; Y185-R302 HydrophobicContact CE2-CB 4.16Å; Y185-R302 HydrophobicContact CE2-CG 4.08Å; L192-R302 HydrophobicContact CD2-CB 4.33Å; L192-R302 HydrophobicContact CD2-CG 4.31Å; K299-R302 PolarHBondContact O-NH1 2.99Å; R302-I304 HydrophobicContact CB-CG1 4.19Å; R302-I304 PolarHBondContact O-N 2.83Å; R302-C317 CarbonylContact O-C 3.48Å; R302-C317 WeakPolarHBondContact O-CA 3.47Å; R302-Q318 PolarHBondContact N-O 3.47Å; R302-Q318 PolarHBondContact O-N 2.88Å; R302-I320 HydrophobicContact CG-CD1 3.89Å; R302-I320 HydrophobicContact CG-CG1 3.73Å
303	C	84	Confident	70.4	Confident	6 Å²	6	33 Å²	33	4%	0.041	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	97.6	179	-171.6	0	0	0	0	109	R184 Y185 C289 F315	R184-C303 WeakPolarHBondContact CA-O 3.35Å; R184-C303 HydrophobicContact CG-CB 4.42Å; Y185-C303 PolarHBondContact N-O 2.85Å; C289-C303 HydrophobicContact CB-CB 3.96Å; C289-C303 WeakPolarHBondContact CB-SG 3.28Å; C289-C303 PolarHBondContact O-SG 2.84Å; C289-C303 WeakPolarHBondContact SG-CA 3.34Å; C289-C303 WeakPolarHBondContact SG-CB 3.48Å; C289-C303 CovalentContact SG-SG 2.04Å; C289-C303 PolarHBondContact SG-SG 2.88Å; C303-F315 VanDerWaalsContact SG-CB 3.51Å
304	I	82.4	Confident	70.4	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.4	-168.5	-50	-170.4	0	0	0	110.7	Y185 Y187 L192 R302 T306 F315 T316 Q318	Y185-I304 CarbonylContact O-C 3.56Å; Y185-I304 WeakPolarHBondContact O-CA 3.28Å; Y187-I304 HydrophobicContact CD2-CD1 4.34Å; Y187-I304 HydrophobicContact CD2-CG2 3.67Å; Y187-I304 HydrophobicContact CE2-CD1 3.67Å; Y187-I304 HydrophobicContact CE2-CG2 4Å; L192-I304 HydrophobicContact CD1-CD1 3.91Å; L192-I304 HydrophobicContact CD2-CD1 4.04Å; L192-I304 HydrophobicContact CG-CD1 4.2Å; R302-I304 HydrophobicContact CB-CG1 4.19Å; R302-I304 PolarHBondContact O-N 2.83Å; I304-T306 PolarHBondContact O-N 2.7Å; I304-F315 WeakPolarHBondContact O-CA 3.05Å; I304-T316 PolarHBondContact N-O 3.12Å; I304-T316 PolarHBondContact O-N 3.4Å; I304-Q318 HydrophobicContact CB-CB 4.29Å; I304-Q318 HydrophobicContact CD1-CB 3.81Å; I304-Q318 HydrophobicContact CG1-CB 4.06Å
305	K	75.4	Confident	70.5	Confident	30 Å²	30	36.2 Å²	36.2	13%	0.13	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	120.1	170.4	-179.7	-171.4	175	-146.5	0	109.6	Y185 E186 F195 D307 I313 F315	Y185-K305 PolarHBondContact O-N 3.3Å; E186-K305 HydrophobicContact CB-CB 4.42Å; E186-K305 HydrophobicContact CB-CD 4.31Å; E186-K305 VanDerWaalsContact CD-CD 3.45Å; E186-K305 HydrophobicContact CG-CD 3.87Å; E186-K305 IonicContact OE1-NZ 3.75Å; E186-K305 PolarHBondContact OE1-NZ 2.75Å; E186-K305 WeakPolarHBondContact OE2-CD 3.33Å; E186-K305 WeakPolarHBondContact OE2-CE 3.32Å; E186-K305 IonicContact OE2-NZ 3.76Å; E186-K305 PolarHBondContact OE2-NZ 3.49Å; F195-K305 HydrophobicContact CE2-CD 4.36Å; K305-D307 WeakPolarHBondContact CE-OD1 3.45Å; K305-D307 IonicContact NZ-OD1 3.85Å; K305-D307 PolarHBondContact NZ-OD1 2.96Å; K305-I313 HydrophobicContact CG-CG2 4.38Å; K305-F315 HydrophobicContact CB-CD1 4.05Å; K305-F315 HydrophobicContact CB-CE1 3.72Å; K305-F315 HydrophobicContact CB-CZ 4.36Å
306	T	65.9	Low	70.6	Confident	23 Å²	23	35.9 Å²	35.9	14%	0.141	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.9	164.7	55.1	0	0	0	0	108.5	I304 N308 R314 T316 Q318	I304-T306 PolarHBondContact O-N 2.7Å; T306-N308 PolarHBondContact O-N 3.11Å; T306-N308 PolarHBondContact O-ND2 3.04Å; T306-N308 PolarHBondContact OG1-ND2 3.1Å; T306-R314 PolarHBondContact N-O 2.96Å; T306-R314 WeakPolarHBondContact OG1-CB 3.33Å; T306-R314 PolarHBondContact OG1-O 2.89Å; T306-T316 HydrophobicContact CG2-CG2 4.03Å; T306-T316 VanDerWaalsContact CG2-OG1 3.26Å; T306-T316 WeakPolarHBondContact CG2-OG1 3.3Å; T306-Q318 VanDerWaalsContact CG2-NE2 3.34Å
307	D	57.1	Low	70.6	Confident	91 Å²	91	35.3 Å²	35.3	49%	0.487	17%	0.171	S	C	.	.			trans	-67.7	133.5	171.1	-69.7	-49.2	0	0	0	110	K305 R597	K305-D307 WeakPolarHBondContact CE-OD1 3.45Å; K305-D307 IonicContact NZ-OD1 3.85Å; K305-D307 PolarHBondContact NZ-OD1 2.96Å; D307-R597 PolarHBondContact O-NH1 2.04Å
308	N	50.4	Low	70.5	Confident	23 Å²	23	35.7 Å²	35.7	12%	0.123	17%	0.174	C	C	.	.			trans	-131.4	130.2	179.1	-69.8	-69.2	0	0	0	106.8	T306 L310 D311 L312 R597	T306-N308 PolarHBondContact O-N 3.11Å; T306-N308 PolarHBondContact O-ND2 3.04Å; T306-N308 PolarHBondContact OG1-ND2 3.1Å; N308-L310 PolarHBondContact O-N 3.14Å; N308-D311 PolarHBondContact O-N 3.4Å; N308-L312 HydrophobicContact CB-CB 4.19Å; N308-L312 PolarHBondContact ND2-O 3.02Å; N308-R597 WeakPolarHBondContact OD1-CD 2.94Å; N308-R597 VanDerWaalsContact OD1-CZ 3.27Å; N308-R597 PolarHBondContact OD1-NE 2.71Å; N308-R597 PolarHBondContact OD1-NH1 2.72Å
309	E	44.6	Very low	70.6	Confident	129 Å²	129	36.1 Å²	36.1	60%	0.603	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	6	176.1	-60.9	-169	149.3	0	0	113.7	N596 Q598	E309-N596 PolarHBondContact OE2-ND2 2.89Å; E309-N596 PolarHBondContact OE2-OD1 3.43Å; E309-Q598 VanDerWaalsContact C-NE2 3.33Å; E309-Q598 PolarHBondContact O-NE2 2.98Å
310	L	47.1	Very low	70.8	Confident	63 Å²	63	35.6 Å²	35.6	33%	0.33	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	4.6	177.3	-68.8	103.7	0	0	0	114.7	N308 L312 R597 K801	N308-L310 PolarHBondContact O-N 3.14Å; L310-L312 HydrophobicContact CB-CD1 3.6Å; L310-L312 PolarHBondContact O-N 2.81Å; L310-R597 HydrophobicContact CD1-CB 4.15Å; L310-K801 PolarHBondContact O-NZ 2.89Å
311	D	48	Very low	70.6	Confident	67 Å²	67	37.3 Å²	37.3	36%	0.358	19%	0.189	S	C	.	.			trans	58	22.7	-162.9	-34.4	-44.2	0	0	0	113.7	N308 I313 R658 K801	N308-D311 PolarHBondContact O-N 3.4Å; D311-I313 PolarHBondContact O-N 3.17Å; D311-I313 VanDerWaalsContact O-N 3.15Å; D311-R658 IonicContact OD2-CZ 2.81Å; D311-R658 IonicContact OD2-NE 2.61Å; D311-R658 IonicContact OD2-NH2 2.7Å; D311-R658 PolarHBondContact OD2-NH2 2.82Å; D311-K801 IonicContact OD2-NZ 3.68Å; D311-K801 PolarHBondContact OD2-NZ 3.34Å
312	L	48.5	Very low	70.4	Confident	25 Å²	25	39.6 Å²	39.6	13%	0.131	21%	0.213	C	C	.	.			trans	-81.7	90.9	174.9	-94	76.8	0	0	0	109.7	N308 L310 R314 Q844	N308-L312 HydrophobicContact CB-CB 4.19Å; N308-L312 PolarHBondContact ND2-O 3.02Å; L310-L312 HydrophobicContact CB-CD1 3.6Å; L310-L312 PolarHBondContact O-N 2.81Å; L312-R314 PolarHBondContact O-N 2.86Å; L312-Q844 HydrophobicContact CD2-CB 4.09Å; L312-Q844 HydrophobicContact CD2-CG 4.05Å; L312-Q844 HydrophobicContact CG-CG 4.11Å
313	I	57.2	Low	70.6	Confident	41 Å²	41	41.8 Å²	41.8	21%	0.21	22%	0.222	C	C	.	.			trans	-62.8	121.6	165.6	-62.1	-163.2	0	0	0	108.5	F195 K305 D311 F315 E670 Q844	F195-I313 HydrophobicContact CZ-CD1 4.28Å; K305-I313 HydrophobicContact CG-CG2 4.38Å; D311-I313 PolarHBondContact O-N 3.17Å; D311-I313 VanDerWaalsContact O-N 3.15Å; I313-F315 HydrophobicContact CG2-CD2 4.19Å; I313-F315 HydrophobicContact CG2-CE2 3.5Å; I313-F315 HydrophobicContact CG2-CZ 3.92Å; I313-E670 WeakPolarHBondContact CD1-OE1 3.35Å; I313-E670 WeakPolarHBondContact CD1-OE2 3.48Å; I313-Q844 PolarHBondContact O-NE2 2.82Å
314	R	66.4	Low	70.8	Confident	73 Å²	73	42 Å²	42	28%	0.275	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	123.5	176.4	-73	176.2	172.7	-171.5	3.3	108	Y288 T306 L312 Q844	Y288-R314 HydrophobicContact CE1-CB 4.18Å; Y288-R314 HydrophobicContact CE1-CG 4.07Å; Y288-R314 PolarHBondContact OH-NH1 2.97Å; Y288-R314 VanDerWaalsContact OH-NH1 3.07Å; T306-R314 PolarHBondContact N-O 2.96Å; T306-R314 WeakPolarHBondContact OG1-CB 3.33Å; T306-R314 PolarHBondContact OG1-O 2.89Å; L312-R314 PolarHBondContact O-N 2.86Å; R314-Q844 VanDerWaalsContact NE-OE1 3.08Å
315	F	73.3	Confident	71.1	Confident	23 Å²	23	43.5 Å²	43.5	10%	0.101	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	130.4	173.5	-61.1	-91.2	0	0	0	109.7	R184 F195 C289 C303 I304 K305 I313	R184-F315 HydrophobicContact CB-CD1 3.95Å; R184-F315 HydrophobicContact CB-CE1 3.71Å; R184-F315 HydrophobicContact CB-CZ 4.34Å; R184-F315 HydrophobicContact CG-CD1 3.97Å; R184-F315 HydrophobicContact CG-CE1 4.1Å; R184-F315 HydrophobicContact CG-CG 4.35Å; F195-F315 HydrophobicContact CB-CE1 4.37Å; F195-F315 HydrophobicContact CD1-CE1 4.25Å; F195-F315 AromaticContact CD1-CZ 3.72Å; F195-F315 HydrophobicContact CD1-CZ 3.72Å; F195-F315 HydrophobicContact CD2-CE1 4.42Å; F195-F315 HydrophobicContact CD2-CZ 4.23Å; F195-F315 AromaticContact CE1-CZ 3.77Å; F195-F315 HydrophobicContact CE1-CZ 3.77Å; F195-F315 HydrophobicContact CE2-CZ 4.28Å; F195-F315 HydrophobicContact CG-CE1 4.11Å; F195-F315 AromaticContact CG-CZ 3.95Å; F195-F315 HydrophobicContact CG-CZ 3.95Å; F195-F315 HydrophobicContact CZ-CZ 4.05Å; C289-F315 PolarHBondContact N-O 3.2Å; C289-F315 VanDerWaalsContact N-O 3.12Å; C289-F315 VanDerWaalsContact SG-C 3.5Å; C303-F315 VanDerWaalsContact SG-CB 3.51Å; I304-F315 WeakPolarHBondContact O-CA 3.05Å; K305-F315 HydrophobicContact CB-CD1 4.05Å; K305-F315 HydrophobicContact CB-CE1 3.72Å; K305-F315 HydrophobicContact CB-CZ 4.36Å; I313-F315 HydrophobicContact CG2-CD2 4.19Å; I313-F315 HydrophobicContact CG2-CE2 3.5Å; I313-F315 HydrophobicContact CG2-CZ 3.92Å
316	T	79.1	Confident	71.7	Confident	16 Å²	16	42.3 Å²	42.3	10%	0.098	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.2	170.1	63.3	0	0	0	0	110.4	W286 E287 I304 T306 Q318	W286-T316 WeakPolarHBondContact O-CB 3.47Å; W286-T316 VanDerWaalsContact O-CG2 3.28Å; W286-T316 WeakPolarHBondContact O-CG2 3.44Å; E287-T316 CarbonylContact O-C 3.6Å; E287-T316 WeakPolarHBondContact O-CA 3.43Å; E287-T316 WeakPolarHBondContact O-CB 3.32Å; I304-T316 PolarHBondContact N-O 3.12Å; I304-T316 PolarHBondContact O-N 3.4Å; T306-T316 HydrophobicContact CG2-CG2 4.03Å; T306-T316 VanDerWaalsContact CG2-OG1 3.26Å; T306-T316 WeakPolarHBondContact CG2-OG1 3.3Å; T316-Q318 PolarHBondContact O-N 2.81Å; T316-Q318 PolarHBondContact OG1-NE2 3.35Å
317	C	85.6	Confident	72.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	126.1	173.6	-76.9	0	0	0	0	109.8	V283 D284 W286 E287 C289 C296 R302	V283-C317 VanDerWaalsContact CG2-SG 3.59Å; D284-C317 WeakPolarHBondContact O-CB 3.23Å; W286-C317 VanDerWaalsContact CA-O 3.31Å; W286-C317 WeakPolarHBondContact CA-O 3.42Å; W286-C317 PolarHBondContact N-O 2.87Å; E287-C317 PolarHBondContact O-N 3.45Å; C289-C317 WeakPolarHBondContact CB-SG 3.21Å; C289-C317 PolarHBondContact SG-N 2.81Å; C296-C317 WeakPolarHBondContact CA-SG 3.19Å; C296-C317 HydrophobicContact CB-CB 3.79Å; C296-C317 WeakPolarHBondContact CB-SG 3.48Å; C296-C317 VanDerWaalsContact SG-CA 3.52Å; C296-C317 WeakPolarHBondContact SG-CB 3.33Å; C296-C317 CovalentContact SG-SG 2.03Å; C296-C317 PolarHBondContact SG-SG 3.18Å; R302-C317 CarbonylContact O-C 3.48Å; R302-C317 WeakPolarHBondContact O-CA 3.47Å
318	Q	86.5	Confident	74	Confident	36 Å²	36	38.7 Å²	38.7	17%	0.168	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146.9	-179	-72.8	172.6	50.6	0	0	111.3	W286 A301 R302 I304 T306 T316	W286-Q318 HydrophobicContact CE3-CB 4.25Å; W286-Q318 HydrophobicContact CE3-CG 3.83Å; W286-Q318 HydrophobicContact CZ3-CB 4.07Å; W286-Q318 HydrophobicContact CZ3-CG 4.05Å; A301-Q318 CarbonylContact C-O 3.43Å; A301-Q318 WeakPolarHBondContact CA-O 3.45Å; R302-Q318 PolarHBondContact N-O 3.47Å; R302-Q318 PolarHBondContact O-N 2.88Å; I304-Q318 HydrophobicContact CB-CB 4.29Å; I304-Q318 HydrophobicContact CD1-CB 3.81Å; I304-Q318 HydrophobicContact CG1-CB 4.06Å; T306-Q318 VanDerWaalsContact CG2-NE2 3.34Å; T316-Q318 PolarHBondContact O-N 2.81Å; T316-Q318 PolarHBondContact OG1-NE2 3.35Å
319	C	89	Confident	75.4	Confident	9 Å²	9	41.4 Å²	41.4	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	143.1	173.7	-62.1	0	0	0	0	111.2	Y187 C336	Y187-C319 PolarHBondContact OH-O 2.98Å; C319-C336 WeakPolarHBondContact CA-SG 3.37Å; C319-C336 HydrophobicContact CB-CB 3.92Å; C319-C336 WeakPolarHBondContact CB-SG 3.41Å; C319-C336 WeakPolarHBondContact SG-CB 3.06Å; C319-C336 CovalentContact SG-SG 2.04Å; C319-C336 PolarHBondContact SG-SG 3.1Å
320	I	86.4	Confident	77.2	Confident	45 Å²	45	37.4 Å²	37.4	23%	0.231	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-64.7	147.6	169	-63.9	164.7	0	0	0	108.9	L192 N300 R302 Y323	L192-I320 HydrophobicContact CD2-CG1 4.39Å; N300-I320 WeakPolarHBondContact O-CD1 3.43Å; N300-I320 VanDerWaalsContact O-CG1 3.25Å; N300-I320 WeakPolarHBondContact O-CG1 3.37Å; N300-I320 PolarHBondContact O-N 2.9Å; R302-I320 HydrophobicContact CG-CD1 3.89Å; R302-I320 HydrophobicContact CG-CG1 3.73Å; I320-Y323 HydrophobicContact CB-CD2 4.23Å; I320-Y323 HydrophobicContact CG2-CD2 4.48Å; I320-Y323 WeakPolarHBondContact O-CB 3.5Å; I320-Y323 PolarHBondContact O-N 2.78Å; I320-Y323 VanDerWaalsContact O-N 3.08Å
321	P	83.9	Confident	78.9	Confident	63 Å²	63	35.5 Å²	35.5	41%	0.409	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	140.5	174	-33	38.9	0	0	0	113.7	Y187 L192 Y323	Y187-P321 HydrophobicContact CE1-CG 3.73Å; Y187-P321 WeakPolarHBondContact OH-CD 3.37Å; Y187-P321 WeakPolarHBondContact OH-CG 3.47Å; L192-P321 HydrophobicContact CD1-CG 3.92Å; P321-Y323 VanDerWaalsContact C-N 3.3Å
322	G	83.8	Confident	80.5	Confident	48 Å²	48	36.9 Å²	36.9	50%	0.495	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-14.1	-173	0	0	0	0	0	114.6	Q339	G322-Q339 WeakPolarHBondContact O-CB 3.48Å; G322-Q339 PolarHBondContact O-N 2.91Å
323	Y	89	Confident	82.2	Confident	67 Å²	67	35.9 Å²	35.9	26%	0.263	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	144.1	177.9	-63.7	-101.1	0	0	0	112.1	N300 I320 P321 C336 F337 L338	N300-Y323 HydrophobicContact CB-CD1 3.77Å; N300-Y323 HydrophobicContact CB-CE1 3.96Å; N300-Y323 HydrophobicContact CB-CG 4.1Å; N300-Y323 WeakPolarHBondContact ND2-CE1 3.23Å; I320-Y323 HydrophobicContact CB-CD2 4.23Å; I320-Y323 HydrophobicContact CG2-CD2 4.48Å; I320-Y323 WeakPolarHBondContact O-CB 3.5Å; I320-Y323 PolarHBondContact O-N 2.78Å; I320-Y323 VanDerWaalsContact O-N 3.08Å; P321-Y323 VanDerWaalsContact C-N 3.3Å; Y323-C336 WeakPolarHBondContact CD1-O 3.29Å; Y323-F337 CarbonylContact C-O 3.56Å; Y323-F337 WeakPolarHBondContact CA-O 3.34Å; Y323-F337 VanDerWaalsContact CD1-C 3.45Å; Y323-L338 HydrophobicContact CD1-CB 4.34Å; Y323-L338 HydrophobicContact CE1-CB 4.07Å; Y323-L338 HydrophobicContact CE1-CD1 4.44Å; Y323-L338 HydrophobicContact CE2-CD1 4.44Å
324	I	87	Confident	83.7	Confident	9 Å²	9	36.1 Å²	36.1	5%	0.046	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	146.6	173.9	58.8	171	0	0	0	112.2	V326 C336 F337 Q339 K356 Y358 L372	I324-V326 HydrophobicContact CG1-CG2 4.37Å; I324-C336 WeakPolarHBondContact O-CA 3.04Å; I324-F337 PolarHBondContact N-O 3.23Å; I324-F337 PolarHBondContact O-N 2.81Å; I324-Q339 HydrophobicContact CD1-CG 4.24Å; I324-Q339 HydrophobicContact CG1-CB 4.36Å; I324-Q339 HydrophobicContact CG2-CB 4.1Å; I324-Q339 HydrophobicContact CG2-CG 4.17Å; I324-Q339 VanDerWaalsContact CG2-OE1 3.22Å; I324-K356 HydrophobicContact CD1-CB 3.75Å; I324-K356 HydrophobicContact CD1-CD 4.19Å; I324-K356 HydrophobicContact CG2-CD 4.31Å; I324-Y358 HydrophobicContact CD1-CD1 4.32Å; I324-L372 HydrophobicContact CD1-CB 4.28Å; I324-L372 HydrophobicContact CD1-CD2 3.96Å
325	P	88.6	Confident	84.8	Confident	32 Å²	32	32.8 Å²	32.8	21%	0.208	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	132	175.1	32.5	-38.9	0	0	0	110.7	L285 W286 Y334	L285-P325 HydrophobicContact CD1-CB 3.52Å; W286-P325 HydrophobicContact CH2-CB 4.23Å; W286-P325 HydrophobicContact CH2-CG 3.92Å; W286-P325 HydrophobicContact CZ2-CB 4.18Å; W286-P325 HydrophobicContact CZ2-CG 3.72Å; P325-Y334 HydrophobicContact CB-CD1 4.13Å
326	V	87.3	Confident	85.7	Confident	6 Å²	6	31.7 Å²	31.7	4%	0.036	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	125.1	172.5	-172	0	0	0	0	109.4	I324 Q328 E335 F337 Y358	I324-V326 HydrophobicContact CG1-CG2 4.37Å; V326-Q328 PolarHBondContact O-N 2.91Å; V326-E335 PolarHBondContact N-O 3.16Å; V326-E335 PolarHBondContact O-N 2.75Å; V326-F337 HydrophobicContact CB-CD2 3.78Å; V326-F337 HydrophobicContact CB-CE2 4.16Å; V326-F337 HydrophobicContact CG2-CB 4.48Å; V326-F337 HydrophobicContact CG2-CD2 3.89Å; V326-Y358 HydrophobicContact CB-CE2 4.45Å; V326-Y358 HydrophobicContact CG1-CE1 3.97Å; V326-Y358 HydrophobicContact CG1-CE2 3.99Å; V326-Y358 HydrophobicContact CG2-CD1 3.77Å; V326-Y358 HydrophobicContact CG2-CD2 3.97Å; V326-Y358 HydrophobicContact CG2-CE1 3.87Å; V326-Y358 HydrophobicContact CG2-CE2 4.07Å; V326-Y358 HydrophobicContact CG2-CG 3.83Å
327	Y	86.1	Confident	86.2	Confident	36 Å²	36	31 Å²	31	14%	0.141	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.9	178.1	-158.4	-91.4	0	0	0	110.9	N103 D332 Y334 P457 P458	N103-Y327 PolarHBondContact ND2-O 3.3Å; Y327-D332 PolarHBondContact OH-OD1 3.12Å; Y327-Y334 HydrophobicContact CD2-CD1 4.1Å; Y327-Y334 AromaticContact CD2-CD2 3.91Å; Y327-Y334 HydrophobicContact CD2-CD2 3.91Å; Y327-Y334 AromaticContact CD2-CE1 4Å; Y327-Y334 HydrophobicContact CD2-CE1 4Å; Y327-Y334 AromaticContact CD2-CE2 3.81Å; Y327-Y334 HydrophobicContact CD2-CE2 3.81Å; Y327-Y334 HydrophobicContact CD2-CG 4.07Å; Y327-Y334 AromaticContact CD2-CZ 3.87Å; Y327-Y334 HydrophobicContact CE2-CD2 4.39Å; Y327-Y334 HydrophobicContact CE2-CE2 4.28Å; Y327-P457 HydrophobicContact CD1-CB 3.66Å; Y327-P457 HydrophobicContact CE1-CB 3.42Å; Y327-P457 VanDerWaalsContact CE1-CB 3.42Å; Y327-P458 HydrophobicContact CD2-CB 4.24Å; Y327-P458 HydrophobicContact CD2-CG 4.4Å; Y327-P458 HydrophobicContact CE2-CB 3.87Å
328	Q	85.9	Confident	86.2	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	108.4	176.1	-62.8	-55	-79.5	0	0	109.9	V326 H330 L331 D332 Y333 E335 F337	V326-Q328 PolarHBondContact O-N 2.91Å; Q328-H330 PolarHBondContact O-N 2.6Å; Q328-L331 HydrophobicContact CB-CB 4.11Å; Q328-L331 HydrophobicContact CB-CD1 4.41Å; Q328-L331 HydrophobicContact CB-CG 4.45Å; Q328-L331 PolarHBondContact O-N 3.31Å; Q328-L331 VanDerWaalsContact O-N 3.1Å; Q328-D332 PolarHBondContact O-N 3.1Å; Q328-Y333 PolarHBondContact N-O 2.98Å; Q328-E335 HydrophobicContact CG-CB 3.93Å; Q328-F337 HydrophobicContact CG-CE2 4.06Å; Q328-F337 HydrophobicContact CG-CZ 4.27Å
329	N	81	Confident	86.3	Confident	79 Å²	79	36 Å²	36	42%	0.422	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-30.7	-174.4	-62.2	-17.4	0	0	0	112	N103	N103-N329 PolarHBondContact ND2-N 3.27Å; N103-N329 PolarHBondContact ND2-ND2 2.99Å; N103-N329 WeakPolarHBondContact OD1-CB 3.47Å; N103-N329 PolarHBondContact OD1-N 3.43Å
330	H	82.1	Confident	86	Confident	46 Å²	46	36.9 Å²	36.9	21%	0.213	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-15	179.8	-57.3	143.1	0	0	0	114.1	G85 T99 L100 T102 Q328	G85-H330 VanDerWaalsContact CA-CD2 3.42Å; G85-H330 WeakPolarHBondContact CA-CD2 3.14Å; T99-H330 PolarHBondContact OG1-O 3.27Å; L100-H330 HydrophobicContact CB-CB 3.92Å; L100-H330 WeakPolarHBondContact O-CB 3.18Å; T102-H330 PolarHBondContact O-ND1 2.69Å; Q328-H330 PolarHBondContact O-N 2.6Å
331	L	82.1	Confident	85.5	Confident	22 Å²	22	42.3 Å²	42.3	12%	0.115	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-16.4	-175.5	-63	-179.7	0	0	0	114.3	T99 L101 Y135 R297 Q328 Y333	T99-L331 HydrophobicContact CG2-CD2 4.5Å; L101-L331 VanDerWaalsContact O-CD1 3.32Å; L101-L331 WeakPolarHBondContact O-CD1 3.37Å; Y135-L331 HydrophobicContact CE1-CD2 4.37Å; R297-L331 PolarHBondContact NH2-O 3.31Å; Q328-L331 HydrophobicContact CB-CB 4.11Å; Q328-L331 HydrophobicContact CB-CD1 4.41Å; Q328-L331 HydrophobicContact CB-CG 4.45Å; Q328-L331 PolarHBondContact O-N 3.31Å; Q328-L331 VanDerWaalsContact O-N 3.1Å; L331-Y333 HydrophobicContact CB-CD1 3.69Å; L331-Y333 HydrophobicContact CB-CE1 3.57Å; L331-Y333 HydrophobicContact CD1-CE1 3.75Å; L331-Y333 HydrophobicContact CG-CE1 4.27Å
332	D	81.5	Confident	84.7	Confident	96 Å²	96	42.7 Å²	42.7	51%	0.513	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	57.4	178.4	-135	30.8	0	0	0	112.3	R297 Y327 Q328	R297-D332 PolarHBondContact NH1-O 2.74Å; Y327-D332 PolarHBondContact OH-OD1 3.12Å; Q328-D332 PolarHBondContact O-N 3.1Å
333	Y	84.6	Confident	83.9	Confident	5 Å²	5	47.5 Å²	47.5	2%	0.02	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	172.9	166.5	71	-79.7	0	0	0	112.6	Y135 D284 R297 Q328 L331 E335	Y135-Y333 PolarHBondContact OH-OH 3.46Å; D284-Y333 WeakPolarHBondContact OD2-CA 3.3Å; D284-Y333 WeakPolarHBondContact OD2-CB 2.92Å; R297-Y333 HydrophobicContact CB-CD2 4.37Å; R297-Y333 HydrophobicContact CG-CD1 4.43Å; R297-Y333 HydrophobicContact CG-CD2 3.89Å; R297-Y333 HydrophobicContact CG-CE1 4.42Å; R297-Y333 HydrophobicContact CG-CE2 3.98Å; R297-Y333 HydrophobicContact CG-CG 4.16Å; R297-Y333 VanDerWaalsContact NE-CD1 3.34Å; Q328-Y333 PolarHBondContact N-O 2.98Å; L331-Y333 HydrophobicContact CB-CD1 3.69Å; L331-Y333 HydrophobicContact CB-CE1 3.57Å; L331-Y333 HydrophobicContact CD1-CE1 3.75Å; L331-Y333 HydrophobicContact CG-CE1 4.27Å; Y333-E335 HydrophobicContact CE2-CB 3.96Å; Y333-E335 HydrophobicContact CE2-CG 4.47Å; Y333-E335 VanDerWaalsContact CE2-OE2 3.28Å; Y333-E335 WeakPolarHBondContact CE2-OE2 3.21Å; Y333-E335 PolarHBondContact OH-OE2 2.88Å
334	Y	88.7	Confident	83	Confident	46 Å²	46	46.9 Å²	46.9	18%	0.18	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.8	170	-68.6	-88.4	0	0	0	112.8	D284 P325 Y327	D284-Y334 PolarHBondContact OD1-N 3.27Å; D284-Y334 VanDerWaalsContact OD1-N 3.17Å; D284-Y334 PolarHBondContact OD2-N 3.47Å; D284-Y334 VanDerWaalsContact OD2-N 3.08Å; P325-Y334 HydrophobicContact CB-CD1 4.13Å; Y327-Y334 HydrophobicContact CD2-CD1 4.1Å; Y327-Y334 AromaticContact CD2-CD2 3.91Å; Y327-Y334 HydrophobicContact CD2-CD2 3.91Å; Y327-Y334 AromaticContact CD2-CE1 4Å; Y327-Y334 HydrophobicContact CD2-CE1 4Å; Y327-Y334 AromaticContact CD2-CE2 3.81Å; Y327-Y334 HydrophobicContact CD2-CE2 3.81Å; Y327-Y334 HydrophobicContact CD2-CG 4.07Å; Y327-Y334 AromaticContact CD2-CZ 3.87Å; Y327-Y334 HydrophobicContact CE2-CD2 4.39Å; Y327-Y334 HydrophobicContact CE2-CE2 4.28Å
335	E	89.8	Confident	82.3	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	144.2	172.9	-173.8	62.2	-96.3	0	0	110.6	H114 S298 K299 V326 Q328 Y333 F337	H114-E335 WeakPolarHBondContact CE1-CG 3.41Å; H114-E335 IonicContact CE1-OE2 2.72Å; S298-E335 VanDerWaalsContact CA-OE1 3.28Å; S298-E335 WeakPolarHBondContact CA-OE1 3.49Å; S298-E335 WeakPolarHBondContact CB-OE1 3.12Å; S298-E335 PolarHBondContact OG-OE1 2.89Å; K299-E335 PolarHBondContact N-OE1 2.04Å; V326-E335 PolarHBondContact N-O 3.16Å; V326-E335 PolarHBondContact O-N 2.75Å; Q328-E335 HydrophobicContact CG-CB 3.93Å; Y333-E335 HydrophobicContact CE2-CB 3.96Å; Y333-E335 HydrophobicContact CE2-CG 4.47Å; Y333-E335 VanDerWaalsContact CE2-OE2 3.28Å; Y333-E335 WeakPolarHBondContact CE2-OE2 3.21Å; Y333-E335 PolarHBondContact OH-OE2 2.88Å; E335-F337 HydrophobicContact CB-CD2 4.39Å; E335-F337 HydrophobicContact CB-CE2 3.71Å; E335-F337 HydrophobicContact CB-CZ 4.2Å; E335-F337 HydrophobicContact CG-CE2 3.92Å; E335-F337 HydrophobicContact CG-CZ 4.02Å; E335-F337 WeakPolarHBondContact O-CD2 3.15Å
336	C	90.8	Very high	81.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	103.8	-176.6	-69.2	0	0	0	0	110	L285 S298 N300 C319 Y323 I324	L285-C336 VanDerWaalsContact CD1-SG 3.56Å; S298-C336 WeakPolarHBondContact OG-CB 3.04Å; S298-C336 PolarHBondContact OG-N 3.3Å; S298-C336 PolarHBondContact OG-SG 3.12Å; N300-C336 HydrophobicContact CB-CB 3.81Å; N300-C336 PolarHBondContact ND2-O 2.81Å; C319-C336 WeakPolarHBondContact CA-SG 3.37Å; C319-C336 HydrophobicContact CB-CB 3.92Å; C319-C336 WeakPolarHBondContact CB-SG 3.41Å; C319-C336 WeakPolarHBondContact SG-CB 3.06Å; C319-C336 CovalentContact SG-SG 2.04Å; C319-C336 PolarHBondContact SG-SG 3.1Å; Y323-C336 WeakPolarHBondContact CD1-O 3.29Å; I324-C336 WeakPolarHBondContact O-CA 3.04Å
337	F	89.5	Confident	81.2	Confident	3 Å²	3	50.5 Å²	50.5	1%	0.013	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	153.9	177.9	-68.1	-86.4	0	0	0	112.2	H114 Y323 I324 V326 Q328 E335 Q339 Y358 M360	H114-F337 AromaticContact CD2-CE1 3.91Å; H114-F337 AromaticContact CG-CE1 4Å; Y323-F337 CarbonylContact C-O 3.56Å; Y323-F337 WeakPolarHBondContact CA-O 3.34Å; Y323-F337 VanDerWaalsContact CD1-C 3.45Å; I324-F337 PolarHBondContact N-O 3.23Å; I324-F337 PolarHBondContact O-N 2.81Å; V326-F337 HydrophobicContact CB-CD2 3.78Å; V326-F337 HydrophobicContact CB-CE2 4.16Å; V326-F337 HydrophobicContact CG2-CB 4.48Å; V326-F337 HydrophobicContact CG2-CD2 3.89Å; Q328-F337 HydrophobicContact CG-CE2 4.06Å; Q328-F337 HydrophobicContact CG-CZ 4.27Å; E335-F337 HydrophobicContact CB-CD2 4.39Å; E335-F337 HydrophobicContact CB-CE2 3.71Å; E335-F337 HydrophobicContact CB-CZ 4.2Å; E335-F337 HydrophobicContact CG-CE2 3.92Å; E335-F337 HydrophobicContact CG-CZ 4.02Å; E335-F337 WeakPolarHBondContact O-CD2 3.15Å; F337-Q339 PolarHBondContact O-N 3.42Å; F337-Y358 HydrophobicContact CB-CD2 3.83Å; F337-Y358 HydrophobicContact CB-CG 4.22Å; F337-Y358 HydrophobicContact CD2-CD2 4.29Å; F337-Y358 AromaticContact CG-CD2 3.97Å; F337-Y358 HydrophobicContact CG-CD2 3.97Å; F337-M360 HydrophobicContact CD1-CG 4.01Å; F337-M360 HydrophobicContact CE1-CB 4.49Å; F337-M360 HydrophobicContact CE1-CG 3.73Å; F337-M360 HydrophobicContact CE1-SD 4.14Å
338	L	87.6	Confident	80.8	Confident	53 Å²	53	52.3 Å²	52.3	28%	0.277	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	125.2	-179.6	-178.8	65.8	0	0	0	109.7	Y323 Y358 T359	Y323-L338 HydrophobicContact CD1-CB 4.34Å; Y323-L338 HydrophobicContact CE1-CB 4.07Å; Y323-L338 HydrophobicContact CE1-CD1 4.44Å; Y323-L338 HydrophobicContact CE2-CD1 4.44Å; L338-Y358 CarbonylContact O-C 3.47Å; L338-Y358 WeakPolarHBondContact O-CA 3.33Å; L338-T359 HydrophobicContact CB-CG2 4.42Å; L338-T359 HydrophobicContact CD2-CG2 4.44Å; L338-T359 PolarHBondContact N-O 2.92Å; L338-T359 PolarHBondContact O-N 2.92Å
339	Q	86.9	Confident	80.4	Confident	88 Å²	88	56 Å²	56	41%	0.411	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	134.1	174.4	-163.9	-169	-65.3	0	0	109.9	G322 I324 F337 C357	G322-Q339 WeakPolarHBondContact O-CB 3.48Å; G322-Q339 PolarHBondContact O-N 2.91Å; I324-Q339 HydrophobicContact CD1-CG 4.24Å; I324-Q339 HydrophobicContact CG1-CB 4.36Å; I324-Q339 HydrophobicContact CG2-CB 4.1Å; I324-Q339 HydrophobicContact CG2-CG 4.17Å; I324-Q339 VanDerWaalsContact CG2-OE1 3.22Å; F337-Q339 PolarHBondContact O-N 3.42Å; Q339-C357 WeakPolarHBondContact CG-O 3.47Å
340	L	83.9	Confident	80.5	Confident	27 Å²	27	52.5 Å²	52.5	14%	0.141	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-85.5	153.4	175	-69	176.2	0	0	0	112.2	C357 T359 A364 I369	L340-C357 HydrophobicContact CB-CB 4.11Å; L340-C357 HydrophobicContact CD1-CB 4.28Å; L340-C357 PolarHBondContact N-O 3.1Å; L340-T359 HydrophobicContact CD1-CG2 4.36Å; L340-T359 HydrophobicContact CD2-CG2 3.75Å; L340-T359 HydrophobicContact CG-CG2 4.04Å; L340-A364 HydrophobicContact CD2-CB 4.08Å; L340-I369 HydrophobicContact CD1-CD1 3.96Å; L340-I369 HydrophobicContact CD1-CG1 4.03Å; L340-I369 HydrophobicContact CD1-CG2 4Å
341	E	74.5	Confident	80.4	Confident	159 Å²	159	53 Å²	53	74%	0.743	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-74.1	157.2	172.6	-67	-168.4	173.4	0	0	112.5	N343	E341-N343 PolarHBondContact O-N 2.61Å
342	A	68.1	Low	80.2	Confident	71 Å²	71	59.9 Å²	59.9	59%	0.587	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-7	-170.6	0	0	0	0	0	115.8	I351	A342-I351 HydrophobicContact CB-CD1 4.18Å; A342-I351 VanDerWaalsContact O-CD1 3.24Å; A342-I351 WeakPolarHBondContact O-CD1 3.4Å
343	N	66.1	Low	79.8	Confident	149 Å²	149	57.2 Å²	57.2	80%	0.797	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-0.8	-173.3	-66.3	-24.3	0	0	0	114.2	E341 S345	E341-N343 PolarHBondContact O-N 2.61Å; N343-S345 PolarHBondContact O-N 3.45Å
344	H	71.5	Confident	79.3	Confident	54 Å²	54	63.4 Å²	63.4	25%	0.25	35%	0.354	C	S	.	.			trans	-72.2	126	-177.9	-158.8	-82.4	0	0	0	111.5	S346 C347 I369	H344-S346 PolarHBondContact CE1-OG 2.85Å; H344-S346 VanDerWaalsContact CE1-OG 3.24Å; H344-S346 PolarHBondContact ND1-OG 2.94Å; H344-S346 PolarHBondContact O-N 3.47Å; H344-C347 HydrophobicContact CB-CB 3.89Å; H344-C347 VanDerWaalsContact O-CB 3.31Å; H344-C347 WeakPolarHBondContact O-CB 3.28Å; H344-C347 PolarHBondContact O-N 2.62Å; H344-I369 VanDerWaalsContact CE1-CD1 3.44Å; H344-I369 WeakPolarHBondContact CE1-CD1 3.34Å
345	S	72.2	Confident	78.8	Confident	91 Å²	91	61.6 Å²	61.6	64%	0.636	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-55.8	-51.1	-173.5	46.1	0	0	0	0	113	N343 C347 S348	N343-S345 PolarHBondContact O-N 3.45Å; S345-C347 PolarHBondContact O-N 2.04Å; S345-C347 VanDerWaalsContact O-N 3.12Å; S345-S348 PolarHBondContact O-N 2.85Å; S345-S348 PolarHBondContact O-OG 3.39Å
346	S	73.1	Confident	78.6	Confident	30 Å²	30	66.4 Å²	66.4	21%	0.21	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-68.1	-8.3	179.9	-3.4	0	0	0	0	113.8	H344 E366	H344-S346 PolarHBondContact CE1-OG 2.85Å; H344-S346 VanDerWaalsContact CE1-OG 3.24Å; H344-S346 PolarHBondContact ND1-OG 2.94Å; H344-S346 PolarHBondContact O-N 3.47Å; S346-E366 VanDerWaalsContact CB-OE1 3.27Å; S346-E366 WeakPolarHBondContact CB-OE1 3.34Å; S346-E366 PolarHBondContact OG-OE1 3.04Å
347	C	79.8	Confident	78.5	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.014	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-97.1	-11.2	179.7	179.4	0	0	0	0	113.1	H344 S345 S349 C350 I351 C357	H344-C347 HydrophobicContact CB-CB 3.89Å; H344-C347 VanDerWaalsContact O-CB 3.31Å; H344-C347 WeakPolarHBondContact O-CB 3.28Å; H344-C347 PolarHBondContact O-N 2.62Å; S345-C347 PolarHBondContact O-N 2.04Å; S345-C347 VanDerWaalsContact O-N 3.12Å; C347-S349 VanDerWaalsContact C-N 3.29Å; C347-S349 PolarHBondContact O-N 2.92Å; C347-S349 VanDerWaalsContact O-N 3.15Å; C347-C350 WeakPolarHBondContact O-CB 3.49Å; C347-C350 PolarHBondContact O-N 3.2Å; C347-I351 HydrophobicContact CB-CD1 4.17Å; C347-I351 PolarHBondContact O-N 3.09Å; C347-I351 WeakPolarHBondContact SG-CD1 3.43Å; C347-I351 VanDerWaalsContact SG-CG1 3.52Å; C347-C357 VanDerWaalsContact CA-SG 3.5Å; C347-C357 HydrophobicContact CB-CB 3.98Å; C347-C357 WeakPolarHBondContact CB-SG 3.4Å; C347-C357 WeakPolarHBondContact SG-CB 3.45Å; C347-C357 CovalentContact SG-SG 2.01Å; C347-C357 PolarHBondContact SG-SG 3.14Å
348	S	77.3	Confident	78.4	Confident	73 Å²	73	66.7 Å²	66.7	51%	0.51	37%	0.372	S	S	.	.	H	α-helix	trans	-54.4	-41.5	-170.7	65.2	0	0	0	0	113.8	S345 C350 I351 H352	S345-S348 PolarHBondContact O-N 2.85Å; S345-S348 PolarHBondContact O-OG 3.39Å; S348-C350 VanDerWaalsContact C-N 3.32Å; S348-C350 PolarHBondContact O-N 3.41Å; S348-I351 PolarHBondContact O-N 3.23Å; S348-H352 WeakPolarHBondContact O-CB 3.47Å; S348-H352 PolarHBondContact O-N 3.48Å
349	S	77.4	Confident	78.3	Confident	79 Å²	79	64.3 Å²	64.3	55%	0.552	36%	0.359	S	S	*	.	H	α-helix	trans	-67.1	-30.6	-179.9	-53.5	0	0	0	0	113.2	C347	C347-S349 VanDerWaalsContact C-N 3.29Å; C347-S349 PolarHBondContact O-N 2.92Å; C347-S349 VanDerWaalsContact O-N 3.15Å
350	C	82.7	Confident	77.9	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-72	-50.4	175.9	-173.3	0	0	0	0	110.6	C347 S348 H352 S353 G355 C357 C371	C347-C350 WeakPolarHBondContact O-CB 3.49Å; C347-C350 PolarHBondContact O-N 3.2Å; S348-C350 VanDerWaalsContact C-N 3.32Å; S348-C350 PolarHBondContact O-N 3.41Å; C350-H352 VanDerWaalsContact C-N 3.32Å; C350-H352 PolarHBondContact O-N 3.08Å; C350-S353 CarbonylContact O-C 3.49Å; C350-S353 PolarHBondContact O-N 3.34Å; C350-S353 VanDerWaalsContact O-N 3.16Å; C350-G355 WeakPolarHBondContact O-CA 3.05Å; C350-G355 PolarHBondContact O-N 3.01Å; C350-G355 VanDerWaalsContact SG-C 3.56Å; C350-C357 WeakPolarHBondContact CB-SG 3.26Å; C350-C371 VanDerWaalsContact CA-SG 3.55Å; C350-C371 HydrophobicContact CB-CB 3.76Å; C350-C371 WeakPolarHBondContact CB-SG 3.28Å; C350-C371 WeakPolarHBondContact SG-CA 3.29Å; C350-C371 WeakPolarHBondContact SG-CB 3.32Å; C350-C371 CovalentContact SG-SG 2.03Å; C350-C371 PolarHBondContact SG-SG 3.35Å
351	I	80.2	Confident	77.4	Confident	56 Å²	56	59.5 Å²	59.5	29%	0.287	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-38.2	-179.4	-62.2	157.5	0	0	0	111.3	A342 C347 S348 S353 N354	A342-I351 HydrophobicContact CB-CD1 4.18Å; A342-I351 VanDerWaalsContact O-CD1 3.24Å; A342-I351 WeakPolarHBondContact O-CD1 3.4Å; C347-I351 HydrophobicContact CB-CD1 4.17Å; C347-I351 PolarHBondContact O-N 3.09Å; C347-I351 WeakPolarHBondContact SG-CD1 3.43Å; C347-I351 VanDerWaalsContact SG-CG1 3.52Å; S348-I351 PolarHBondContact O-N 3.23Å; I351-S353 PolarHBondContact O-N 3.41Å; I351-N354 WeakPolarHBondContact O-CA 3.47Å; I351-N354 PolarHBondContact O-N 3.31Å
352	H	78.5	Confident	77.1	Confident	168 Å²	168	59.7 Å²	59.7	78%	0.778	34%	0.337	S	S	*	.	H	α-helix	trans	-61.5	-27.3	178.9	-164.2	77.3	0	0	0	112.9	S348 C350	S348-H352 WeakPolarHBondContact O-CB 3.47Å; S348-H352 PolarHBondContact O-N 3.48Å; C350-H352 VanDerWaalsContact C-N 3.32Å; C350-H352 PolarHBondContact O-N 3.08Å
353	S	73.1	Confident	76.8	Confident	40 Å²	40	64.3 Å²	64.3	28%	0.28	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	21.4	172.3	-60.6	0	0	0	0	113.3	C350 I351 G355 L377	C350-S353 CarbonylContact O-C 3.49Å; C350-S353 PolarHBondContact O-N 3.34Å; C350-S353 VanDerWaalsContact O-N 3.16Å; I351-S353 PolarHBondContact O-N 3.41Å; S353-G355 PolarHBondContact O-N 3.21Å; S353-G355 VanDerWaalsContact O-N 3.16Å; S353-L377 WeakPolarHBondContact O-CD1 3.21Å
354	N	74.8	Confident	76.5	Confident	135 Å²	135	58.1 Å²	58.1	72%	0.722	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	17.8	-174.7	-67.1	-8.3	0	0	0	115.4	I351 P374	I351-N354 WeakPolarHBondContact O-CA 3.47Å; I351-N354 PolarHBondContact O-N 3.31Å; N354-P374 HydrophobicContact CB-CG 4.25Å
355	G	77.5	Confident	76.1	Confident	7 Å²	7	58.2 Å²	58.2	7%	0.072	32%	0.318	C	S	.	.			trans	-74.8	161.3	173.1	0	0	0	0	0	113	C350 S353 L372	C350-G355 WeakPolarHBondContact O-CA 3.05Å; C350-G355 PolarHBondContact O-N 3.01Å; C350-G355 VanDerWaalsContact SG-C 3.56Å; S353-G355 PolarHBondContact O-N 3.21Å; S353-G355 VanDerWaalsContact O-N 3.16Å; G355-L372 CarbonylContact C-O 3.54Å; G355-L372 WeakPolarHBondContact CA-O 3.19Å
356	K	85.1	Confident	75.7	Confident	103 Å²	103	58 Å²	58	45%	0.448	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.3	175.9	-59.5	179.5	-176.6	177.8	0	110.1	I324 L372	I324-K356 HydrophobicContact CD1-CB 3.75Å; I324-K356 HydrophobicContact CD1-CD 4.19Å; I324-K356 HydrophobicContact CG2-CD 4.31Å; K356-L372 HydrophobicContact CB-CB 4.43Å; K356-L372 PolarHBondContact N-O 3.37Å; K356-L372 WeakPolarHBondContact O-CB 3.45Å; K356-L372 PolarHBondContact O-N 2.94Å
357	C	88.2	Confident	75.2	Confident	4 Å²	4	57.4 Å²	57.4	3%	0.027	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	144.4	171.1	-61.9	0	0	0	0	111.7	Q339 L340 C347 C350 I369 G370	Q339-C357 WeakPolarHBondContact CG-O 3.47Å; L340-C357 HydrophobicContact CB-CB 4.11Å; L340-C357 HydrophobicContact CD1-CB 4.28Å; L340-C357 PolarHBondContact N-O 3.1Å; C347-C357 VanDerWaalsContact CA-SG 3.5Å; C347-C357 HydrophobicContact CB-CB 3.98Å; C347-C357 WeakPolarHBondContact CB-SG 3.4Å; C347-C357 WeakPolarHBondContact SG-CB 3.45Å; C347-C357 CovalentContact SG-SG 2.01Å; C347-C357 PolarHBondContact SG-SG 3.14Å; C350-C357 WeakPolarHBondContact CB-SG 3.26Å; C357-I369 HydrophobicContact CB-CG2 4.32Å; C357-G370 VanDerWaalsContact CA-O 3.27Å; C357-G370 WeakPolarHBondContact CA-O 3.36Å
358	Y	88.5	Confident	74.8	Confident	6 Å²	6	57.3 Å²	57.3	2%	0.024	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	161.8	171	58.7	-85.2	0	0	0	110.5	L104 I324 V326 F337 L338 I369 G370 L372	L104-Y358 HydrophobicContact CD1-CD2 3.93Å; L104-Y358 HydrophobicContact CD1-CE2 3.48Å; L104-Y358 VanDerWaalsContact CD1-CE2 3.48Å; L104-Y358 HydrophobicContact CD2-CE2 4.47Å; L104-Y358 HydrophobicContact CG-CE2 4.04Å; I324-Y358 HydrophobicContact CD1-CD1 4.32Å; V326-Y358 HydrophobicContact CB-CE2 4.45Å; V326-Y358 HydrophobicContact CG1-CE1 3.97Å; V326-Y358 HydrophobicContact CG1-CE2 3.99Å; V326-Y358 HydrophobicContact CG2-CD1 3.77Å; V326-Y358 HydrophobicContact CG2-CD2 3.97Å; V326-Y358 HydrophobicContact CG2-CE1 3.87Å; V326-Y358 HydrophobicContact CG2-CE2 4.07Å; V326-Y358 HydrophobicContact CG2-CG 3.83Å; F337-Y358 HydrophobicContact CB-CD2 3.83Å; F337-Y358 HydrophobicContact CB-CG 4.22Å; F337-Y358 HydrophobicContact CD2-CD2 4.29Å; F337-Y358 AromaticContact CG-CD2 3.97Å; F337-Y358 HydrophobicContact CG-CD2 3.97Å; L338-Y358 CarbonylContact O-C 3.47Å; L338-Y358 WeakPolarHBondContact O-CA 3.33Å; Y358-I369 WeakPolarHBondContact O-CA 3.47Å; Y358-G370 VanDerWaalsContact CE1-C 3.46Å; Y358-G370 PolarHBondContact N-O 3.31Å; Y358-G370 PolarHBondContact O-N 3.11Å; Y358-L372 HydrophobicContact CD1-CB 4.07Å; Y358-L372 HydrophobicContact CE1-CB 4.02Å
359	T	85	Confident	74.9	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.8	173.5	-173.4	0	0	0	0	112.6	L338 L340 N361 S368	L338-T359 HydrophobicContact CB-CG2 4.42Å; L338-T359 HydrophobicContact CD2-CG2 4.44Å; L338-T359 PolarHBondContact N-O 2.92Å; L338-T359 PolarHBondContact O-N 2.92Å; L340-T359 HydrophobicContact CD1-CG2 4.36Å; L340-T359 HydrophobicContact CD2-CG2 3.75Å; L340-T359 HydrophobicContact CG-CG2 4.04Å; T359-N361 WeakPolarHBondContact CG2-O 3.31Å; T359-N361 PolarHBondContact OG1-N 2.93Å; T359-N361 VanDerWaalsContact OG1-N 3.13Å; T359-N361 PolarHBondContact OG1-O 2.86Å; T359-S368 VanDerWaalsContact CA-O 3.27Å; T359-S368 WeakPolarHBondContact CA-O 3.04Å; T359-S368 WeakPolarHBondContact CB-O 3.33Å; T359-S368 PolarHBondContact OG1-O 3.09Å; T359-S368 PolarHBondContact OG1-OG 3.07Å
360	M	78.5	Confident	75.1	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.059	26%	0.258	C	S	.	.	S	Bend	trans	-82.6	-20.8	169.2	-50.8	-158.1	-66.2	0	0	112.7	T102 L104 H114 F337 S368	T102-M360 HydrophobicContact CG2-CE 4.16Å; T102-M360 HydrophobicContact CG2-SD 3.35Å; T102-M360 WeakPolarHBondContact CG2-SD 3.34Å; L104-M360 HydrophobicContact CB-CE 3.77Å; L104-M360 HydrophobicContact CB-CG 4.18Å; L104-M360 HydrophobicContact CB-SD 3.74Å; L104-M360 HydrophobicContact CD1-CG 3.61Å; L104-M360 HydrophobicContact CD1-SD 4.24Å; H114-M360 HydrophobicContact CB-CB 4.17Å; F337-M360 HydrophobicContact CD1-CG 4.01Å; F337-M360 HydrophobicContact CE1-CB 4.49Å; F337-M360 HydrophobicContact CE1-CG 3.73Å; F337-M360 HydrophobicContact CE1-SD 4.14Å; M360-S368 PolarHBondContact N-O 2.83Å
361	N	74.2	Confident	75.2	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	26%	0.258	C	S	.	.			trans	-119.2	125.8	-164.9	-68.1	-30.5	0	0	0	111	D111 I113 T359 Q363 A364 S368	D111-N361 WeakPolarHBondContact CA-ND2 3.06Å; D111-N361 PolarHBondContact O-ND2 2.95Å; D111-N361 VanDerWaalsContact O-ND2 3.13Å; D111-N361 PolarHBondContact O-OD1 3.29Å; D111-N361 VanDerWaalsContact O-OD1 3.07Å; I113-N361 HydrophobicContact CD1-CB 4.36Å; I113-N361 WeakPolarHBondContact CG1-OD1 2.93Å; T359-N361 WeakPolarHBondContact CG2-O 3.31Å; T359-N361 PolarHBondContact OG1-N 2.93Å; T359-N361 VanDerWaalsContact OG1-N 3.13Å; T359-N361 PolarHBondContact OG1-O 2.86Å; N361-Q363 PolarHBondContact O-N 2.81Å; N361-A364 PolarHBondContact O-N 2.74Å; N361-S368 WeakPolarHBondContact ND2-CB 3.4Å; N361-S368 PolarHBondContact ND2-OG 3.45Å
362	E	66.6	Low	75.3	Confident	163 Å²	163	51.2 Å²	51.2	76%	0.762	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.9	174.8	-62.2	-179.3	169.2	0	0	112.9
363	Q	62.6	Low	75.3	Confident	167 Å²	167	44.1 Å²	44.1	78%	0.78	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	4.6	177.4	-61.4	-178.1	-5.2	0	0	114.1	N361 I365	N361-Q363 PolarHBondContact O-N 2.81Å; Q363-I365 VanDerWaalsContact C-N 3.3Å; Q363-I365 HydrophobicContact CB-CG1 4.35Å; Q363-I365 PolarHBondContact O-N 2.7Å
364	A	60	Low	75.5	Confident	19 Å²	19	43.3 Å²	43.3	16%	0.157	22%	0.222	C	C	.	.			trans	50.9	38.6	173.6	0	0	0	0	0	115.7	L340 N361 E366	L340-A364 HydrophobicContact CD2-CB 4.08Å; N361-A364 PolarHBondContact O-N 2.74Å; A364-E366 PolarHBondContact O-N 2.95Å
365	I	63	Low	75.3	Confident	56 Å²	56	39.3 Å²	39.3	29%	0.287	20%	0.2	S	C	.	.			trans	-62.3	129.6	179.4	-53.1	175.4	0	0	0	109.7	D111 Q363 S367 S368	D111-I365 WeakPolarHBondContact OD1-CD1 3.21Å; Q363-I365 VanDerWaalsContact C-N 3.3Å; Q363-I365 HydrophobicContact CB-CG1 4.35Å; Q363-I365 PolarHBondContact O-N 2.7Å; I365-S367 WeakPolarHBondContact CG2-OG 3.39Å; I365-S367 PolarHBondContact O-N 2.83Å; I365-S367 VanDerWaalsContact O-N 3.08Å; I365-S368 WeakPolarHBondContact O-CA 3.33Å; I365-S368 PolarHBondContact O-N 2.95Å; I365-S368 PolarHBondContact O-OG 3.31Å
366	E	63.5	Low	74.8	Confident	88 Å²	88	39.8 Å²	39.8	41%	0.411	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-57.1	-30.6	-169	-58.3	-161.4	119.9	0	0	114.9	S346 A364 S368 M428	S346-E366 VanDerWaalsContact CB-OE1 3.27Å; S346-E366 WeakPolarHBondContact CB-OE1 3.34Å; S346-E366 PolarHBondContact OG-OE1 3.04Å; A364-E366 PolarHBondContact O-N 2.95Å; E366-S368 PolarHBondContact O-N 3.26Å; E366-M428 HydrophobicContact CB-CE 3.89Å
367	S	62.5	Low	74	Confident	16 Å²	16	36 Å²	36	11%	0.112	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-63.3	-21.9	175.2	52.3	0	0	0	0	113.6	I365	I365-S367 WeakPolarHBondContact CG2-OG 3.39Å; I365-S367 PolarHBondContact O-N 2.83Å; I365-S367 VanDerWaalsContact O-N 3.08Å
368	S	71.1	Confident	72.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-113.4	20.6	-171.8	70.3	0	0	0	0	113.4	T359 M360 N361 I365 E366	T359-S368 VanDerWaalsContact CA-O 3.27Å; T359-S368 WeakPolarHBondContact CA-O 3.04Å; T359-S368 WeakPolarHBondContact CB-O 3.33Å; T359-S368 PolarHBondContact OG1-O 3.09Å; T359-S368 PolarHBondContact OG1-OG 3.07Å; M360-S368 PolarHBondContact N-O 2.83Å; N361-S368 WeakPolarHBondContact ND2-CB 3.4Å; N361-S368 PolarHBondContact ND2-OG 3.45Å; I365-S368 WeakPolarHBondContact O-CA 3.33Å; I365-S368 PolarHBondContact O-N 2.95Å; I365-S368 PolarHBondContact O-OG 3.31Å; E366-S368 PolarHBondContact O-N 3.26Å
369	I	79	Confident	71.7	Confident	17 Å²	17	39 Å²	39	9%	0.087	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129	174.4	-58.2	-179.9	0	0	0	109.2	L340 H344 C357 Y358	L340-I369 HydrophobicContact CD1-CD1 3.96Å; L340-I369 HydrophobicContact CD1-CG1 4.03Å; L340-I369 HydrophobicContact CD1-CG2 4Å; H344-I369 VanDerWaalsContact CE1-CD1 3.44Å; H344-I369 WeakPolarHBondContact CE1-CD1 3.34Å; C357-I369 HydrophobicContact CB-CG2 4.32Å; Y358-I369 WeakPolarHBondContact O-CA 3.47Å
370	G	82.2	Confident	70.5	Confident	5 Å²	5	41 Å²	41	5%	0.052	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	164.4	173.3	0	0	0	0	0	112.7	C357 Y358	C357-G370 VanDerWaalsContact CA-O 3.27Å; C357-G370 WeakPolarHBondContact CA-O 3.36Å; Y358-G370 VanDerWaalsContact CE1-C 3.46Å; Y358-G370 PolarHBondContact N-O 3.31Å; Y358-G370 PolarHBondContact O-N 3.11Å
371	C	84.2	Confident	69.3	Low	7 Å²	7	44 Å²	44	5%	0.047	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	108.1	179.3	-179.3	0	0	0	0	111.3	C350 C373 E431 C433	C350-C371 VanDerWaalsContact CA-SG 3.55Å; C350-C371 HydrophobicContact CB-CB 3.76Å; C350-C371 WeakPolarHBondContact CB-SG 3.28Å; C350-C371 WeakPolarHBondContact SG-CA 3.29Å; C350-C371 WeakPolarHBondContact SG-CB 3.32Å; C350-C371 CovalentContact SG-SG 2.03Å; C350-C371 PolarHBondContact SG-SG 3.35Å; C371-C373 PolarHBondContact O-N 2.88Å; C371-E431 HydrophobicContact CB-CB 4.31Å; C371-E431 VanDerWaalsContact CB-O 3.23Å; C371-E431 WeakPolarHBondContact CB-O 3.41Å; C371-C433 PolarHBondContact SG-SG 3.15Å
372	L	83.7	Confident	67.8	Low	57 Å²	57	46.1 Å²	46.1	30%	0.298	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	100.4	172.2	-176.4	68.8	0	0	0	108.8	I324 G355 K356 Y358	I324-L372 HydrophobicContact CD1-CB 4.28Å; I324-L372 HydrophobicContact CD1-CD2 3.96Å; G355-L372 CarbonylContact C-O 3.54Å; G355-L372 WeakPolarHBondContact CA-O 3.19Å; K356-L372 HydrophobicContact CB-CB 4.43Å; K356-L372 PolarHBondContact N-O 3.37Å; K356-L372 WeakPolarHBondContact O-CB 3.45Å; K356-L372 PolarHBondContact O-N 2.94Å; Y358-L372 HydrophobicContact CD1-CB 4.07Å; Y358-L372 HydrophobicContact CE1-CB 4.02Å
373	C	78.2	Confident	66.2	Low	20 Å²	20	41.9 Å²	41.9	14%	0.135	23%	0.231	C	C	.	.			trans	-71.8	150.7	178	-64.8	0	0	0	0	112.6	C371 C433	C371-C373 PolarHBondContact O-N 2.88Å; C373-C433 WeakPolarHBondContact CA-SG 3.36Å; C373-C433 HydrophobicContact CB-CB 3.85Å; C373-C433 WeakPolarHBondContact CB-SG 3.3Å; C373-C433 WeakPolarHBondContact SG-CA 3.48Å; C373-C433 WeakPolarHBondContact SG-CB 3Å; C373-C433 CovalentContact SG-SG 2.04Å; C373-C433 PolarHBondContact SG-SG 3.05Å
374	P	76.4	Confident	64.7	Low	22 Å²	22	36.7 Å²	36.7	14%	0.143	21%	0.213	C	C	.	.			trans	-59	144.6	166.4	-21.1	34.3	0	0	0	110.7	N354 N376 L377	N354-P374 HydrophobicContact CB-CG 4.25Å; P374-N376 WeakPolarHBondContact CB-OD1 2.98Å; P374-N376 PolarHBondContact O-N 2.98Å; P374-L377 PolarHBondContact O-N 2.89Å
375	N	72.2	Confident	63.2	Low	52 Å²	52	41.9 Å²	41.9	28%	0.278	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-5.7	-176.3	-69.2	-57.6	0	0	0	113.8	L437 L568 F570 E590	N375-L437 WeakPolarHBondContact O-CD1 3.18Å; N375-L568 HydrophobicContact CB-CD2 3.72Å; N375-F570 HydrophobicContact CB-CE1 4.35Å; N375-F570 WeakPolarHBondContact O-CZ 3.03Å; N375-E590 WeakPolarHBondContact CB-OE1 3.34Å; N375-E590 PolarHBondContact N-OE2 2.85Å; N375-E590 PolarHBondContact ND2-OE1 3.01Å
376	N	66	Low	61.5	Low	17 Å²	17	47 Å²	47	9%	0.091	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.9	169	71	-81.9	0	0	0	113.4	P374 N436 L437 F570	P374-N376 WeakPolarHBondContact CB-OD1 2.98Å; P374-N376 PolarHBondContact O-N 2.98Å; N376-N436 PolarHBondContact ND2-OD1 2.89Å; N376-N436 CarbonylContact O-C 3.49Å; N376-N436 VanDerWaalsContact O-CA 3.24Å; N376-N436 WeakPolarHBondContact O-CA 3.23Å; N376-L437 PolarHBondContact O-N 3.25Å; N376-F570 HydrophobicContact CB-CD1 3.93Å; N376-F570 HydrophobicContact CB-CE1 3.78Å
377	L	68.1	Low	59.8	Low	24 Å²	24	48.3 Å²	48.3	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.2	178.2	-54.3	-176.2	0	0	0	110.8	S353 P374 C433 N436	S353-L377 WeakPolarHBondContact O-CD1 3.21Å; P374-L377 PolarHBondContact O-N 2.89Å; L377-C433 HydrophobicContact CB-CB 4.17Å; L377-C433 HydrophobicContact CD1-CB 3.68Å; L377-N436 VanDerWaalsContact CD2-OD1 3.31Å; L377-N436 WeakPolarHBondContact CD2-OD1 3.35Å
378	Q	65.6	Low	58	Low	50 Å²	50	57 Å²	57	23%	0.234	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	142.3	171.1	-153.4	-161.1	-85.1	0	0	110.4	G434 E435 L437	Q378-G434 WeakPolarHBondContact O-CA 3.38Å; Q378-G434 PolarHBondContact O-N 2.7Å; Q378-E435 PolarHBondContact N-O 2.77Å; Q378-L437 HydrophobicContact CB-CD2 4.09Å; Q378-L437 HydrophobicContact CB-CG 4.33Å; Q378-L437 HydrophobicContact CG-CD2 4.3Å
379	S	62.8	Low	56	Low	22 Å²	22	64.8 Å²	64.8	15%	0.154	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	142	165.7	72.2	0	0	0	0	110.7	Q456	S379-Q456 PolarHBondContact OG-NE2 3.22Å
380	I	58.8	Low	53.7	Low	43 Å²	43	69.7 Å²	69.7	22%	0.221	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.1	174.7	-63.3	-173.6	0	0	0	107.9	S382 A432 I508	I380-S382 PolarHBondContact O-N 2.84Å; I380-A432 PolarHBondContact N-O 3.23Å; I380-A432 PolarHBondContact O-N 3.45Å; I380-I508 HydrophobicContact CD1-CD1 4.19Å
381	I	54.8	Low	51	Low	76 Å²	76	78 Å²	78	39%	0.39	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	112.8	170.7	-58.4	174.4	0	0	0	107.5	E429 E431	I381-E429 HydrophobicContact CG2-CB 3.66Å; I381-E429 HydrophobicContact CG2-CG 3.73Å; I381-E431 HydrophobicContact CG1-CG 4.46Å
382	S	42.2	Very low	48.5	Very low	48 Å²	48	83.4 Å²	83.4	34%	0.336	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	109.5	179.4	64.3	0	0	0	0	110.6	I380 S384 E429 Y430	I380-S382 PolarHBondContact O-N 2.84Å; S382-S384 PolarHBondContact O-N 3.5Å; S382-E429 WeakPolarHBondContact O-CA 3.37Å; S382-Y430 PolarHBondContact N-O 3.36Å; S382-Y430 PolarHBondContact O-N 2.79Å; S382-Y430 PolarHBondContact OG-O 3.15Å
383	S	33.4	Very low	45.8	Very low	74 Å²	74	87.1 Å²	87.1	52%	0.517	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	103.4	174.3	42.5	0	0	0	0	109.8	T385	S383-T385 PolarHBondContact O-N 2.84Å; S383-T385 VanDerWaalsContact O-N 3.08Å
384	S	31.3	Very low	43.7	Very low	58 Å²	58	91.8 Å²	91.8	41%	0.406	50%	0.499	S	S	.	.			trans	-80	90.7	-171.1	60.1	0	0	0	0	113.3	S382 Q386 M428	S382-S384 PolarHBondContact O-N 3.5Å; S384-Q386 PolarHBondContact O-N 3.24Å; S384-M428 PolarHBondContact N-O 2.89Å; S384-M428 PolarHBondContact OG-O 3.06Å; S384-M428 VanDerWaalsContact OG-O 3.1Å
385	T	27.1	Very low	41.5	Very low	127 Å²	127	97.1 Å²	97.1	78%	0.779	53%	0.526	S	S	*	.			trans	-73	101.6	155.1	38.7	0	0	0	0	109	S383 T387	S383-T385 PolarHBondContact O-N 2.84Å; S383-T385 VanDerWaalsContact O-N 3.08Å; T385-T387 PolarHBondContact O-N 3.28Å; T385-T387 PolarHBondContact O-OG1 2.04Å
386	Q	27.4	Very low	39.7	Very low	164 Å²	164	102.2 Å²	102.2	77%	0.766	55%	0.554	S	S	*	*			trans	-57.4	112.3	179.2	-69.8	-176	-5.6	0	0	111.2	S384	S384-Q386 PolarHBondContact O-N 3.24Å
387	T	27.8	Very low	38.2	Very low	115 Å²	115	108.5 Å²	108.5	71%	0.706	59%	0.587	S	S	*	*			trans	-134.1	99.6	165.4	-24.7	0	0	0	0	108.6	T385 L389	T385-T387 PolarHBondContact O-N 3.28Å; T385-T387 PolarHBondContact O-OG1 2.04Å; T387-L389 PolarHBondContact O-N 2.86Å; T387-L389 VanDerWaalsContact O-N 3.15Å
388	Y	26.1	Very low	36.6	Very low	199 Å²	199	114.6 Å²	114.6	78%	0.78	62%	0.618	S	S	*	*			trans	-64.9	109.9	173.3	-74.9	-101.1	0	0	0	109.4
389	L	29.2	Very low	35	Very low	163 Å²	163	118 Å²	118	85%	0.853	65%	0.645	S	S	*	*			trans	-123.7	92	162.9	-75.4	179.2	0	0	0	110.1	T387	T387-L389 PolarHBondContact O-N 2.86Å; T387-L389 VanDerWaalsContact O-N 3.15Å
390	V	30.3	Very low	33.9	Very low	121 Å²	121	124.6 Å²	124.6	73%	0.733	68%	0.677	S	S	*	*			trans	-54.5	136.2	171.5	170.7	0	0	0	0	110.4	P392	V390-P392 WeakPolarHBondContact O-CD 3.48Å
391	Q	25.3	Very low	32.8	Very low	180 Å²	180	129.4 Å²	129.4	84%	0.841	70%	0.703	S	S	*	*			trans	-72.4	131	162.9	-69	-177.6	-6.5	0	0	110.4
392	P	31.3	Very low	32	Very low	120 Å²	120	130.5 Å²	130.5	78%	0.779	72%	0.718	S	S	*	*			trans	-109.6	130.8	143.1	33.7	-29	0	0	0	109.9	V390	V390-P392 WeakPolarHBondContact O-CD 3.48Å
393	N	27.8	Very low	31.8	Very low	135 Å²	135	133.8 Å²	133.8	72%	0.722	73%	0.731	S	S	*	*			trans	-88.2	167.2	179.6	-159.2	1.9	0	0	0	111.2
394	N	32.9	Very low	32	Very low	118 Å²	118	137.2 Å²	137.2	63%	0.631	74%	0.744	S	S	*	*			trans	76.5	119	164.5	-54.4	-34.6	0	0	0	119.6
395	N	30.6	Very low	32.2	Very low	133 Å²	133	138 Å²	138	71%	0.711	74%	0.743	S	S	*	*			trans	60.2	101.1	130.6	-51.2	-13.3	0	0	0	119.4
396	N	35.4	Very low	32.9	Very low	160 Å²	160	140.5 Å²	140.5	86%	0.856	75%	0.746	S	S	*	*				-174.2	162.3	89.8	-90.9	-44.9	0	0	0	113
397	N	33	Very low	33.5	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	74%	0.743	S	S	*	*			trans	-81.2	148.5	177.4	-52.3	-62	0	0	0	111.8
398	I	36.1	Very low	34	Very low	152 Å²	152	138 Å²	138	78%	0.779	73%	0.732	S	S	*	*			trans	164.3	124.2	131.1	-84.4	153.2	0	0	0	109.3
399	P	31.7	Very low	34.4	Very low	123 Å²	123	134.1 Å²	134.1	80%	0.799	72%	0.724	S	S	*	*			trans	-104.8	142	175	37	-30.1	0	0	0	113.1
400	I	38.5	Very low	34.8	Very low	159 Å²	159	132.7 Å²	132.7	82%	0.815	72%	0.717	S	S	*	*			trans	-143.7	146.7	167.3	-60.6	-175.1	0	0	0	109
401	D	37	Very low	35.2	Very low	145 Å²	145	135 Å²	135	78%	0.775	73%	0.726	S	S	*	*			trans	-93.2	160.1	-162.2	-54.9	-85.1	0	0	0	117.5
402	S	37.6	Very low	35.7	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	72%	0.716	S	S	*	*			trans	78.4	123.6	135.9	68.2	0	0	0	0	123.2
403	N	37.2	Very low	35.9	Very low	116 Å²	116	132.1 Å²	132.1	62%	0.62	73%	0.725	S	S	*	*				64.4	104.6	129	-57.2	9.1	0	0	0	120.9
404	N	38.4	Very low	36.7	Very low	146 Å²	146	134 Å²	134	78%	0.781	73%	0.729	S	S	*	*				172.8	137.9	97.4	-83.7	-34.3	0	0	0	111.1
405	D	35.1	Very low	37.1	Very low	74 Å²	74	136.1 Å²	136.1	40%	0.396	74%	0.735	S	S	.	*			trans	-101.5	142.9	173.2	-60.4	-43.2	0	0	0	111.1	L1117 F1118	D405-L1117 WeakPolarHBondContact OD2-CB 3.35Å; D405-L1117 WeakPolarHBondContact OD2-CD2 3.39Å; D405-F1118 HydrophobicContact CB-CE2 3.78Å; D405-F1118 HydrophobicContact CB-CZ 4.07Å; D405-F1118 WeakPolarHBondContact OD2-CD2 3.49Å; D405-F1118 WeakPolarHBondContact OD2-CE2 3.41Å; D405-F1118 WeakPolarHBondContact OD2-CZ 3.32Å
406	E	41.6	Very low	37.3	Very low	180 Å²	180	135.9 Å²	135.9	84%	0.841	73%	0.734	S	S	*	*			trans	-152.2	104.3	148.2	-135.3	172.4	-162.8	0	0	113
407	I	39.9	Very low	37.3	Very low	136 Å²	136	134.7 Å²	134.7	70%	0.697	73%	0.727	S	S	*	*			trans	52.8	90.5	141.4	-51.6	176.4	0	0	0	118.4
408	I	39.8	Very low	37.4	Very low	91 Å²	91	136.3 Å²	136.3	47%	0.467	72%	0.724	S	S	.	*				36	119.2	114.6	-55.5	166.9	0	0	0	117.8
409	N	34.7	Very low	37.2	Very low	117 Å²	117	137.9 Å²	137.9	63%	0.626	73%	0.725	S	S	*	*				-172.4	156	116.1	-110	-59.9	0	0	0	118.1
410	N	37.5	Very low	37.3	Very low	133 Å²	133	136.2 Å²	136.2	71%	0.711	72%	0.716	S	S	*	*			trans	82.8	138.4	161.1	-58.6	-39.8	0	0	0	121.1
411	N	38.3	Very low	36.9	Very low	169 Å²	169	135.6 Å²	135.6	90%	0.904	71%	0.711	S	S	*	*			trans	74.2	126.1	176.4	-46.9	-31.5	0	0	0	116.1
412	G	34.6	Very low	36.6	Very low	63 Å²	63	135 Å²	135	65%	0.649	71%	0.708	S	S	*	*			cis	178	131.6	-10.9	0	0	0	0	0	115.5	E414	G412-E414 PolarHBondContact O-N 2.83Å
413	N	36.7	Very low	36.2	Very low	178 Å²	178	135.2 Å²	135.2	95%	0.952	71%	0.709	S	S	*	*			trans	50.2	17.3	144.7	-67.2	2	0	0	0	124.7
414	E	43.2	Very low	35.9	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	72%	0.716	S	S	*	*			trans	-108.1	-20.4	177.8	-67.9	-163.9	141	0	0	117.8	G412 N416	G412-E414 PolarHBondContact O-N 2.83Å; E414-N416 PolarHBondContact O-N 2.88Å
415	Q	41.4	Very low	35.5	Very low	163 Å²	163	133.3 Å²	133.3	76%	0.762	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-80.5	-12.9	-165.5	-78.4	175.5	-39.5	0	0	117.4	N417	Q415-N417 PolarHBondContact O-N 3.22Å
416	N	36.3	Very low	35.2	Very low	129 Å²	129	134.1 Å²	134.1	69%	0.69	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-75.7	-21.4	-168.7	-78.9	-24.4	0	0	0	115.5	E414	E414-N416 PolarHBondContact O-N 2.88Å
417	N	34	Very low	34.8	Very low	134 Å²	134	131.5 Å²	131.5	72%	0.717	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-75.2	-23	-179.2	-79.8	-3.2	0	0	0	114	Q415 K419	Q415-N417 PolarHBondContact O-N 3.22Å; N417-K419 VanDerWaalsContact C-N 3.31Å; N417-K419 PolarHBondContact O-N 3.36Å
418	Y	34.8	Very low	34.7	Very low	183 Å²	183	127 Å²	127	72%	0.718	68%	0.677	S	S	*	*	H	α-helix	trans	-74.9	-19.9	-178.2	-78	-82.1	0	0	0	113.6
419	K	33.7	Very low	35.1	Very low	185 Å²	185	126.6 Å²	126.6	80%	0.804	67%	0.673	S	S	*	*	H	α-helix	trans	-86.7	-17.4	-172.3	-150	166.5	-172.1	171.5	0	114.4	N417	N417-K419 VanDerWaalsContact C-N 3.31Å; N417-K419 PolarHBondContact O-N 3.36Å
420	S	32.6	Very low	35.8	Very low	87 Å²	87	123.8 Å²	123.8	61%	0.608	65%	0.654	S	S	*	*	H	α-helix	trans	-93.8	-14.2	172.6	58.9	0	0	0	0	114	S423	S420-S423 PolarHBondContact O-OG 3.44Å; S420-S423 VanDerWaalsContact O-OG 3.08Å
421	M	30	Very low	37	Very low	146 Å²	146	120.7 Å²	120.7	72%	0.719	64%	0.635	S	S	*	*	H	α-helix	trans	-82	-20.4	174.7	-129.3	169.6	78.6	0	0	112.4	S423 Q424	M421-S423 PolarHBondContact O-N 2.97Å; M421-Q424 PolarHBondContact O-N 3.46Å
422	L	30.6	Very low	38.1	Very low	133 Å²	133	113.8 Å²	113.8	70%	0.696	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-73.1	-9.2	-177.5	-141.6	73.9	0	0	0	114.3	Q424	L422-Q424 VanDerWaalsContact C-N 3.29Å
423	S	29.9	Very low	39.9	Very low	104 Å²	104	111.4 Å²	111.4	73%	0.727	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-80.5	-4.6	174	51.4	0	0	0	0	114.3	S420 M421	S420-S423 PolarHBondContact O-OG 3.44Å; S420-S423 VanDerWaalsContact O-OG 3.08Å; M421-S423 PolarHBondContact O-N 2.97Å
424	Q	31.5	Very low	41.2	Very low	161 Å²	161	103.9 Å²	103.9	75%	0.752	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-120	9	173.3	-67.9	-178.3	-2.1	0	0	112.7	M421 L422 T426	M421-Q424 PolarHBondContact O-N 3.46Å; L422-Q424 VanDerWaalsContact C-N 3.29Å; Q424-T426 PolarHBondContact O-N 3.4Å; Q424-T426 VanDerWaalsContact O-N 3.08Å
425	A	28.4	Very low	42.1	Very low	61 Å²	61	99.1 Å²	99.1	50%	0.504	52%	0.517	S	S	.	.			trans	-69.2	105	171.2	0	0	0	0	0	109.6	I427	A425-I427 PolarHBondContact O-N 2.88Å
426	T	30.3	Very low	43.5	Very low	90 Å²	90	94.8 Å²	94.8	55%	0.552	50%	0.499	S	S	*	.			trans	-58.8	118.5	175.7	47.1	0	0	0	0	110.1	Q424 M428	Q424-T426 PolarHBondContact O-N 3.4Å; Q424-T426 VanDerWaalsContact O-N 3.08Å; T426-M428 PolarHBondContact O-N 3.16Å
427	I	31.4	Very low	45.5	Very low	126 Å²	126	89 Å²	89	65%	0.646	47%	0.468	S	S	*	.			trans	-72.4	85.3	172	-54.4	178.3	0	0	0	107.7	A425 E429	A425-I427 PolarHBondContact O-N 2.88Å; I427-E429 HydrophobicContact CG2-CG 4.24Å; I427-E429 PolarHBondContact O-N 3.16Å; I427-E429 VanDerWaalsContact O-N 3.12Å
428	M	39.6	Very low	47.8	Very low	41 Å²	41	82.7 Å²	82.7	20%	0.202	44%	0.435	C	S	.	.			trans	-71.6	101.4	172.3	-67.8	-77.2	-82	0	0	107.9	Q107 E366 S384 T426 Y430	Q107-M428 PolarHBondContact NE2-SD 3.46Å; Q107-M428 VanDerWaalsContact NE2-SD 3.37Å; E366-M428 HydrophobicContact CB-CE 3.89Å; S384-M428 PolarHBondContact N-O 2.89Å; S384-M428 PolarHBondContact OG-O 3.06Å; S384-M428 VanDerWaalsContact OG-O 3.1Å; T426-M428 PolarHBondContact O-N 3.16Å; M428-Y430 HydrophobicContact CB-CD2 4.4Å; M428-Y430 HydrophobicContact CB-CE2 3.77Å; M428-Y430 HydrophobicContact CE-CE1 4.36Å; M428-Y430 WeakPolarHBondContact CE-OH 3.33Å
429	E	46.6	Very low	50.1	Low	82 Å²	82	75.8 Å²	75.8	38%	0.383	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	108.4	173.7	-86.5	168.2	-165.8	0	0	108.8	K105 I381 S382 I427	K105-E429 IonicContact NZ-OE2 2.82Å; K105-E429 PolarHBondContact NZ-OE2 2.88Å; I381-E429 HydrophobicContact CG2-CB 3.66Å; I381-E429 HydrophobicContact CG2-CG 3.73Å; S382-E429 WeakPolarHBondContact O-CA 3.37Å; I427-E429 HydrophobicContact CG2-CG 4.24Å; I427-E429 PolarHBondContact O-N 3.16Å; I427-E429 VanDerWaalsContact O-N 3.12Å
430	Y	51.2	Low	52.5	Low	58 Å²	58	67 Å²	67	23%	0.227	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.3	176.5	-65.6	-79.8	0	0	0	109.9	S382 M428 A432	S382-Y430 PolarHBondContact N-O 3.36Å; S382-Y430 PolarHBondContact O-N 2.79Å; S382-Y430 PolarHBondContact OG-O 3.15Å; M428-Y430 HydrophobicContact CB-CD2 4.4Å; M428-Y430 HydrophobicContact CB-CE2 3.77Å; M428-Y430 HydrophobicContact CE-CE1 4.36Å; M428-Y430 WeakPolarHBondContact CE-OH 3.33Å; Y430-A432 PolarHBondContact O-N 2.03Å
431	E	60.8	Low	54.9	Low	69 Å²	69	64.6 Å²	64.6	32%	0.322	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	121.3	167.4	-69.9	-168.8	116.3	0	0	110	C371 I381	C371-E431 HydrophobicContact CB-CB 4.31Å; C371-E431 VanDerWaalsContact CB-O 3.23Å; C371-E431 WeakPolarHBondContact CB-O 3.41Å; I381-E431 HydrophobicContact CG1-CG 4.46Å
432	A	62.3	Low	57.4	Low	24 Å²	24	57.9 Å²	57.9	20%	0.198	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	149.5	172.6	0	0	0	0	0	109.5	I380 Y430 G434	I380-A432 PolarHBondContact N-O 3.23Å; I380-A432 PolarHBondContact O-N 3.45Å; Y430-A432 PolarHBondContact O-N 2.03Å; A432-G434 PolarHBondContact O-N 3.41Å
433	C	71.5	Confident	59.6	Low	13 Å²	13	54.9 Å²	54.9	9%	0.088	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	121.8	178	-49.6	0	0	0	0	110.5	C371 C373 L377	C371-C433 PolarHBondContact SG-SG 3.15Å; C373-C433 WeakPolarHBondContact CA-SG 3.36Å; C373-C433 HydrophobicContact CB-CB 3.85Å; C373-C433 WeakPolarHBondContact CB-SG 3.3Å; C373-C433 WeakPolarHBondContact SG-CA 3.48Å; C373-C433 WeakPolarHBondContact SG-CB 3Å; C373-C433 CovalentContact SG-SG 2.04Å; C373-C433 PolarHBondContact SG-SG 3.05Å; L377-C433 HydrophobicContact CB-CB 4.17Å; L377-C433 HydrophobicContact CD1-CB 3.68Å
434	G	64.8	Low	61.7	Low	20 Å²	20	56.3 Å²	56.3	21%	0.206	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-144.7	-178	0	0	0	0	0	113.9	Q378 A432	Q378-G434 WeakPolarHBondContact O-CA 3.38Å; Q378-G434 PolarHBondContact O-N 2.7Å; A432-G434 PolarHBondContact O-N 3.41Å
435	E	62.9	Low	63.8	Low	73 Å²	73	51.8 Å²	51.8	34%	0.341	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	163.1	-171.9	-63	-160	175.5	0	0	114.8	Q378 L437 N506 T507	Q378-E435 PolarHBondContact N-O 2.77Å; E435-L437 PolarHBondContact O-N 2.85Å; E435-N506 VanDerWaalsContact OE1-C 3.28Å; E435-T507 HydrophobicContact CB-CG2 4.5Å; E435-T507 PolarHBondContact OE1-N 2.9Å; E435-T507 WeakPolarHBondContact OE2-CG2 3.36Å
436	N	70.3	Confident	66.2	Low	72 Å²	72	51.4 Å²	51.4	39%	0.385	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	126.7	179.7	-74.8	-69.6	0	0	0	112.9	N376 L377	N376-N436 PolarHBondContact ND2-OD1 2.89Å; N376-N436 CarbonylContact O-C 3.49Å; N376-N436 VanDerWaalsContact O-CA 3.24Å; N376-N436 WeakPolarHBondContact O-CA 3.23Å; L377-N436 VanDerWaalsContact CD2-OD1 3.31Å; L377-N436 WeakPolarHBondContact CD2-OD1 3.35Å
437	L	77.6	Confident	68.9	Low	6 Å²	6	47.3 Å²	47.3	3%	0.031	23%	0.231	C	C	.	.	S	Bend	trans	-75	-24.4	172.9	-68.6	160.6	0	0	0	112.7	N375 N376 Q378 E435 L452 I454	N375-L437 WeakPolarHBondContact O-CD1 3.18Å; N376-L437 PolarHBondContact O-N 3.25Å; Q378-L437 HydrophobicContact CB-CD2 4.09Å; Q378-L437 HydrophobicContact CB-CG 4.33Å; Q378-L437 HydrophobicContact CG-CD2 4.3Å; E435-L437 PolarHBondContact O-N 2.85Å; L437-L452 HydrophobicContact CD2-CB 4.47Å; L437-L452 HydrophobicContact CD2-CD2 4.44Å; L437-L452 PolarHBondContact O-N 3.38Å; L437-I454 HydrophobicContact CD1-CD1 4.06Å; L437-I454 HydrophobicContact CD1-CG1 3.66Å; L437-I454 HydrophobicContact CD2-CG1 4.41Å
438	V	83	Confident	71.5	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123	173.5	-180	0	0	0	0	108.6	V440 C450 F451 L553 F570 V588	V438-V440 HydrophobicContact CG1-CG2 4.26Å; V438-C450 CarbonylContact C-O 3.57Å; V438-C450 WeakPolarHBondContact CA-O 3.41Å; V438-F451 HydrophobicContact CG2-CD2 3.84Å; V438-F451 HydrophobicContact CG2-CE2 4.43Å; V438-L553 HydrophobicContact CG1-CD2 3.75Å; V438-L553 HydrophobicContact CG2-CD2 3.93Å; V438-F570 HydrophobicContact CG2-CB 4.41Å; V438-F570 HydrophobicContact CG2-CD1 4.19Å; V438-F570 HydrophobicContact CG2-CD2 3.56Å; V438-F570 HydrophobicContact CG2-CE1 4.34Å; V438-F570 HydrophobicContact CG2-CE2 3.71Å; V438-F570 HydrophobicContact CG2-CG 3.79Å; V438-F570 HydrophobicContact CG2-CZ 4.1Å; V438-V588 HydrophobicContact CB-CG1 4.06Å; V438-V588 HydrophobicContact CB-CG2 4.31Å; V438-V588 HydrophobicContact CG1-CG1 4.09Å; V438-V588 HydrophobicContact CG1-CG2 3.96Å
439	H	82.4	Confident	73.8	Confident	38 Å²	38	40.2 Å²	40.2	18%	0.176	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.6	172.2	-158.6	-50.5	0	0	0	110.9	F441 C450 W503	H439-F441 AromaticContact CD2-CZ 3.86Å; H439-F441 AromaticContact CE1-CD1 3.56Å; H439-F441 AromaticContact CE1-CD2 3.83Å; H439-F441 AromaticContact CE1-CE1 3.12Å; H439-F441 WeakPolarHBondContact CE1-CE1 3.26Å; H439-F441 AromaticContact CE1-CE2 3.42Å; H439-F441 VanDerWaalsContact CE1-CE2 3.42Å; H439-F441 WeakPolarHBondContact CE1-CE2 3.05Å; H439-F441 AromaticContact CE1-CG 3.89Å; H439-F441 AromaticContact CE1-CZ 3.03Å; H439-F441 WeakPolarHBondContact CE1-CZ 3.23Å; H439-F441 AromaticContact CG-CE2 3.66Å; H439-F441 AromaticContact CG-CZ 3.89Å; H439-F441 AromaticContact ND1-CD1 3.98Å; H439-F441 AromaticContact ND1-CD2 3.43Å; H439-F441 WeakPolarHBondContact ND1-CD2 3.41Å; H439-F441 AromaticContact ND1-CE1 3.77Å; H439-F441 AromaticContact ND1-CE2 3.17Å; H439-F441 WeakPolarHBondContact ND1-CE2 3.48Å; H439-F441 AromaticContact ND1-CG 3.82Å; H439-F441 AromaticContact ND1-CZ 3.36Å; H439-F441 WeakPolarHBondContact ND1-CZ 3.03Å; H439-F441 AromaticContact NE2-CE1 3.67Å; H439-F441 AromaticContact NE2-CE2 3.93Å; H439-F441 AromaticContact NE2-CZ 3.33Å; H439-F441 VanDerWaalsContact NE2-CZ 3.33Å; H439-F441 WeakPolarHBondContact NE2-CZ 3.09Å; H439-C450 PolarHBondContact N-O 3.27Å; H439-C450 PolarHBondContact O-N 2.89Å; H439-W503 HydrophobicContact CB-CH2 4.26Å; H439-W503 HydrophobicContact CB-CZ2 4.24Å
440	V	84.9	Confident	75.7	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.8	171.6	-177.7	0	0	0	0	110	V438 L447 E448 I449 F572 C574 P585 G586 V588	V438-V440 HydrophobicContact CG1-CG2 4.26Å; V440-L447 HydrophobicContact CG1-CD1 3.91Å; V440-E448 CarbonylContact C-O 3.54Å; V440-E448 WeakPolarHBondContact CA-O 3.13Å; V440-I449 HydrophobicContact CB-CG1 4.49Å; V440-I449 HydrophobicContact CG1-CG1 4Å; V440-I449 HydrophobicContact CG2-CB 4.46Å; V440-I449 HydrophobicContact CG2-CG1 3.94Å; V440-I449 HydrophobicContact CG2-CG2 4.26Å; V440-F572 HydrophobicContact CG1-CD2 4.36Å; V440-F572 HydrophobicContact CG2-CB 3.75Å; V440-F572 HydrophobicContact CG2-CG 4.02Å; V440-C574 HydrophobicContact CG1-CB 4.02Å; V440-P585 WeakPolarHBondContact O-CA 3.44Å; V440-G586 PolarHBondContact O-N 3.4Å; V440-V588 HydrophobicContact CG2-CG2 3.91Å
441	F	83.8	Confident	77.4	Confident	37 Å²	37	33.9 Å²	33.9	16%	0.162	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.1	173.6	-68.9	-73.1	0	0	0	109.5	H439 E448 Q499 R583	H439-F441 AromaticContact CD2-CZ 3.86Å; H439-F441 AromaticContact CE1-CD1 3.56Å; H439-F441 AromaticContact CE1-CD2 3.83Å; H439-F441 AromaticContact CE1-CE1 3.12Å; H439-F441 WeakPolarHBondContact CE1-CE1 3.26Å; H439-F441 AromaticContact CE1-CE2 3.42Å; H439-F441 VanDerWaalsContact CE1-CE2 3.42Å; H439-F441 WeakPolarHBondContact CE1-CE2 3.05Å; H439-F441 AromaticContact CE1-CG 3.89Å; H439-F441 AromaticContact CE1-CZ 3.03Å; H439-F441 WeakPolarHBondContact CE1-CZ 3.23Å; H439-F441 AromaticContact CG-CE2 3.66Å; H439-F441 AromaticContact CG-CZ 3.89Å; H439-F441 AromaticContact ND1-CD1 3.98Å; H439-F441 AromaticContact ND1-CD2 3.43Å; H439-F441 WeakPolarHBondContact ND1-CD2 3.41Å; H439-F441 AromaticContact ND1-CE1 3.77Å; H439-F441 AromaticContact ND1-CE2 3.17Å; H439-F441 WeakPolarHBondContact ND1-CE2 3.48Å; H439-F441 AromaticContact ND1-CG 3.82Å; H439-F441 AromaticContact ND1-CZ 3.36Å; H439-F441 WeakPolarHBondContact ND1-CZ 3.03Å; H439-F441 AromaticContact NE2-CE1 3.67Å; H439-F441 AromaticContact NE2-CE2 3.93Å; H439-F441 AromaticContact NE2-CZ 3.33Å; H439-F441 VanDerWaalsContact NE2-CZ 3.33Å; H439-F441 WeakPolarHBondContact NE2-CZ 3.09Å; F441-E448 HydrophobicContact CB-CB 4.5Å; F441-E448 PolarHBondContact N-O 3.18Å; F441-E448 PolarHBondContact O-N 3.08Å; F441-Q499 VanDerWaalsContact CE2-CD 3.5Å; F441-Q499 HydrophobicContact CE2-CG 4.03Å; F441-Q499 HydrophobicContact CZ-CG 4.09Å; F441-R583 HydrophobicContact CD1-CB 4.44Å
442	C	81.4	Confident	78.5	Confident	4 Å²	4	31.2 Å²	31.2	3%	0.027	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148.9	169.4	56.7	0	0	0	0	112.9	L446 L447 Y549 C574 T576 I584	C442-L446 WeakPolarHBondContact CA-O 3.4Å; C442-L447 HydrophobicContact CB-CD1 4.16Å; C442-Y549 HydrophobicContact CB-CD2 3.86Å; C442-Y549 HydrophobicContact CB-CE2 4.08Å; C442-C574 HydrophobicContact CB-CB 3.77Å; C442-C574 WeakPolarHBondContact CB-SG 3.47Å; C442-C574 PolarHBondContact N-SG 3.19Å; C442-C574 WeakPolarHBondContact SG-CB 3.38Å; C442-C574 CovalentContact SG-SG 2.04Å; C442-C574 PolarHBondContact SG-SG 2.81Å; C442-T576 HydrophobicContact CB-CG2 3.83Å; C442-I584 PolarHBondContact N-O 2.85Å; C442-I584 PolarHBondContact O-N 3.39Å
443	Q	77.1	Confident	79.5	Confident	70 Å²	70	30.4 Å²	30.4	33%	0.327	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.8	168.9	-161.5	176.8	13.1	0	0	107.2	H445 L446 P581	Q443-H445 PolarHBondContact O-N 3.08Å; Q443-L446 HydrophobicContact CB-CB 4.45Å; Q443-L446 PolarHBondContact N-O 2.89Å; Q443-L446 PolarHBondContact O-N 3.34Å; Q443-L446 VanDerWaalsContact O-O 3.1Å; Q443-P581 PolarHBondContact NE2-O 2.96Å
444	R	73.6	Confident	79.8	Confident	135 Å²	135	30.4 Å²	30.4	51%	0.509	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	0.2	-168.7	-162.5	176.3	173	179	1.4	118.9	R528	R444-R528 PolarHBondContact O-NH2 3.4Å; R444-R528 VanDerWaalsContact O-NH2 3.16Å
445	H	75.5	Confident	79.9	Confident	66 Å²	66	34 Å²	34	31%	0.306	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-147.9	-2.3	170.8	61.7	-72.2	0	0	0	113.3	Q443 D526 W527 R528	Q443-H445 PolarHBondContact O-N 3.08Å; H445-D526 IonicContact CD2-OD1 2.74Å; H445-D526 IonicContact CD2-OD2 3.32Å; H445-D526 VanDerWaalsContact O-CA 3.3Å; H445-D526 WeakPolarHBondContact O-CA 3.47Å; H445-W527 PolarHBondContact O-N 3.32Å; H445-W527 VanDerWaalsContact O-N 3.15Å; H445-R528 HydrophobicContact CB-CG 3.88Å
446	L	80	Confident	80.2	Confident	53 Å²	53	34 Å²	34	28%	0.277	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	121	-162.2	-165.6	77.3	0	0	0	109.7	C442 Q443 T524 M525 D526	C442-L446 WeakPolarHBondContact CA-O 3.4Å; Q443-L446 HydrophobicContact CB-CB 4.45Å; Q443-L446 PolarHBondContact N-O 2.89Å; Q443-L446 PolarHBondContact O-N 3.34Å; Q443-L446 VanDerWaalsContact O-O 3.1Å; L446-T524 HydrophobicContact CD1-CG2 3.69Å; L446-T524 HydrophobicContact CD2-CG2 4.34Å; L446-T524 HydrophobicContact CG-CG2 4.03Å; L446-M525 WeakPolarHBondContact CA-O 3.27Å; L446-D526 HydrophobicContact CD1-CB 4.24Å
447	L	85.8	Confident	80	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.6	170.6	-178.5	66.6	0	0	0	108.1	V440 C442 I449 T524 M525 L538 Y549 F572 C574	V440-L447 HydrophobicContact CG1-CD1 3.91Å; C442-L447 HydrophobicContact CB-CD1 4.16Å; L447-I449 HydrophobicContact CD2-CD1 3.85Å; L447-I449 HydrophobicContact CG-CD1 4.02Å; L447-I449 HydrophobicContact CG-CG1 4.28Å; L447-T524 CarbonylContact O-C 3.6Å; L447-T524 WeakPolarHBondContact O-CA 3.23Å; L447-M525 PolarHBondContact N-O 3.1Å; L447-M525 PolarHBondContact O-N 3.25Å; L447-L538 HydrophobicContact CD2-CD1 3.64Å; L447-L538 HydrophobicContact CD2-CD2 4.23Å; L447-Y549 HydrophobicContact CB-CD1 4.38Å; L447-Y549 HydrophobicContact CD1-CG 4.14Å; L447-Y549 HydrophobicContact CD2-CD1 4.09Å; L447-Y549 HydrophobicContact CD2-CG 4.33Å; L447-F572 HydrophobicContact CD2-CE2 4.38Å; L447-C574 HydrophobicContact CD1-CB 4.49Å
448	E	86.3	Confident	79.8	Confident	17 Å²	17	34 Å²	34	8%	0.079	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.5	171.4	179.8	150.9	-114.8	0	0	110	V440 F441 K493 K523 T524	V440-E448 CarbonylContact C-O 3.54Å; V440-E448 WeakPolarHBondContact CA-O 3.13Å; F441-E448 HydrophobicContact CB-CB 4.5Å; F441-E448 PolarHBondContact N-O 3.18Å; F441-E448 PolarHBondContact O-N 3.08Å; E448-K493 IonicContact OE1-NZ 2.62Å; E448-K493 PolarHBondContact OE1-NZ 2.86Å; E448-K493 IonicContact OE2-NZ 3.63Å; E448-K493 PolarHBondContact OE2-NZ 2.58Å; E448-K523 WeakPolarHBondContact CA-O 3.42Å; E448-T524 HydrophobicContact CB-CG2 4.26Å; E448-T524 PolarHBondContact OE1-OG1 3.07Å
449	I	88	Confident	79.5	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.4	177.8	-65.2	149.7	0	0	0	107	V440 L447 I475 C522 K523 L553 F572	V440-I449 HydrophobicContact CB-CG1 4.49Å; V440-I449 HydrophobicContact CG1-CG1 4Å; V440-I449 HydrophobicContact CG2-CB 4.46Å; V440-I449 HydrophobicContact CG2-CG1 3.94Å; V440-I449 HydrophobicContact CG2-CG2 4.26Å; L447-I449 HydrophobicContact CD2-CD1 3.85Å; L447-I449 HydrophobicContact CG-CD1 4.02Å; L447-I449 HydrophobicContact CG-CG1 4.28Å; I449-I475 HydrophobicContact CB-CD1 4.32Å; I449-I475 HydrophobicContact CD1-CD1 3.5Å; I449-I475 VanDerWaalsContact CD1-CD1 3.5Å; I449-I475 HydrophobicContact CD1-CG1 3.97Å; I449-C522 CarbonylContact O-C 3.6Å; I449-C522 VanDerWaalsContact O-CA 3.29Å; I449-C522 WeakPolarHBondContact O-CA 3.38Å; I449-K523 PolarHBondContact N-O 3.11Å; I449-K523 PolarHBondContact O-N 3.25Å; I449-L553 HydrophobicContact CG2-CD2 4.12Å; I449-F572 HydrophobicContact CD1-CD1 4.48Å; I449-F572 HydrophobicContact CD1-CD2 4.39Å; I449-F572 HydrophobicContact CD1-CE1 3.76Å; I449-F572 HydrophobicContact CD1-CE2 3.68Å; I449-F572 HydrophobicContact CD1-CZ 3.32Å; I449-F572 HydrophobicContact CG1-CE1 4.41Å; I449-F572 HydrophobicContact CG1-CE2 4.4Å; I449-F572 HydrophobicContact CG1-CZ 4.27Å
450	C	87.4	Confident	79.1	Confident	8 Å²	8	36.3 Å²	36.3	5%	0.054	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.6	179.1	-66.5	0	0	0	0	110.9	V438 H439 W503 I520 W521 C522	V438-C450 CarbonylContact C-O 3.57Å; V438-C450 WeakPolarHBondContact CA-O 3.41Å; H439-C450 PolarHBondContact N-O 3.27Å; H439-C450 PolarHBondContact O-N 2.89Å; C450-W503 HydrophobicContact CB-CZ3 4.27Å; C450-I520 HydrophobicContact CB-CG2 3.94Å; C450-W521 CarbonylContact C-O 3.49Å; C450-W521 VanDerWaalsContact CA-O 3.26Å; C450-W521 WeakPolarHBondContact CA-O 3.29Å; C450-C522 HydrophobicContact CB-CB 4.15Å; C450-C522 WeakPolarHBondContact CB-SG 3.46Å; C450-C522 WeakPolarHBondContact SG-CB 3.44Å; C450-C522 CovalentContact SG-SG 2.05Å; C450-C522 PolarHBondContact SG-SG 2.89Å
451	F	87	Confident	78.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.3	178.9	176.2	-124.9	0	0	0	109.5	V438 P453 L462 L466 L490 W521 L553 I555 L568 F570	V438-F451 HydrophobicContact CG2-CD2 3.84Å; V438-F451 HydrophobicContact CG2-CE2 4.43Å; F451-P453 HydrophobicContact CD1-CG 4.36Å; F451-P453 HydrophobicContact CE1-CB 4.31Å; F451-P453 HydrophobicContact CE1-CG 4.25Å; F451-L462 HydrophobicContact CE1-CD2 4.14Å; F451-L462 HydrophobicContact CZ-CD2 4.06Å; F451-L466 HydrophobicContact CE1-CD1 4.25Å; F451-L490 HydrophobicContact CB-CD2 4.08Å; F451-W521 PolarHBondContact N-O 3.41Å; F451-W521 PolarHBondContact O-N 2.8Å; F451-L553 HydrophobicContact CB-CD2 4.25Å; F451-I555 HydrophobicContact CD1-CD1 3.7Å; F451-I555 HydrophobicContact CD1-CG1 4.42Å; F451-I555 HydrophobicContact CE1-CD1 3.76Å; F451-I555 HydrophobicContact CE1-CG1 4Å; F451-I555 HydrophobicContact CE1-CG2 4.12Å; F451-I555 HydrophobicContact CE2-CG1 4.45Å; F451-I555 HydrophobicContact CG-CD1 4.09Å; F451-I555 HydrophobicContact CZ-CD1 4.2Å; F451-I555 HydrophobicContact CZ-CG1 4.01Å; F451-L568 HydrophobicContact CZ-CD1 4.49Å; F451-F570 HydrophobicContact CE2-CE2 4.13Å
452	L	83.9	Confident	78.7	Confident	13 Å²	13	38.8 Å²	38.8	7%	0.068	19%	0.191	C	C	.	.			trans	-99.6	111.2	168.9	-173.7	66.2	0	0	0	107.8	L437 I454 W503 K518 I520	L437-L452 HydrophobicContact CD2-CB 4.47Å; L437-L452 HydrophobicContact CD2-CD2 4.44Å; L437-L452 PolarHBondContact O-N 3.38Å; L452-I454 PolarHBondContact O-N 3.22Å; L452-W503 HydrophobicContact CB-CH2 4Å; L452-W503 HydrophobicContact CB-CZ2 4.28Å; L452-K518 HydrophobicContact CD1-CB 3.86Å; L452-K518 HydrophobicContact CD1-CD 4Å; L452-K518 HydrophobicContact CD2-CD 4.38Å; L452-K518 HydrophobicContact CG-CD 4.4Å; L452-I520 HydrophobicContact CD1-CG1 4.25Å
453	P	81.5	Confident	78.7	Confident	7 Å²	7	40 Å²	40	5%	0.045	20%	0.202	C	C	.	.			trans	-57.1	133.6	179	-26.4	35.6	0	0	0	112	F451 L462 A463 L466 Y519	F451-P453 HydrophobicContact CD1-CG 4.36Å; F451-P453 HydrophobicContact CE1-CB 4.31Å; F451-P453 HydrophobicContact CE1-CG 4.25Å; P453-L462 HydrophobicContact CB-CD2 4.5Å; P453-L462 HydrophobicContact CB-CG 4.49Å; P453-A463 HydrophobicContact CB-CB 3.98Å; P453-A463 HydrophobicContact CG-CB 4.35Å; P453-L466 HydrophobicContact CB-CD1 4.42Å; P453-L466 HydrophobicContact CG-CD1 3.95Å; P453-Y519 WeakPolarHBondContact CD-O 3.5Å
454	I	78.8	Confident	78.9	Confident	13 Å²	13	42.1 Å²	42.1	7%	0.067	21%	0.212	C	C	.	.			trans	-61.3	138.3	171.9	-59	168	0	0	0	108.2	L437 L452 Q456 Y459 L568	L437-I454 HydrophobicContact CD1-CD1 4.06Å; L437-I454 HydrophobicContact CD1-CG1 3.66Å; L437-I454 HydrophobicContact CD2-CG1 4.41Å; L452-I454 PolarHBondContact O-N 3.22Å; I454-Q456 HydrophobicContact CG2-CB 4.26Å; I454-Y459 HydrophobicContact CB-CD2 4.22Å; I454-Y459 HydrophobicContact CB-CG 4.15Å; I454-Y459 HydrophobicContact CD1-CD2 3.85Å; I454-Y459 HydrophobicContact CD1-CE2 4.18Å; I454-Y459 HydrophobicContact CD1-CG 4.28Å; I454-Y459 HydrophobicContact CG2-CD2 3.98Å; I454-Y459 HydrophobicContact CG2-CG 4.26Å; I454-Y459 VanDerWaalsContact O-O 3.06Å; I454-L568 HydrophobicContact CD1-CD1 3.96Å
455	N	67.2	Low	79.3	Confident	96 Å²	96	37.5 Å²	37.5	51%	0.513	20%	0.198	S	C	.	.			trans	-125.3	29.6	-175.6	-157.6	98	0	0	0	111.3
456	Q	68.8	Low	79.8	Confident	73 Å²	73	34.6 Å²	34.6	34%	0.341	18%	0.184	S	C	.	.	S	Bend	trans	-123.9	153.9	175.1	-70.9	162.2	-60	0	0	107.7	S379 I454 Y459 Q460	S379-Q456 PolarHBondContact OG-NE2 3.22Å; I454-Q456 HydrophobicContact CG2-CB 4.26Å; Q456-Y459 CarbonylContact O-C 3.55Å; Q456-Y459 WeakPolarHBondContact O-CA 3.42Å; Q456-Y459 WeakPolarHBondContact O-CB 3.49Å; Q456-Y459 PolarHBondContact O-N 3.21Å; Q456-Q460 PolarHBondContact O-N 3.43Å
457	P	67.1	Low	79.8	Confident	42 Å²	42	36.9 Å²	36.9	27%	0.273	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	148	177.4	-24.1	35.6	0	0	0	113.6	Y327 Y459 Q460	Y327-P457 HydrophobicContact CD1-CB 3.66Å; Y327-P457 HydrophobicContact CE1-CB 3.42Å; Y327-P457 VanDerWaalsContact CE1-CB 3.42Å; P457-Y459 VanDerWaalsContact C-N 3.27Å; P457-Q460 VanDerWaalsContact CA-OE1 3.31Å
458	P	72.2	Confident	79.7	Confident	36 Å²	36	40.8 Å²	40.8	23%	0.234	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	cis	-80.8	6.7	-2	35.6	-38.7	0	0	0	114.3	Y327 Q460	Y327-P458 HydrophobicContact CD2-CB 4.24Å; Y327-P458 HydrophobicContact CD2-CG 4.4Å; Y327-P458 HydrophobicContact CE2-CB 3.87Å; P458-Q460 PolarHBondContact O-OE1 2.87Å; P458-Q460 VanDerWaalsContact O-OE1 3.07Å
459	Y	76.7	Confident	79.4	Confident	13 Å²	13	46.7 Å²	46.7	5%	0.051	24%	0.241	C	C	.	.	S	Bend	trans	-91.5	9.5	-173.8	-58.4	-71.8	0	0	0	114.3	I454 Q456 P457 N461 L462 T557 I566 L568	I454-Y459 HydrophobicContact CB-CD2 4.22Å; I454-Y459 HydrophobicContact CB-CG 4.15Å; I454-Y459 HydrophobicContact CD1-CD2 3.85Å; I454-Y459 HydrophobicContact CD1-CE2 4.18Å; I454-Y459 HydrophobicContact CD1-CG 4.28Å; I454-Y459 HydrophobicContact CG2-CD2 3.98Å; I454-Y459 HydrophobicContact CG2-CG 4.26Å; I454-Y459 VanDerWaalsContact O-O 3.06Å; Q456-Y459 CarbonylContact O-C 3.55Å; Q456-Y459 WeakPolarHBondContact O-CA 3.42Å; Q456-Y459 WeakPolarHBondContact O-CB 3.49Å; Q456-Y459 PolarHBondContact O-N 3.21Å; P457-Y459 VanDerWaalsContact C-N 3.27Å; Y459-N461 PolarHBondContact O-N 2.86Å; Y459-L462 HydrophobicContact CD1-CD2 4.06Å; Y459-L462 HydrophobicContact CG-CD2 4.49Å; Y459-L462 WeakPolarHBondContact O-CB 3.42Å; Y459-L462 PolarHBondContact O-N 2.78Å; Y459-T557 HydrophobicContact CD1-CG2 4.35Å; Y459-T557 HydrophobicContact CE1-CG2 3.98Å; Y459-I566 HydrophobicContact CE1-CG2 3.76Å; Y459-I566 VanDerWaalsContact CE1-O 3.31Å; Y459-I566 WeakPolarHBondContact CE1-O 3.49Å; Y459-I566 PolarHBondContact OH-O 2.84Å; Y459-L568 HydrophobicContact CE1-CD1 4.13Å; Y459-L568 HydrophobicContact CE1-CD2 4.36Å; Y459-L568 HydrophobicContact CE1-CG 4.16Å; Y459-L568 VanDerWaalsContact OH-CD2 3.31Å; Y459-L568 WeakPolarHBondContact OH-CD2 3.31Å
460	Q	73.8	Confident	78.9	Confident	74 Å²	74	53.6 Å²	53.6	35%	0.346	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.8	-172.5	71.2	-78.4	9.8	0	0	114.1	Q456 P457 P458	Q456-Q460 PolarHBondContact O-N 3.43Å; P457-Q460 VanDerWaalsContact CA-OE1 3.31Å; P458-Q460 PolarHBondContact O-OE1 2.87Å; P458-Q460 VanDerWaalsContact O-OE1 3.07Å
461	N	77.6	Confident	78.7	Confident	84 Å²	84	53.4 Å²	53.4	45%	0.449	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	3.2	178.4	-63.2	-19.2	0	0	0	113.5	Y459 A463 E464 N465	Y459-N461 PolarHBondContact O-N 2.86Å; N461-A463 PolarHBondContact O-N 3.02Å; N461-E464 PolarHBondContact O-N 3.09Å; N461-N465 WeakPolarHBondContact O-CB 3.4Å; N461-N465 PolarHBondContact O-N 3.33Å; N461-N465 PolarHBondContact O-ND2 2.03Å
462	L	83.2	Confident	78.6	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-39.8	-174.4	-179.9	62.6	0	0	0	112.3	F451 P453 Y459 N465 L466 I555 T557	F451-L462 HydrophobicContact CE1-CD2 4.14Å; F451-L462 HydrophobicContact CZ-CD2 4.06Å; P453-L462 HydrophobicContact CB-CD2 4.5Å; P453-L462 HydrophobicContact CB-CG 4.49Å; Y459-L462 HydrophobicContact CD1-CD2 4.06Å; Y459-L462 HydrophobicContact CG-CD2 4.49Å; Y459-L462 WeakPolarHBondContact O-CB 3.42Å; Y459-L462 PolarHBondContact O-N 2.78Å; L462-N465 PolarHBondContact O-N 3.43Å; L462-L466 HydrophobicContact CD1-CD1 4.23Å; L462-L466 HydrophobicContact CD1-CG 4.2Å; L462-L466 HydrophobicContact CG-CD1 4.06Å; L462-L466 HydrophobicContact CG-CG 4.48Å; L462-L466 WeakPolarHBondContact O-CB 3.09Å; L462-L466 VanDerWaalsContact O-CG 3.27Å; L462-L466 WeakPolarHBondContact O-CG 3.41Å; L462-L466 PolarHBondContact O-N 3.17Å; L462-I555 HydrophobicContact CD1-CG2 4.02Å; L462-I555 HydrophobicContact CD2-CG2 4.31Å; L462-T557 HydrophobicContact CD1-CG2 4.26Å
463	A	80.5	Confident	78.8	Confident	31 Å²	31	53.6 Å²	53.6	26%	0.256	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-43.7	176.6	0	0	0	0	0	112.1	P453 N461 Q467	P453-A463 HydrophobicContact CB-CB 3.98Å; P453-A463 HydrophobicContact CG-CB 4.35Å; N461-A463 PolarHBondContact O-N 3.02Å; A463-Q467 WeakPolarHBondContact O-CB 3.4Å; A463-Q467 PolarHBondContact O-N 2.89Å; A463-Q467 VanDerWaalsContact O-N 3.13Å
464	E	82.1	Confident	79.1	Confident	113 Å²	113	53.8 Å²	53.8	53%	0.528	27%	0.267	S	S	.	.	H	α-helix	trans	-69.5	-44.4	176.7	-173.8	179.1	173.7	0	0	111.3	N461 L466 Q467 L468	N461-E464 PolarHBondContact O-N 3.09Å; E464-L466 PolarHBondContact O-N 3.02Å; E464-Q467 CarbonylContact O-C 3.54Å; E464-Q467 PolarHBondContact O-N 2.67Å; E464-Q467 VanDerWaalsContact O-N 3.11Å; E464-L468 HydrophobicContact CG-CD1 3.81Å; E464-L468 HydrophobicContact CG-CG 4.13Å; E464-L468 WeakPolarHBondContact O-CB 3.32Å; E464-L468 WeakPolarHBondContact O-CG 3.45Å; E464-L468 PolarHBondContact O-N 2.84Å
465	N	82.7	Confident	79.4	Confident	39 Å²	39	53.3 Å²	53.3	21%	0.209	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-33.1	179.6	-74.6	-32.7	0	0	0	112.7	N461 L462 H469 R470 S471	N461-N465 WeakPolarHBondContact O-CB 3.4Å; N461-N465 PolarHBondContact O-N 3.33Å; N461-N465 PolarHBondContact O-ND2 2.03Å; L462-N465 PolarHBondContact O-N 3.43Å; N465-H469 PolarHBondContact O-N 3.38Å; N465-R470 HydrophobicContact CB-CB 4.03Å; N465-R470 PolarHBondContact O-N 3.34Å; N465-R470 VanDerWaalsContact OD1-CD 3.31Å; N465-R470 WeakPolarHBondContact OD1-CD 3.01Å; N465-S471 WeakPolarHBondContact CB-OG 3.48Å; N465-S471 PolarHBondContact O-N 3.26Å
466	L	84.5	Confident	80.1	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-47.1	167.8	-74.9	166.4	0	0	0	110.7	F451 P453 L462 E464 L468 H469 A473 W521	F451-L466 HydrophobicContact CE1-CD1 4.25Å; P453-L466 HydrophobicContact CB-CD1 4.42Å; P453-L466 HydrophobicContact CG-CD1 3.95Å; L462-L466 HydrophobicContact CD1-CD1 4.23Å; L462-L466 HydrophobicContact CD1-CG 4.2Å; L462-L466 HydrophobicContact CG-CD1 4.06Å; L462-L466 HydrophobicContact CG-CG 4.48Å; L462-L466 WeakPolarHBondContact O-CB 3.09Å; L462-L466 VanDerWaalsContact O-CG 3.27Å; L462-L466 WeakPolarHBondContact O-CG 3.41Å; L462-L466 PolarHBondContact O-N 3.17Å; E464-L466 PolarHBondContact O-N 3.02Å; L466-L468 PolarHBondContact O-N 3.13Å; L466-H469 PolarHBondContact O-N 3.31Å; L466-H469 VanDerWaalsContact O-N 3.11Å; L466-A473 HydrophobicContact CD2-CB 4.01Å; L466-W521 HydrophobicContact CB-CD2 4.41Å; L466-W521 HydrophobicContact CB-CH2 3.95Å; L466-W521 HydrophobicContact CB-CZ2 3.48Å; L466-W521 VanDerWaalsContact CB-CZ2 3.48Å; L466-W521 HydrophobicContact CD1-CD2 4.5Å; L466-W521 WeakPolarHBondContact O-CH2 3.36Å
467	Q	81.7	Confident	80.3	Confident	102 Å²	102	48.4 Å²	48.4	48%	0.477	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-39.8	178.7	-177.3	176.3	-25.7	0	0	112.6	A463 E464 H469 I492 W521	A463-Q467 WeakPolarHBondContact O-CB 3.4Å; A463-Q467 PolarHBondContact O-N 2.89Å; A463-Q467 VanDerWaalsContact O-N 3.13Å; E464-Q467 CarbonylContact O-C 3.54Å; E464-Q467 PolarHBondContact O-N 2.67Å; E464-Q467 VanDerWaalsContact O-N 3.11Å; Q467-H469 PolarHBondContact O-CE1 3.35Å; Q467-H469 PolarHBondContact O-N 2.8Å; Q467-H469 PolarHBondContact O-ND1 2.99Å; Q467-I492 HydrophobicContact CG-CD1 4.46Å; Q467-W521 HydrophobicContact CB-CZ2 4.42Å
468	L	82.5	Confident	80.1	Confident	85 Å²	85	49.1 Å²	49.1	45%	0.445	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	2.2	176.1	-67.6	-179.7	0	0	0	113.8	E464 L466 R470	E464-L468 HydrophobicContact CG-CD1 3.81Å; E464-L468 HydrophobicContact CG-CG 4.13Å; E464-L468 WeakPolarHBondContact O-CB 3.32Å; E464-L468 WeakPolarHBondContact O-CG 3.45Å; E464-L468 PolarHBondContact O-N 2.84Å; L466-L468 PolarHBondContact O-N 3.13Å; L468-R470 HydrophobicContact CB-CG 4.32Å; L468-R470 PolarHBondContact O-N 3.49Å
469	H	79.3	Confident	79.2	Confident	141 Å²	141	50.4 Å²	50.4	65%	0.653	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	38.1	-178.4	-56.8	42.6	0	0	0	112.5	N465 L466 Q467 Q559	N465-H469 PolarHBondContact O-N 3.38Å; L466-H469 PolarHBondContact O-N 3.31Å; L466-H469 VanDerWaalsContact O-N 3.11Å; Q467-H469 PolarHBondContact O-CE1 3.35Å; Q467-H469 PolarHBondContact O-N 2.8Å; Q467-H469 PolarHBondContact O-ND1 2.99Å; H469-Q559 VanDerWaalsContact C-NE2 3.28Å; H469-Q559 PolarHBondContact O-NE2 2.78Å
470	R	78.2	Confident	78	Confident	146 Å²	146	50.6 Å²	50.6	55%	0.551	25%	0.252	S	S	*	.	S	Bend	trans	-96.9	-28.5	168.1	-68.9	175.1	172.4	167.8	-2.5	112.4	N465 L468 Q559	N465-R470 HydrophobicContact CB-CB 4.03Å; N465-R470 PolarHBondContact O-N 3.34Å; N465-R470 VanDerWaalsContact OD1-CD 3.31Å; N465-R470 WeakPolarHBondContact OD1-CD 3.01Å; L468-R470 HydrophobicContact CB-CG 4.32Å; L468-R470 PolarHBondContact O-N 3.49Å; R470-Q559 WeakPolarHBondContact O-CG 3.49Å; R470-Q559 PolarHBondContact O-N 2.87Å
471	S	82.9	Confident	76.8	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.028	24%	0.243	C	C	.	.	S	Bend	trans	-103.1	168.7	167.4	-51.4	0	0	0	0	109.9	N465 I556 T557 Q559	N465-S471 WeakPolarHBondContact CB-OG 3.48Å; N465-S471 PolarHBondContact O-N 3.26Å; S471-I556 CarbonylContact C-O 3.44Å; S471-I556 WeakPolarHBondContact CA-O 3.49Å; S471-I556 WeakPolarHBondContact CB-O 3.41Å; S471-T557 WeakPolarHBondContact CB-O 3.41Å; S471-T557 PolarHBondContact OG-O 3.3Å; S471-Q559 PolarHBondContact O-NE2 3.46Å; S471-Q559 VanDerWaalsContact O-NE2 3.09Å
472	I	85.1	Confident	75.5	Confident	16 Å²	16	51 Å²	51	8%	0.082	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	133.3	168.3	-50.9	179.2	0	0	0	109.4	L474 I489 I555 I556 Q559	I472-L474 HydrophobicContact CB-CD2 4.29Å; I472-L474 HydrophobicContact CG2-CB 4.09Å; I472-L474 HydrophobicContact CG2-CD2 3.77Å; I472-L474 HydrophobicContact CG2-CG 4.49Å; I472-I489 HydrophobicContact CG2-CD1 4.26Å; I472-I489 HydrophobicContact CG2-CG1 4.03Å; I472-I489 HydrophobicContact CG2-CG2 4.06Å; I472-I555 CarbonylContact O-C 3.47Å; I472-I555 WeakPolarHBondContact O-CA 3.37Å; I472-I556 PolarHBondContact N-O 3.06Å; I472-I556 PolarHBondContact O-N 3.18Å; I472-Q559 HydrophobicContact CD1-CG 3.78Å; I472-Q559 HydrophobicContact CG1-CG 3.65Å
473	A	87.8	Confident	74.1	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.9	163.3	0	0	0	0	0	109.1	L466 I489 L490 A554 I555	L466-A473 HydrophobicContact CD2-CB 4.01Å; A473-I489 WeakPolarHBondContact O-CA 3Å; A473-L490 HydrophobicContact CB-CB 4.09Å; A473-L490 HydrophobicContact CB-CD2 4.27Å; A473-L490 PolarHBondContact O-N 2.83Å; A473-A554 WeakPolarHBondContact CA-O 3.35Å; A473-I555 HydrophobicContact CB-CD1 3.51Å
474	L	87.2	Confident	73.1	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.052	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.9	-172.7	69.4	97.5	0	0	0	114	I472 T476 F484 C488 L553 A554 I556	I472-L474 HydrophobicContact CB-CD2 4.29Å; I472-L474 HydrophobicContact CG2-CB 4.09Å; I472-L474 HydrophobicContact CG2-CD2 3.77Å; I472-L474 HydrophobicContact CG2-CG 4.49Å; L474-T476 HydrophobicContact CD1-CG2 4.13Å; L474-F484 HydrophobicContact CD2-CD1 3.95Å; L474-F484 HydrophobicContact CD2-CE1 3.7Å; L474-C488 WeakPolarHBondContact CA-O 3.39Å; L474-L553 WeakPolarHBondContact O-CA 3.24Å; L474-A554 HydrophobicContact CD1-CB 4.36Å; L474-A554 HydrophobicContact CG-CB 4.34Å; L474-A554 PolarHBondContact N-O 2.93Å; L474-A554 PolarHBondContact O-N 3.13Å; L474-I556 HydrophobicContact CD2-CD1 3.92Å
475	I	87	Confident	72.3	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	136	175.4	-65.9	155.2	0	0	0	110.3	I449 C488 L490 K523 M525 C536 L538 Y552 F572	I449-I475 HydrophobicContact CB-CD1 4.32Å; I449-I475 HydrophobicContact CD1-CD1 3.5Å; I449-I475 VanDerWaalsContact CD1-CD1 3.5Å; I449-I475 HydrophobicContact CD1-CG1 3.97Å; I475-C488 PolarHBondContact N-O 3.26Å; I475-L490 HydrophobicContact CD1-CD1 4Å; I475-L490 HydrophobicContact CG1-CD1 3.94Å; I475-K523 HydrophobicContact CD1-CB 3.98Å; I475-K523 HydrophobicContact CD1-CG 4.27Å; I475-M525 HydrophobicContact CB-CE 4.31Å; I475-M525 HydrophobicContact CD1-CE 3.48Å; I475-M525 VanDerWaalsContact CD1-CE 3.48Å; I475-M525 HydrophobicContact CD1-SD 4.34Å; I475-M525 HydrophobicContact CG2-CE 4.47Å; I475-C536 HydrophobicContact CB-CB 4.08Å; I475-C536 HydrophobicContact CG2-CB 3.74Å; I475-L538 HydrophobicContact CG2-CD2 3.67Å; I475-L538 HydrophobicContact CG2-CG 4.16Å; I475-Y552 CarbonylContact C-O 3.58Å; I475-Y552 WeakPolarHBondContact CA-O 3.2Å; I475-F572 HydrophobicContact CG2-CZ 4.16Å
476	T	80.4	Confident	71.5	Confident	10 Å²	10	63.3 Å²	63.3	6%	0.061	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	178.2	-174.7	-172.8	0	0	0	0	112.2	L474 C536 Y552 A554	L474-T476 HydrophobicContact CD1-CG2 4.13Å; T476-C536 CarbonylContact C-O 3.57Å; T476-C536 WeakPolarHBondContact CA-O 3.45Å; T476-Y552 PolarHBondContact N-O 2.92Å; T476-Y552 WeakPolarHBondContact O-CB 3.37Å; T476-Y552 PolarHBondContact O-N 2.82Å; T476-A554 HydrophobicContact CG2-CB 4.09Å
477	N	73.1	Confident	71.1	Confident	55 Å²	55	67.4 Å²	67.4	29%	0.294	32%	0.323	S	S	.	.	S	Bend	trans	-125.5	28.7	-171.7	70.7	-21.7	0	0	0	112.9	T479 G537	N477-T479 PolarHBondContact O-N 3.03Å; N477-T479 PolarHBondContact OD1-N 2.93Å; N477-T479 PolarHBondContact OD1-OG1 3.46Å; N477-G537 WeakPolarHBondContact CB-O 3.27Å
478	L	62.9	Low	71.1	Confident	58 Å²	58	63 Å²	63	30%	0.304	30%	0.303	S	S	.	.	S	Bend	trans	71.9	-18.2	-165.1	-59.8	163.3	0	0	0	116.1	I480 Y552 L569	L478-I480 VanDerWaalsContact C-N 3.3Å; L478-I480 VanDerWaalsContact O-CG1 3.31Å; L478-I480 WeakPolarHBondContact O-CG1 3.35Å; L478-I480 PolarHBondContact O-N 3.25Å; L478-Y552 HydrophobicContact CD1-CE1 4.38Å; L478-Y552 HydrophobicContact CD1-CE2 3.83Å; L478-Y552 HydrophobicContact CD2-CD1 3.97Å; L478-Y552 HydrophobicContact CD2-CD2 4.33Å; L478-Y552 HydrophobicContact CD2-CE1 3.82Å; L478-Y552 HydrophobicContact CD2-CE2 4.22Å; L478-Y552 HydrophobicContact CD2-CG 4.23Å; L478-Y552 HydrophobicContact CG-CD1 4.37Å; L478-Y552 HydrophobicContact CG-CD2 3.86Å; L478-Y552 HydrophobicContact CG-CE1 4.1Å; L478-Y552 HydrophobicContact CG-CE2 3.59Å; L478-Y552 HydrophobicContact CG-CG 4.27Å; L478-L569 HydrophobicContact CD2-CD2 4.12Å
479	T	53.1	Low	71.2	Confident	63 Å²	63	60.8 Å²	60.8	39%	0.387	29%	0.291	S	S	.	.			trans	-82.3	78.7	171.7	72.2	0	0	0	0	110.6	N477 Y481 Q482	N477-T479 PolarHBondContact O-N 3.03Å; N477-T479 PolarHBondContact OD1-N 2.93Å; N477-T479 PolarHBondContact OD1-OG1 3.46Å; T479-Y481 PolarHBondContact O-N 3.39Å; T479-Q482 PolarHBondContact O-N 2.68Å
480	I	52.7	Low	71.5	Confident	16 Å²	16	54 Å²	54	8%	0.082	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	28	-179	-21	-178.5	0	0	0	113.6	L478 R562	L478-I480 VanDerWaalsContact C-N 3.3Å; L478-I480 VanDerWaalsContact O-CG1 3.31Å; L478-I480 WeakPolarHBondContact O-CG1 3.35Å; L478-I480 PolarHBondContact O-N 3.25Å; I480-R562 PolarHBondContact O-NH1 2.94Å; I480-R562 PolarHBondContact O-NH2 3.02Å
481	Y	48.2	Very low	71.9	Confident	44 Å²	44	51.5 Å²	51.5	17%	0.173	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-10	-163.9	-55.4	-72.5	0	0	0	113	T479 L600	T479-Y481 PolarHBondContact O-N 3.39Å; Y481-L600 WeakPolarHBondContact CD1-O 3.37Å; Y481-L600 HydrophobicContact CD2-CD1 4.44Å; Y481-L600 HydrophobicContact CE1-CD1 4.38Å; Y481-L600 HydrophobicContact CE1-CG 3.95Å; Y481-L600 VanDerWaalsContact CE1-O 3.25Å; Y481-L600 WeakPolarHBondContact CE1-O 3.4Å; Y481-L600 HydrophobicContact CE2-CD1 3.47Å; Y481-L600 VanDerWaalsContact CE2-CD1 3.47Å; Y481-L600 HydrophobicContact CE2-CG 3.97Å; Y481-L600 VanDerWaalsContact CZ-CD1 3.47Å; Y481-L600 VanDerWaalsContact CZ-CG 3.46Å; Y481-L600 VanDerWaalsContact OH-CD1 3.3Å; Y481-L600 WeakPolarHBondContact OH-CD1 3.43Å; Y481-L600 VanDerWaalsContact OH-CG 3.26Å; Y481-L600 WeakPolarHBondContact OH-CG 3.37Å
482	Q	50.2	Low	71.9	Confident	122 Å²	122	53.3 Å²	53.3	57%	0.57	27%	0.266	S	S	*	.	S	Bend	trans	-68.7	138	167.3	-66.7	-167.6	-2	0	0	110	T479 F484	T479-Q482 PolarHBondContact O-N 2.68Å; Q482-F484 PolarHBondContact O-N 3.03Å
483	K	53.2	Low	71.3	Confident	162 Å²	162	56.5 Å²	56.5	70%	0.704	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-51.6	123.2	175.9	-178.4	177.6	179.7	177.8	0	109.8	L485 P605	K483-L485 PolarHBondContact O-N 3.11Å; K483-P605 HydrophobicContact CB-CG 4.02Å; K483-P605 HydrophobicContact CG-CG 4.15Å
484	F	59.4	Low	70	Confident	55 Å²	55	65.1 Å²	65.1	24%	0.241	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-51	117.4	-173.4	-59.1	-82.3	0	0	0	110.6	L474 Q482 I556 W606	L474-F484 HydrophobicContact CD2-CD1 3.95Å; L474-F484 HydrophobicContact CD2-CE1 3.7Å; Q482-F484 PolarHBondContact O-N 3.03Å; F484-I556 HydrophobicContact CE1-CD1 4.19Å; F484-I556 HydrophobicContact CZ-CD1 4.38Å; F484-W606 HydrophobicContact CD2-CZ2 4.29Å; F484-W606 AromaticContact CE2-CE2 3.62Å; F484-W606 HydrophobicContact CE2-CH2 4.02Å; F484-W606 AromaticContact CE2-CZ2 3.28Å; F484-W606 HydrophobicContact CE2-CZ2 3.28Å; F484-W606 AromaticContact CE2-NE1 3.87Å; F484-W606 AromaticContact CZ-CZ2 3.58Å; F484-W606 HydrophobicContact CZ-CZ2 3.58Å
485	L	64.7	Low	68.4	Low	99 Å²	99	71.2 Å²	71.2	52%	0.518	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-85.9	120.2	168.4	-62.6	171.9	0	0	0	106.2	K483 H487 C488	K483-L485 PolarHBondContact O-N 3.11Å; L485-H487 PolarHBondContact O-N 2.84Å; L485-C488 WeakPolarHBondContact O-CB 3.18Å; L485-C488 PolarHBondContact O-N 2.88Å
486	D	67.4	Low	66.7	Low	132 Å²	132	80.3 Å²	80.3	71%	0.706	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-58.6	-25.4	179.6	-52.8	-45.3	0	0	0	111.8	C488 I489	D486-C488 PolarHBondContact O-N 2.82Å; D486-I489 PolarHBondContact O-N 2.83Å
487	H	75.2	Confident	65	Low	90 Å²	90	81.6 Å²	81.6	42%	0.417	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-61.8	-19.8	171.3	-166.4	85.9	0	0	0	113.6	L485 K523	L485-H487 PolarHBondContact O-N 2.84Å; H487-K523 VanDerWaalsContact C-NZ 3.35Å; H487-K523 WeakPolarHBondContact O-CE 3.46Å; H487-K523 PolarHBondContact O-NZ 2.89Å
488	C	81.2	Confident	63.7	Low	11 Å²	11	86.7 Å²	86.7	7%	0.074	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-93.9	-10.4	-178.6	-59	0	0	0	0	114.9	L474 I475 L485 D486 C536	L474-C488 WeakPolarHBondContact CA-O 3.39Å; I475-C488 PolarHBondContact N-O 3.26Å; L485-C488 WeakPolarHBondContact O-CB 3.18Å; L485-C488 PolarHBondContact O-N 2.88Å; D486-C488 PolarHBondContact O-N 2.82Å; C488-C536 WeakPolarHBondContact CA-SG 3.28Å; C488-C536 HydrophobicContact CB-CB 3.81Å; C488-C536 WeakPolarHBondContact CB-SG 3.35Å; C488-C536 WeakPolarHBondContact SG-CA 3.24Å; C488-C536 WeakPolarHBondContact SG-CB 3.16Å; C488-C536 CovalentContact SG-SG 2.02Å; C488-C536 PolarHBondContact SG-SG 2.98Å
489	I	84.9	Confident	63	Low	37 Å²	37	85.2 Å²	85.2	19%	0.19	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-78.5	137.8	179.6	-59.5	176.2	0	0	0	109.6	I472 A473 D486 K523	I472-I489 HydrophobicContact CG2-CD1 4.26Å; I472-I489 HydrophobicContact CG2-CG1 4.03Å; I472-I489 HydrophobicContact CG2-CG2 4.06Å; A473-I489 WeakPolarHBondContact O-CA 3Å; D486-I489 PolarHBondContact O-N 2.83Å; I489-K523 PolarHBondContact O-NZ 2.91Å
490	L	87.2	Confident	62.9	Low	0 Å²	0	86.3 Å²	86.3	0%	0	42%	0.416	C	S	.	.			trans	-75.3	145.8	170.9	-81.2	62.6	0	0	0	109.3	F451 A473 I475 W521 K523 L553	F451-L490 HydrophobicContact CB-CD2 4.08Å; A473-L490 HydrophobicContact CB-CB 4.09Å; A473-L490 HydrophobicContact CB-CD2 4.27Å; A473-L490 PolarHBondContact O-N 2.83Å; I475-L490 HydrophobicContact CD1-CD1 4Å; I475-L490 HydrophobicContact CG1-CD1 3.94Å; L490-W521 HydrophobicContact CB-CB 4.28Å; L490-W521 WeakPolarHBondContact O-CZ3 3.36Å; L490-K523 HydrophobicContact CD1-CB 4.01Å; L490-K523 HydrophobicContact CG-CB 3.94Å; L490-L553 HydrophobicContact CD1-CD1 3.71Å; L490-L553 HydrophobicContact CD2-CD1 3.76Å; L490-L553 HydrophobicContact CG-CD1 4.42Å
491	N	85.9	Confident	62.6	Low	93 Å²	93	90.1 Å²	90.1	50%	0.497	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	154.1	-179.9	-71.7	-21.1	0	0	0	110.9	K493 C522	N491-K493 PolarHBondContact O-N 2.9Å; N491-C522 PolarHBondContact N-O 3.3Å; N491-C522 PolarHBondContact O-N 3.3Å
492	I	82.6	Confident	62.6	Low	41 Å²	41	94.4 Å²	94.4	21%	0.21	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	119.2	173	-61	174.3	0	0	0	109.9	Q467 K494 Y519 W521	Q467-I492 HydrophobicContact CG-CD1 4.46Å; I492-K494 HydrophobicContact CG2-CG 4.32Å; I492-K494 PolarHBondContact O-N 2.83Å; I492-Y519 HydrophobicContact CD1-CG 4.46Å; I492-Y519 HydrophobicContact CG2-CD1 3.62Å; I492-Y519 HydrophobicContact CG2-CE1 4.41Å; I492-Y519 HydrophobicContact CG2-CG 4.15Å; I492-W521 HydrophobicContact CD1-CH2 4.18Å; I492-W521 HydrophobicContact CD1-CZ2 3.65Å; I492-W521 HydrophobicContact CG1-CD2 3.95Å; I492-W521 VanDerWaalsContact CG1-CE2 3.48Å; I492-W521 HydrophobicContact CG1-CE3 4.32Å; I492-W521 HydrophobicContact CG1-CH2 3.85Å; I492-W521 HydrophobicContact CG1-CZ2 3.41Å; I492-W521 VanDerWaalsContact CG1-CZ2 3.41Å; I492-W521 HydrophobicContact CG1-CZ3 4.28Å
493	K	73	Confident	62.7	Low	84 Å²	84	90.5 Å²	90.5	37%	0.365	44%	0.438	S	S	.	.			trans	-80.2	102.4	176.8	-168.6	166.6	-179.2	170.8	0	109.2	E448 N491 I520 C522	E448-K493 IonicContact OE1-NZ 2.62Å; E448-K493 PolarHBondContact OE1-NZ 2.86Å; E448-K493 IonicContact OE2-NZ 3.63Å; E448-K493 PolarHBondContact OE2-NZ 2.58Å; N491-K493 PolarHBondContact O-N 2.9Å; K493-I520 PolarHBondContact N-O 3.43Å; K493-C522 HydrophobicContact CB-CB 4.21Å; K493-C522 HydrophobicContact CD-CB 3.99Å
494	K	59.6	Low	62.4	Low	181 Å²	181	85.8 Å²	85.8	79%	0.787	42%	0.416	S	S	*	.			trans	-81.9	-20.6	-174.1	-67.9	-176.5	178.7	179.2	0	114.7	I492	I492-K494 HydrophobicContact CG2-CG 4.32Å; I492-K494 PolarHBondContact O-N 2.83Å
495	D	54.4	Low	61.7	Low	138 Å²	138	87 Å²	87	74%	0.738	43%	0.425	S	S	*	.	S	Bend	trans	-94.6	133.2	-178.8	-70.8	-51.2	0	0	0	112.5	G497	D495-G497 PolarHBondContact O-N 2.88Å
496	Y	51.3	Low	61	Low	196 Å²	196	88 Å²	88	77%	0.769	43%	0.431	S	S	*	.			trans	-70.8	72.2	171.6	-60.6	-88.1	0	0	0	111.1	Y500	Y496-Y500 HydrophobicContact CD1-CD2 4.39Å; Y496-Y500 HydrophobicContact CD1-CE2 4.44Å; Y496-Y500 HydrophobicContact CD1-CG 4.46Å; Y496-Y500 HydrophobicContact CE1-CE2 4.49Å
497	G	44.7	Very low	60.1	Low	36 Å²	36	82.4 Å²	82.4	37%	0.371	40%	0.402	S	S	.	.			trans	-66.6	160.1	174.6	0	0	0	0	0	113	D495 Q499 Y500	D495-G497 PolarHBondContact O-N 2.88Å; G497-Q499 PolarHBondContact O-N 2.75Å; G497-Y500 PolarHBondContact O-N 3.35Å; G497-Y500 VanDerWaalsContact O-N 3.1Å
498	L	45.2	Very low	58.7	Low	163 Å²	163	83 Å²	83	85%	0.853	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	38.7	-180	-71	164.5	0	0	0	115.6	R583	L498-R583 PolarHBondContact O-NH1 2.94Å
499	Q	49.6	Very low	57.1	Low	27 Å²	27	84.3 Å²	84.3	13%	0.126	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151.2	-12.8	-176.6	-157.6	154.5	20.3	0	0	112.2	F441 G497 Q502 W503	F441-Q499 VanDerWaalsContact CE2-CD 3.5Å; F441-Q499 HydrophobicContact CE2-CG 4.03Å; F441-Q499 HydrophobicContact CZ-CG 4.09Å; G497-Q499 PolarHBondContact O-N 2.75Å; Q499-Q502 PolarHBondContact O-N 2.93Å; Q499-W503 PolarHBondContact O-N 3.06Å
500	Y	51.3	Low	55	Low	85 Å²	85	88.1 Å²	88.1	33%	0.333	43%	0.428	S	S	.	.	H	α-helix	trans	-50.3	-57.6	167.8	-176.5	-97.4	0	0	0	109.8	Y496 G497 Q502 W503 Y504	Y496-Y500 HydrophobicContact CD1-CD2 4.39Å; Y496-Y500 HydrophobicContact CD1-CE2 4.44Å; Y496-Y500 HydrophobicContact CD1-CG 4.46Å; Y496-Y500 HydrophobicContact CE1-CE2 4.49Å; G497-Y500 PolarHBondContact O-N 3.35Å; G497-Y500 VanDerWaalsContact O-N 3.1Å; Y500-Q502 VanDerWaalsContact C-N 3.3Å; Y500-Q502 PolarHBondContact O-N 2.78Å; Y500-W503 PolarHBondContact O-N 2.93Å; Y500-Y504 HydrophobicContact CD1-CD1 4.24Å; Y500-Y504 HydrophobicContact CD1-CG 4.22Å; Y500-Y504 AromaticContact CE1-CD1 3.67Å; Y500-Y504 HydrophobicContact CE1-CD1 3.67Å; Y500-Y504 AromaticContact CE1-CD2 3.97Å; Y500-Y504 HydrophobicContact CE1-CD2 3.97Å; Y500-Y504 AromaticContact CE1-CE1 3.85Å; Y500-Y504 HydrophobicContact CE1-CE1 3.85Å; Y500-Y504 HydrophobicContact CE1-CE2 4.14Å; Y500-Y504 AromaticContact CE1-CG 3.71Å; Y500-Y504 HydrophobicContact CE1-CG 3.71Å; Y500-Y504 HydrophobicContact CE2-CD2 4.5Å; Y500-Y504 AromaticContact CZ-CD2 3.82Å; Y500-Y504 AromaticContact CZ-CE2 3.87Å; Y500-Y504 WeakPolarHBondContact O-CB 3.39Å; Y500-Y504 PolarHBondContact O-N 3.3Å; Y500-Y504 VanDerWaalsContact OH-CE2 3.29Å; Y500-Y504 WeakPolarHBondContact OH-CE2 3.29Å
501	D	46	Very low	52.9	Low	97 Å²	97	95 Å²	95	52%	0.519	47%	0.465	S	S	.	.	H	α-helix	trans	-58.9	-32.9	-176.5	-66.7	-39.4	0	0	0	114.4	N505	D501-N505 WeakPolarHBondContact O-CB 3Å; D501-N505 VanDerWaalsContact O-CG 3.3Å; D501-N505 PolarHBondContact O-N 2.9Å; D501-N505 PolarHBondContact O-ND2 2.94Å
502	Q	48.5	Very low	50.8	Low	133 Å²	133	97.2 Å²	97.2	62%	0.621	47%	0.467	S	S	*	.	H	α-helix	trans	-74.3	-38.7	-178.5	-74.4	-173	-41	0	0	112.5	Q499 Y500	Q499-Q502 PolarHBondContact O-N 2.93Å; Y500-Q502 VanDerWaalsContact C-N 3.3Å; Y500-Q502 PolarHBondContact O-N 2.78Å
503	W	51.8	Low	48.8	Very low	41 Å²	41	98.4 Å²	98.4	16%	0.155	47%	0.474	C	S	.	.	H	α-helix	trans	-75.1	-39.3	173.7	-163.5	13.9	0	0	0	110.8	H439 C450 L452 Q499 Y500 T507 I520	H439-W503 HydrophobicContact CB-CH2 4.26Å; H439-W503 HydrophobicContact CB-CZ2 4.24Å; C450-W503 HydrophobicContact CB-CZ3 4.27Å; L452-W503 HydrophobicContact CB-CH2 4Å; L452-W503 HydrophobicContact CB-CZ2 4.28Å; Q499-W503 PolarHBondContact O-N 3.06Å; Y500-W503 PolarHBondContact O-N 2.93Å; W503-T507 WeakPolarHBondContact O-CB 3.29Å; W503-T507 WeakPolarHBondContact O-CG2 3.43Å; W503-T507 PolarHBondContact O-N 2.94Å; W503-T507 PolarHBondContact O-OG1 2.86Å; W503-I520 HydrophobicContact CE3-CD1 4.04Å; W503-I520 HydrophobicContact CH2-CG2 4.45Å; W503-I520 HydrophobicContact CZ3-CD1 3.89Å; W503-I520 HydrophobicContact CZ3-CG1 4.26Å; W503-I520 HydrophobicContact CZ3-CG2 3.79Å
504	Y	46.4	Very low	47.2	Very low	63 Å²	63	101.8 Å²	101.8	25%	0.247	49%	0.489	C	S	.	.	H	α-helix	trans	-74.1	-21.6	-177.9	-172.7	-109.1	0	0	0	115	Y500 T507 I509 N513	Y500-Y504 HydrophobicContact CD1-CD1 4.24Å; Y500-Y504 HydrophobicContact CD1-CG 4.22Å; Y500-Y504 AromaticContact CE1-CD1 3.67Å; Y500-Y504 HydrophobicContact CE1-CD1 3.67Å; Y500-Y504 AromaticContact CE1-CD2 3.97Å; Y500-Y504 HydrophobicContact CE1-CD2 3.97Å; Y500-Y504 AromaticContact CE1-CE1 3.85Å; Y500-Y504 HydrophobicContact CE1-CE1 3.85Å; Y500-Y504 HydrophobicContact CE1-CE2 4.14Å; Y500-Y504 AromaticContact CE1-CG 3.71Å; Y500-Y504 HydrophobicContact CE1-CG 3.71Å; Y500-Y504 HydrophobicContact CE2-CD2 4.5Å; Y500-Y504 AromaticContact CZ-CD2 3.82Å; Y500-Y504 AromaticContact CZ-CE2 3.87Å; Y500-Y504 WeakPolarHBondContact O-CB 3.39Å; Y500-Y504 PolarHBondContact O-N 3.3Å; Y500-Y504 VanDerWaalsContact OH-CE2 3.29Å; Y500-Y504 WeakPolarHBondContact OH-CE2 3.29Å; Y504-T507 WeakPolarHBondContact CA-OG1 3.33Å; Y504-I509 HydrophobicContact CD2-CG2 3.77Å; Y504-I509 HydrophobicContact CE2-CG2 3.59Å; Y504-N513 WeakPolarHBondContact CE2-OD1 3.46Å; Y504-N513 VanDerWaalsContact CZ-OD1 3.31Å; Y504-N513 PolarHBondContact OH-ND2 2.79Å; Y504-N513 PolarHBondContact OH-OD1 3.07Å
505	N	45.7	Very low	46.4	Very low	79 Å²	79	97.3 Å²	97.3	42%	0.422	47%	0.473	S	S	.	.	H	α-helix	trans	-92	-25.7	174	-76.1	-69.5	0	0	0	113.9	D501 K510	D501-N505 WeakPolarHBondContact O-CB 3Å; D501-N505 VanDerWaalsContact O-CG 3.3Å; D501-N505 PolarHBondContact O-N 2.9Å; D501-N505 PolarHBondContact O-ND2 2.94Å; N505-K510 WeakPolarHBondContact OD1-CE 3.06Å; N505-K510 PolarHBondContact OD1-NZ 2.99Å
506	N	49.1	Very low	46	Very low	122 Å²	122	95.9 Å²	95.9	65%	0.652	47%	0.465	S	S	*	.	H	α-helix	trans	-81.4	-47.7	174.6	-77.4	15.8	0	0	0	111.2	E435 I508	E435-N506 VanDerWaalsContact OE1-C 3.28Å; N506-I508 PolarHBondContact O-N 2.78Å
507	T	48.5	Very low	45.9	Very low	14 Å²	14	91.7 Å²	91.7	9%	0.086	46%	0.46	C	S	.	.	S	Bend	trans	-53.4	141.6	172.9	48.4	0	0	0	0	111.4	E435 W503 Y504 I509	E435-T507 HydrophobicContact CB-CG2 4.5Å; E435-T507 PolarHBondContact OE1-N 2.9Å; E435-T507 WeakPolarHBondContact OE2-CG2 3.36Å; W503-T507 WeakPolarHBondContact O-CB 3.29Å; W503-T507 WeakPolarHBondContact O-CG2 3.43Å; W503-T507 PolarHBondContact O-N 2.94Å; W503-T507 PolarHBondContact O-OG1 2.86Å; Y504-T507 WeakPolarHBondContact CA-OG1 3.33Å; T507-I509 HydrophobicContact CG2-CD1 4.06Å; T507-I509 HydrophobicContact CG2-CG1 4.45Å; T507-I509 PolarHBondContact O-N 2.81Å
508	I	45.5	Very low	46.6	Very low	101 Å²	101	94.4 Å²	94.4	52%	0.518	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	22.4	173.1	-57.6	166.8	0	0	0	111.2	I380 N506 K510 N511	I380-I508 HydrophobicContact CD1-CD1 4.19Å; N506-I508 PolarHBondContact O-N 2.78Å; I508-K510 PolarHBondContact O-N 3.09Å; I508-N511 PolarHBondContact O-N 3.45Å
509	I	47.9	Very low	47.8	Very low	39 Å²	39	92.3 Å²	92.3	20%	0.2	44%	0.443	C	S	.	.	H	α-helix	trans	-61.5	-23.8	174.1	-77.2	175	0	0	0	111.4	Y504 T507 N511 Y512 N513	Y504-I509 HydrophobicContact CD2-CG2 3.77Å; Y504-I509 HydrophobicContact CE2-CG2 3.59Å; T507-I509 HydrophobicContact CG2-CD1 4.06Å; T507-I509 HydrophobicContact CG2-CG1 4.45Å; T507-I509 PolarHBondContact O-N 2.81Å; I509-N511 PolarHBondContact O-N 3.14Å; I509-N511 VanDerWaalsContact O-N 3.14Å; I509-Y512 CarbonylContact O-C 3Å; I509-Y512 PolarHBondContact O-N 3.41Å; I509-N513 VanDerWaalsContact CG2-OD1 3.24Å; I509-N513 WeakPolarHBondContact CG2-OD1 3.44Å; I509-N513 WeakPolarHBondContact O-CA 3.44Å; I509-N513 VanDerWaalsContact O-CB 3.26Å; I509-N513 WeakPolarHBondContact O-CB 3.12Å; I509-N513 PolarHBondContact O-N 2.04Å; I509-N513 PolarHBondContact O-ND2 2.88Å
510	K	41.5	Very low	49	Very low	118 Å²	118	92.9 Å²	92.9	51%	0.513	45%	0.447	S	S	.	.	H	α-helix	trans	-55	-30.8	175.1	-77.4	-177.7	178.8	170.9	0	115.2	N505 I508	N505-K510 WeakPolarHBondContact OD1-CE 3.06Å; N505-K510 PolarHBondContact OD1-NZ 2.99Å; I508-K510 PolarHBondContact O-N 3.09Å
511	N	43	Very low	50.7	Low	145 Å²	145	89.6 Å²	89.6	78%	0.775	43%	0.434	S	S	*	.	H	α-helix	trans	-89.8	-15.1	175.3	-73.9	-0.5	0	0	0	113.7	I508 I509	I508-N511 PolarHBondContact O-N 3.45Å; I509-N511 PolarHBondContact O-N 3.14Å; I509-N511 VanDerWaalsContact O-N 3.14Å
512	Y	42	Very low	52.8	Low	139 Å²	139	85.5 Å²	85.5	55%	0.545	41%	0.412	S	S	.	.	H	α-helix	trans	-102.3	-0.5	176.6	-75.9	-84.4	0	0	0	113.8	I509 K514 L515	I509-Y512 CarbonylContact O-C 3Å; I509-Y512 PolarHBondContact O-N 3.41Å; Y512-K514 PolarHBondContact O-N 2.81Å; Y512-L515 PolarHBondContact O-N 2.86Å
513	N	39.2	Very low	54.7	Low	66 Å²	66	80.4 Å²	80.4	35%	0.353	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	6.7	-165.6	-111.7	-27.3	0	0	0	116.8	Y504 I509	Y504-N513 WeakPolarHBondContact CE2-OD1 3.46Å; Y504-N513 VanDerWaalsContact CZ-OD1 3.31Å; Y504-N513 PolarHBondContact OH-ND2 2.79Å; Y504-N513 PolarHBondContact OH-OD1 3.07Å; I509-N513 VanDerWaalsContact CG2-OD1 3.24Å; I509-N513 WeakPolarHBondContact CG2-OD1 3.44Å; I509-N513 WeakPolarHBondContact O-CA 3.44Å; I509-N513 VanDerWaalsContact O-CB 3.26Å; I509-N513 WeakPolarHBondContact O-CB 3.12Å; I509-N513 PolarHBondContact O-N 2.04Å; I509-N513 PolarHBondContact O-ND2 2.88Å
514	K	40.9	Very low	56.2	Low	155 Å²	155	81.6 Å²	81.6	67%	0.674	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-12.3	179.5	-147.8	-177.8	175.6	-138.8	0	113.2	E41 Y512	E41-K514 IonicContact OE1-NZ 2.86Å; E41-K514 PolarHBondContact OE1-NZ 3.06Å; E41-K514 WeakPolarHBondContact OE2-CD 3.41Å; E41-K514 WeakPolarHBondContact OE2-CE 3.27Å; E41-K514 IonicContact OE2-NZ 3.97Å; E41-K514 PolarHBondContact OE2-NZ 2.85Å; Y512-K514 PolarHBondContact O-N 2.81Å
515	L	41.6	Very low	57.9	Low	86 Å²	86	78.9 Å²	78.9	45%	0.45	39%	0.39	S	S	.	.	S	Bend	trans	-106.8	131.6	-172.6	-68.2	164.2	0	0	0	111.6	Y512	Y512-L515 PolarHBondContact O-N 2.86Å
516	N	46.8	Very low	59.5	Low	109 Å²	109	76.6 Å²	76.6	58%	0.583	38%	0.377	S	S	*	.			trans	5.3	122.5	176.9	-78.7	-33.8	0	0	0	118.3	N38 K518	N38-N516 PolarHBondContact ND2-OD1 2.96Å; N516-K518 PolarHBondContact O-N 3.3Å
517	T	49.8	Very low	60.5	Low	108 Å²	108	75.2 Å²	75.2	66%	0.663	36%	0.363	S	S	*	.			trans	-45.5	97.8	179.2	53.7	0	0	0	0	113.7	Y519	T517-Y519 PolarHBondContact O-N 2.94Å
518	K	59.1	Low	61.4	Low	93 Å²	93	80.5 Å²	80.5	40%	0.404	38%	0.382	S	S	.	.			trans	-63.7	106.2	174.1	-70.1	-170.2	177.4	-175.3	0	109.8	L452 N516 I520	L452-K518 HydrophobicContact CD1-CB 3.86Å; L452-K518 HydrophobicContact CD1-CD 4Å; L452-K518 HydrophobicContact CD2-CD 4.38Å; L452-K518 HydrophobicContact CG-CD 4.4Å; N516-K518 PolarHBondContact O-N 3.3Å; K518-I520 PolarHBondContact O-N 2.04Å
519	Y	68.9	Low	62.3	Low	119 Å²	119	83.6 Å²	83.6	47%	0.467	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-70.1	123.8	175.7	-69.1	-71.3	0	0	0	111	P453 I492 T517	P453-Y519 WeakPolarHBondContact CD-O 3.5Å; I492-Y519 HydrophobicContact CD1-CG 4.46Å; I492-Y519 HydrophobicContact CG2-CD1 3.62Å; I492-Y519 HydrophobicContact CG2-CE1 4.41Å; I492-Y519 HydrophobicContact CG2-CG 4.15Å; T517-Y519 PolarHBondContact O-N 2.94Å
520	I	76.5	Confident	62.9	Low	39 Å²	39	84.5 Å²	84.5	20%	0.2	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-85	127	173.1	-56	169.1	0	0	0	108.7	C450 L452 K493 W503 K518 C522	C450-I520 HydrophobicContact CB-CG2 3.94Å; L452-I520 HydrophobicContact CD1-CG1 4.25Å; K493-I520 PolarHBondContact N-O 3.43Å; W503-I520 HydrophobicContact CE3-CD1 4.04Å; W503-I520 HydrophobicContact CH2-CG2 4.45Å; W503-I520 HydrophobicContact CZ3-CD1 3.89Å; W503-I520 HydrophobicContact CZ3-CG1 4.26Å; W503-I520 HydrophobicContact CZ3-CG2 3.79Å; K518-I520 PolarHBondContact O-N 2.04Å; I520-C522 VanDerWaalsContact CG2-SG 3.52Å
521	W	86.7	Confident	63.5	Low	16 Å²	16	84.6 Å²	84.6	6%	0.061	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121.1	174.5	-72.3	75.6	0	0	0	108.6	C450 F451 L466 Q467 L490 I492	C450-W521 CarbonylContact C-O 3.49Å; C450-W521 VanDerWaalsContact CA-O 3.26Å; C450-W521 WeakPolarHBondContact CA-O 3.29Å; F451-W521 PolarHBondContact N-O 3.41Å; F451-W521 PolarHBondContact O-N 2.8Å; L466-W521 HydrophobicContact CB-CD2 4.41Å; L466-W521 HydrophobicContact CB-CH2 3.95Å; L466-W521 HydrophobicContact CB-CZ2 3.48Å; L466-W521 VanDerWaalsContact CB-CZ2 3.48Å; L466-W521 HydrophobicContact CD1-CD2 4.5Å; L466-W521 WeakPolarHBondContact O-CH2 3.36Å; Q467-W521 HydrophobicContact CB-CZ2 4.42Å; L490-W521 HydrophobicContact CB-CB 4.28Å; L490-W521 WeakPolarHBondContact O-CZ3 3.36Å; I492-W521 HydrophobicContact CD1-CH2 4.18Å; I492-W521 HydrophobicContact CD1-CZ2 3.65Å; I492-W521 HydrophobicContact CG1-CD2 3.95Å; I492-W521 VanDerWaalsContact CG1-CE2 3.48Å; I492-W521 HydrophobicContact CG1-CE3 4.32Å; I492-W521 HydrophobicContact CG1-CH2 3.85Å; I492-W521 HydrophobicContact CG1-CZ2 3.41Å; I492-W521 VanDerWaalsContact CG1-CZ2 3.41Å; I492-W521 HydrophobicContact CG1-CZ3 4.28Å
522	C	88.9	Confident	64	Low	10 Å²	10	83.3 Å²	83.3	7%	0.068	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.1	-178.3	-64.4	0	0	0	0	112.2	I449 C450 N491 K493 I520	I449-C522 CarbonylContact O-C 3.6Å; I449-C522 VanDerWaalsContact O-CA 3.29Å; I449-C522 WeakPolarHBondContact O-CA 3.38Å; C450-C522 HydrophobicContact CB-CB 4.15Å; C450-C522 WeakPolarHBondContact CB-SG 3.46Å; C450-C522 WeakPolarHBondContact SG-CB 3.44Å; C450-C522 CovalentContact SG-SG 2.05Å; C450-C522 PolarHBondContact SG-SG 2.89Å; N491-C522 PolarHBondContact N-O 3.3Å; N491-C522 PolarHBondContact O-N 3.3Å; K493-C522 HydrophobicContact CB-CB 4.21Å; K493-C522 HydrophobicContact CD-CB 3.99Å; I520-C522 VanDerWaalsContact CG2-SG 3.52Å
523	K	88.2	Confident	64.8	Low	27 Å²	27	85.2 Å²	85.2	12%	0.117	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	126.6	160.7	-164.2	47.7	160.4	-94.2	0	110.5	E448 I449 I475 H487 I489 L490 M525	E448-K523 WeakPolarHBondContact CA-O 3.42Å; I449-K523 PolarHBondContact N-O 3.11Å; I449-K523 PolarHBondContact O-N 3.25Å; I475-K523 HydrophobicContact CD1-CB 3.98Å; I475-K523 HydrophobicContact CD1-CG 4.27Å; H487-K523 VanDerWaalsContact C-NZ 3.35Å; H487-K523 WeakPolarHBondContact O-CE 3.46Å; H487-K523 PolarHBondContact O-NZ 2.89Å; I489-K523 PolarHBondContact O-NZ 2.91Å; L490-K523 HydrophobicContact CD1-CB 4.01Å; L490-K523 HydrophobicContact CG-CB 3.94Å; K523-M525 HydrophobicContact CG-CE 3.89Å; K523-M525 HydrophobicContact CG-CG 4.43Å
524	T	85	Confident	65.8	Low	65 Å²	65	86.1 Å²	86.1	40%	0.399	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131	174.2	-31.6	0	0	0	0	108.3	L446 L447 E448	L446-T524 HydrophobicContact CD1-CG2 3.69Å; L446-T524 HydrophobicContact CD2-CG2 4.34Å; L446-T524 HydrophobicContact CG-CG2 4.03Å; L447-T524 CarbonylContact O-C 3.6Å; L447-T524 WeakPolarHBondContact O-CA 3.23Å; E448-T524 HydrophobicContact CB-CG2 4.26Å; E448-T524 PolarHBondContact OE1-OG1 3.07Å
525	M	80.8	Confident	67.1	Low	7 Å²	7	79.6 Å²	79.6	3%	0.034	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.2	179.3	-67	176.9	178.8	0	0	109.8	L446 L447 I475 K523 P535 C536 L538	L446-M525 WeakPolarHBondContact CA-O 3.27Å; L447-M525 PolarHBondContact N-O 3.1Å; L447-M525 PolarHBondContact O-N 3.25Å; I475-M525 HydrophobicContact CB-CE 4.31Å; I475-M525 HydrophobicContact CD1-CE 3.48Å; I475-M525 VanDerWaalsContact CD1-CE 3.48Å; I475-M525 HydrophobicContact CD1-SD 4.34Å; I475-M525 HydrophobicContact CG2-CE 4.47Å; K523-M525 HydrophobicContact CG-CE 3.89Å; K523-M525 HydrophobicContact CG-CG 4.43Å; M525-P535 HydrophobicContact SD-CB 4.49Å; M525-P535 HydrophobicContact SD-CG 4.13Å; M525-C536 HydrophobicContact CE-CB 4.21Å; M525-C536 WeakPolarHBondContact CE-SG 3.33Å; M525-L538 HydrophobicContact SD-CD1 3.7Å
526	D	79	Confident	68.6	Low	30 Å²	30	76.1 Å²	76.1	16%	0.16	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	100	174.6	-177.1	-23.2	0	0	0	109.2	H445 L446 R528 K529	H445-D526 IonicContact CD2-OD1 2.74Å; H445-D526 IonicContact CD2-OD2 3.32Å; H445-D526 VanDerWaalsContact O-CA 3.3Å; H445-D526 WeakPolarHBondContact O-CA 3.47Å; L446-D526 HydrophobicContact CD1-CB 4.24Å; D526-R528 PolarHBondContact O-N 2.93Å; D526-R528 VanDerWaalsContact O-N 3.17Å; D526-R528 PolarHBondContact OD1-N 2.9Å; D526-R528 VanDerWaalsContact OD1-N 3.1Å; D526-K529 HydrophobicContact CB-CB 4.44Å; D526-K529 HydrophobicContact CB-CD 4.31Å; D526-K529 HydrophobicContact CB-CG 4.28Å; D526-K529 PolarHBondContact O-N 2.81Å; D526-K529 VanDerWaalsContact O-N 3.1Å; D526-K529 IonicContact OD2-NZ 3.75Å; D526-K529 PolarHBondContact OD2-NZ 3.43Å
527	W	70.5	Confident	69.7	Low	93 Å²	93	72.3 Å²	72.3	35%	0.352	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-17.8	-171.4	74.9	-103.9	0	0	0	113.1	H445 K529 Y549	H445-W527 PolarHBondContact O-N 3.32Å; H445-W527 VanDerWaalsContact O-N 3.15Å; W527-K529 VanDerWaalsContact C-N 3.34Å; W527-Y549 AromaticContact CD1-CE1 3.91Å; W527-Y549 AromaticContact CD1-CZ 3.96Å; W527-Y549 PolarHBondContact NE1-OH 2.81Å
528	R	67.8	Low	71.2	Confident	126 Å²	126	67.6 Å²	67.6	48%	0.475	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-17	176.9	-64.1	-175	-177.5	177.6	3.2	113.1	R444 H445 D526 T531	R444-R528 PolarHBondContact O-NH2 3.4Å; R444-R528 VanDerWaalsContact O-NH2 3.16Å; H445-R528 HydrophobicContact CB-CG 3.88Å; D526-R528 PolarHBondContact O-N 2.93Å; D526-R528 VanDerWaalsContact O-N 3.17Å; D526-R528 PolarHBondContact OD1-N 2.9Å; D526-R528 VanDerWaalsContact OD1-N 3.1Å; R528-T531 WeakPolarHBondContact O-CG2 3.35Å
529	K	64.9	Low	72.2	Confident	165 Å²	165	66.2 Å²	66.2	72%	0.717	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-31.3	174.8	-67.2	-172.2	177.1	96.2	0	112.4	D526 W527 T531	D526-K529 HydrophobicContact CB-CB 4.44Å; D526-K529 HydrophobicContact CB-CD 4.31Å; D526-K529 HydrophobicContact CB-CG 4.28Å; D526-K529 PolarHBondContact O-N 2.81Å; D526-K529 VanDerWaalsContact O-N 3.1Å; D526-K529 IonicContact OD2-NZ 3.75Å; D526-K529 PolarHBondContact OD2-NZ 3.43Å; W527-K529 VanDerWaalsContact C-N 3.34Å; K529-T531 PolarHBondContact O-N 3.15Å
530	D	59	Low	72.7	Confident	58 Å²	58	62.6 Å²	62.6	31%	0.31	32%	0.323	S	S	.	.			trans	-99	75.3	-179.6	-160.1	-12.5	0	0	0	112	T532	D530-T532 PolarHBondContact O-N 3.26Å
531	T	54.6	Low	72.9	Confident	121 Å²	121	63.1 Å²	63.1	74%	0.742	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	8.8	-167.1	58.8	0	0	0	0	115.3	R528 K529	R528-T531 WeakPolarHBondContact O-CG2 3.35Å; K529-T531 PolarHBondContact O-N 3.15Å
532	T	54.3	Low	72.3	Confident	117 Å²	117	70.1 Å²	70.1	72%	0.718	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-24.2	-166.2	68.1	0	0	0	0	115.6	D530	D530-T532 PolarHBondContact O-N 3.26Å
533	K	57.7	Low	71.3	Confident	179 Å²	179	75.7 Å²	75.7	78%	0.778	38%	0.383	S	S	*	.	S	Bend	trans	-167	150.8	168.4	-109.1	164.1	-177.1	177	0	108	P535	K533-P535 WeakPolarHBondContact O-CD 3.49Å
534	I	60.2	Low	70.3	Confident	85 Å²	85	83.6 Å²	83.6	44%	0.436	42%	0.422	S	S	.	.			trans	-63.6	122.1	173.9	-54.5	173.9	0	0	0	108.2	L538 I540	I534-L538 HydrophobicContact CG2-CB 3.83Å; I534-L538 WeakPolarHBondContact CG2-O 3.35Å; I534-I540 HydrophobicContact CD1-CB 4.38Å; I534-I540 HydrophobicContact CD1-CD1 4.29Å; I534-I540 HydrophobicContact CD1-CG1 4.31Å; I534-I540 HydrophobicContact CG1-CD1 4.42Å; I534-I540 HydrophobicContact CG2-CD1 3.69Å; I534-I540 HydrophobicContact CG2-CG1 4.12Å
535	P	68.9	Low	69.5	Low	18 Å²	18	83 Å²	83	12%	0.117	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-64.3	145.5	-176.2	24.5	-33.6	0	0	0	111.2	M525 K533 G537 L538	M525-P535 HydrophobicContact SD-CB 4.49Å; M525-P535 HydrophobicContact SD-CG 4.13Å; K533-P535 WeakPolarHBondContact O-CD 3.49Å; P535-G537 PolarHBondContact O-N 3.39Å; P535-L538 PolarHBondContact O-N 3.29Å
536	C	73.3	Confident	69.2	Low	13 Å²	13	82.7 Å²	82.7	9%	0.088	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	61.9	15.2	169.1	-45.5	0	0	0	0	115.8	I475 T476 C488 M525 L538	I475-C536 HydrophobicContact CB-CB 4.08Å; I475-C536 HydrophobicContact CG2-CB 3.74Å; T476-C536 CarbonylContact C-O 3.57Å; T476-C536 WeakPolarHBondContact CA-O 3.45Å; C488-C536 WeakPolarHBondContact CA-SG 3.28Å; C488-C536 HydrophobicContact CB-CB 3.81Å; C488-C536 WeakPolarHBondContact CB-SG 3.35Å; C488-C536 WeakPolarHBondContact SG-CA 3.24Å; C488-C536 WeakPolarHBondContact SG-CB 3.16Å; C488-C536 CovalentContact SG-SG 2.02Å; C488-C536 PolarHBondContact SG-SG 2.98Å; M525-C536 HydrophobicContact CE-CB 4.21Å; M525-C536 WeakPolarHBondContact CE-SG 3.33Å; C536-L538 VanDerWaalsContact C-N 3.26Å; C536-L538 PolarHBondContact O-N 3.23Å
537	G	70.4	Confident	69.2	Low	30 Å²	30	82 Å²	82	31%	0.309	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	70.6	16.7	178.3	0	0	0	0	0	114.5	N477 P535 S539	N477-G537 WeakPolarHBondContact CB-O 3.27Å; P535-G537 PolarHBondContact O-N 3.39Å; G537-S539 PolarHBondContact O-N 3.17Å
538	L	79.5	Confident	69.8	Low	9 Å²	9	79 Å²	79	5%	0.047	41%	0.405	C	S	.	.			trans	-50.7	137.3	171	-65.6	170.6	0	0	0	110.4	L447 I475 M525 I534 P535 C536 F572	L447-L538 HydrophobicContact CD2-CD1 3.64Å; L447-L538 HydrophobicContact CD2-CD2 4.23Å; I475-L538 HydrophobicContact CG2-CD2 3.67Å; I475-L538 HydrophobicContact CG2-CG 4.16Å; M525-L538 HydrophobicContact SD-CD1 3.7Å; I534-L538 HydrophobicContact CG2-CB 3.83Å; I534-L538 WeakPolarHBondContact CG2-O 3.35Å; P535-L538 PolarHBondContact O-N 3.29Å; C536-L538 VanDerWaalsContact C-N 3.26Å; C536-L538 PolarHBondContact O-N 3.23Å; L538-F572 HydrophobicContact CD2-CE2 3.78Å; L538-F572 HydrophobicContact CD2-CZ 3.6Å
539	S	80.5	Confident	70.6	Confident	64 Å²	64	73.2 Å²	73.2	45%	0.448	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	112.8	170.2	176.8	0	0	0	0	108.5	G537 T550	G537-S539 PolarHBondContact O-N 3.17Å; S539-T550 WeakPolarHBondContact CB-OG1 3.45Å; S539-T550 PolarHBondContact N-O 3.33Å; S539-T550 PolarHBondContact O-N 3.21Å; S539-T550 PolarHBondContact O-OG1 2.82Å
540	I	80.1	Confident	71.5	Confident	42 Å²	42	66.9 Å²	66.9	22%	0.215	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.1	177.8	-53.2	175.7	0	0	0	107.2	I534 D547 L548 Y549	I534-I540 HydrophobicContact CD1-CB 4.38Å; I534-I540 HydrophobicContact CD1-CD1 4.29Å; I534-I540 HydrophobicContact CD1-CG1 4.31Å; I534-I540 HydrophobicContact CG1-CD1 4.42Å; I534-I540 HydrophobicContact CG2-CD1 3.69Å; I534-I540 HydrophobicContact CG2-CG1 4.12Å; I540-D547 HydrophobicContact CG2-CB 4.36Å; I540-L548 WeakPolarHBondContact CA-O 3.21Å; I540-Y549 HydrophobicContact CD1-CD1 4.02Å; I540-Y549 HydrophobicContact CD1-CE1 3.87Å; I540-Y549 HydrophobicContact CG1-CD1 3.85Å; I540-Y549 HydrophobicContact CG1-CE1 4.13Å; I540-Y549 HydrophobicContact CG2-CD1 4.37Å; I540-Y549 HydrophobicContact CG2-CE1 4.22Å
541	T	79.5	Confident	72.7	Confident	51 Å²	51	64.3 Å²	64.3	31%	0.313	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.7	-179.3	42.8	0	0	0	0	109.9	Y543 L548	T541-Y543 WeakPolarHBondContact O-CD2 3.47Å; T541-L548 PolarHBondContact N-O 3.38Å; T541-L548 PolarHBondContact O-N 3.3Å; T541-L548 PolarHBondContact OG1-O 3.43Å
542	E	74.2	Confident	74.2	Confident	162 Å²	162	59.9 Å²	59.9	76%	0.757	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	129.3	177.9	-63.7	-175.9	174.7	0	0	110.2
543	Y	69.3	Low	75.7	Confident	127 Å²	127	54.3 Å²	54.3	50%	0.498	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	163.2	170.3	-72.9	-103	0	0	0	110.2	T541 T545 G546 L548	T541-Y543 WeakPolarHBondContact O-CD2 3.47Å; Y543-T545 PolarHBondContact O-N 2.84Å; Y543-G546 WeakPolarHBondContact CB-O 3.48Å; Y543-G546 PolarHBondContact N-O 3.43Å; Y543-G546 PolarHBondContact O-N 3Å; Y543-L548 HydrophobicContact CD2-CB 3.81Å; Y543-L548 HydrophobicContact CE2-CB 3.63Å; Y543-L548 HydrophobicContact CE2-CD2 3.58Å; Y543-L548 HydrophobicContact CE2-CG 4.24Å
544	M	65.7	Low	77	Confident	193 Å²	193	46.1 Å²	46.1	95%	0.951	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-26.7	176.9	-59.3	178.3	75.1	0	0	113.7	N578	M544-N578 PolarHBondContact O-ND2 3.33Å
545	T	69.6	Low	78.2	Confident	52 Å²	52	42.1 Å²	42.1	32%	0.319	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	7	178.8	73	0	0	0	0	113.9	Y543 K575 N577 N578	Y543-T545 PolarHBondContact O-N 2.84Å; T545-K575 WeakPolarHBondContact OG1-CE 3.39Å; T545-K575 PolarHBondContact OG1-NZ 3.05Å; T545-N577 CarbonylContact O-C 3.56Å; T545-N577 WeakPolarHBondContact O-CA 3.33Å; T545-N577 PolarHBondContact O-OD1 2.85Å; T545-N578 PolarHBondContact O-N 3.03Å
546	G	74.9	Confident	78.8	Confident	2 Å²	2	41.5 Å²	41.5	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127.8	-178.4	-180	0	0	0	0	0	114.7	Y543 N578	Y543-G546 WeakPolarHBondContact CB-O 3.48Å; Y543-G546 PolarHBondContact N-O 3.43Å; Y543-G546 PolarHBondContact O-N 3Å; G546-N578 PolarHBondContact N-ND2 3.35Å
547	D	78.7	Confident	78.9	Confident	15 Å²	15	41.9 Å²	41.9	8%	0.08	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	135.8	-171.9	-31.5	-31.7	0	0	0	112	I540 Y549 T576	I540-D547 HydrophobicContact CG2-CB 4.36Å; D547-Y549 HydrophobicContact CB-CE2 3.83Å; D547-Y549 PolarHBondContact OD2-OH 3.4Å; D547-T576 PolarHBondContact N-OG1 2.89Å; D547-T576 PolarHBondContact O-N 3.39Å; D547-T576 PolarHBondContact O-OG1 3.43Å
548	L	82.7	Confident	78.9	Confident	31 Å²	31	43.4 Å²	43.4	16%	0.162	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115	166.4	174	69.7	0	0	0	109.8	I540 T541 Y543 T550 K575	I540-L548 WeakPolarHBondContact CA-O 3.21Å; T541-L548 PolarHBondContact N-O 3.38Å; T541-L548 PolarHBondContact O-N 3.3Å; T541-L548 PolarHBondContact OG1-O 3.43Å; Y543-L548 HydrophobicContact CD2-CB 3.81Å; Y543-L548 HydrophobicContact CE2-CB 3.63Å; Y543-L548 HydrophobicContact CE2-CD2 3.58Å; Y543-L548 HydrophobicContact CE2-CG 4.24Å; L548-T550 HydrophobicContact CD1-CG2 4.43Å; L548-T550 HydrophobicContact CD2-CG2 4.17Å; L548-T550 HydrophobicContact CG-CG2 3.98Å; L548-K575 HydrophobicContact CD1-CB 3.94Å
549	Y	84.6	Confident	78.2	Confident	3 Å²	3	45.6 Å²	45.6	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135	171.8	-57.1	-92.4	0	0	0	109.7	C442 L447 W527 I540 D547 T573 C574 T576	C442-Y549 HydrophobicContact CB-CD2 3.86Å; C442-Y549 HydrophobicContact CB-CE2 4.08Å; L447-Y549 HydrophobicContact CB-CD1 4.38Å; L447-Y549 HydrophobicContact CD1-CG 4.14Å; L447-Y549 HydrophobicContact CD2-CD1 4.09Å; L447-Y549 HydrophobicContact CD2-CG 4.33Å; W527-Y549 AromaticContact CD1-CE1 3.91Å; W527-Y549 AromaticContact CD1-CZ 3.96Å; W527-Y549 PolarHBondContact NE1-OH 2.81Å; I540-Y549 HydrophobicContact CD1-CD1 4.02Å; I540-Y549 HydrophobicContact CD1-CE1 3.87Å; I540-Y549 HydrophobicContact CG1-CD1 3.85Å; I540-Y549 HydrophobicContact CG1-CE1 4.13Å; I540-Y549 HydrophobicContact CG2-CD1 4.37Å; I540-Y549 HydrophobicContact CG2-CE1 4.22Å; D547-Y549 HydrophobicContact CB-CE2 3.83Å; D547-Y549 PolarHBondContact OD2-OH 3.4Å; Y549-T573 CarbonylContact O-C 3.6Å; Y549-T573 VanDerWaalsContact O-CA 3.28Å; Y549-T573 WeakPolarHBondContact O-CA 3.31Å; Y549-C574 PolarHBondContact N-O 3.47Å; Y549-C574 PolarHBondContact O-N 2.94Å; Y549-T576 HydrophobicContact CE2-CG2 3.87Å
550	T	84.1	Confident	76.9	Confident	32 Å²	32	50 Å²	50	20%	0.196	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.2	172.5	66.2	0	0	0	0	110.7	S539 L548 F572 T573	S539-T550 WeakPolarHBondContact CB-OG1 3.45Å; S539-T550 PolarHBondContact N-O 3.33Å; S539-T550 PolarHBondContact O-N 3.21Å; S539-T550 PolarHBondContact O-OG1 2.82Å; L548-T550 HydrophobicContact CD1-CG2 4.43Å; L548-T550 HydrophobicContact CD2-CG2 4.17Å; L548-T550 HydrophobicContact CG-CG2 3.98Å; T550-F572 WeakPolarHBondContact CA-O 3.41Å; T550-T573 HydrophobicContact CG2-CG2 3.91Å
551	G	83.7	Confident	75.6	Confident	4 Å²	4	54.2 Å²	54.2	4%	0.041	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.4	-172.4	-178.1	0	0	0	0	0	113.1	F572	G551-F572 PolarHBondContact N-O 2.87Å; G551-F572 VanDerWaalsContact N-O 3.12Å; G551-F572 PolarHBondContact O-N 2.85Å
552	Y	85.3	Confident	74.4	Confident	28 Å²	28	54 Å²	54	11%	0.11	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.5	-178.7	-60.8	-93.5	0	0	0	110.8	I475 T476 L478 L569 F570 Q571 F572	I475-Y552 CarbonylContact C-O 3.58Å; I475-Y552 WeakPolarHBondContact CA-O 3.2Å; T476-Y552 PolarHBondContact N-O 2.92Å; T476-Y552 WeakPolarHBondContact O-CB 3.37Å; T476-Y552 PolarHBondContact O-N 2.82Å; L478-Y552 HydrophobicContact CD1-CE1 4.38Å; L478-Y552 HydrophobicContact CD1-CE2 3.83Å; L478-Y552 HydrophobicContact CD2-CD1 3.97Å; L478-Y552 HydrophobicContact CD2-CD2 4.33Å; L478-Y552 HydrophobicContact CD2-CE1 3.82Å; L478-Y552 HydrophobicContact CD2-CE2 4.22Å; L478-Y552 HydrophobicContact CD2-CG 4.23Å; L478-Y552 HydrophobicContact CG-CD1 4.37Å; L478-Y552 HydrophobicContact CG-CD2 3.86Å; L478-Y552 HydrophobicContact CG-CE1 4.1Å; L478-Y552 HydrophobicContact CG-CE2 3.59Å; L478-Y552 HydrophobicContact CG-CG 4.27Å; Y552-L569 HydrophobicContact CD1-CD1 4.25Å; Y552-L569 HydrophobicContact CD1-CG 4.34Å; Y552-L569 HydrophobicContact CG-CD1 4.49Å; Y552-F570 CarbonylContact C-O 3.52Å; Y552-F570 VanDerWaalsContact CA-O 3.3Å; Y552-F570 WeakPolarHBondContact CA-O 3.36Å; Y552-Q571 HydrophobicContact CD1-CB 3.9Å; Y552-Q571 HydrophobicContact CD1-CG 4.21Å; Y552-Q571 HydrophobicContact CE1-CB 3.6Å; Y552-Q571 HydrophobicContact CE1-CG 3.66Å; Y552-F572 VanDerWaalsContact C-CE1 3.45Å
553	L	87.1	Confident	73.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	116	168	169	65.5	0	0	0	107.3	V438 I449 F451 L474 L490 I555 F570 F572	V438-L553 HydrophobicContact CG1-CD2 3.75Å; V438-L553 HydrophobicContact CG2-CD2 3.93Å; I449-L553 HydrophobicContact CG2-CD2 4.12Å; F451-L553 HydrophobicContact CB-CD2 4.25Å; L474-L553 WeakPolarHBondContact O-CA 3.24Å; L490-L553 HydrophobicContact CD1-CD1 3.71Å; L490-L553 HydrophobicContact CD2-CD1 3.76Å; L490-L553 HydrophobicContact CG-CD1 4.42Å; L553-I555 HydrophobicContact CD1-CD1 3.93Å; L553-I555 HydrophobicContact CD2-CD1 4.27Å; L553-I555 HydrophobicContact CG-CD1 3.94Å; L553-F570 HydrophobicContact CB-CB 4.33Å; L553-F570 HydrophobicContact CD2-CD2 4.13Å; L553-F570 HydrophobicContact CG-CD2 4.28Å; L553-F570 PolarHBondContact N-O 2.92Å; L553-F570 PolarHBondContact O-N 2.76Å; L553-F572 HydrophobicContact CB-CD1 4.24Å; L553-F572 HydrophobicContact CB-CE1 4.16Å
554	A	84.2	Confident	73.1	Confident	7 Å²	7	45.3 Å²	45.3	6%	0.058	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130	176.4	0	0	0	0	0	110	A473 L474 T476 L568 L569	A473-A554 WeakPolarHBondContact CA-O 3.35Å; L474-A554 HydrophobicContact CD1-CB 4.36Å; L474-A554 HydrophobicContact CG-CB 4.34Å; L474-A554 PolarHBondContact N-O 2.93Å; L474-A554 PolarHBondContact O-N 3.13Å; T476-A554 HydrophobicContact CG2-CB 4.09Å; A554-L568 CarbonylContact C-O 3.55Å; A554-L568 WeakPolarHBondContact CA-O 3.36Å; A554-L569 HydrophobicContact CB-CD1 4.05Å
555	I	85.3	Confident	72.8	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	98.3	172.5	-42.1	-61.9	0	0	0	107.7	F451 L462 I472 A473 L553 T557 D567 L568 F570	F451-I555 HydrophobicContact CD1-CD1 3.7Å; F451-I555 HydrophobicContact CD1-CG1 4.42Å; F451-I555 HydrophobicContact CE1-CD1 3.76Å; F451-I555 HydrophobicContact CE1-CG1 4Å; F451-I555 HydrophobicContact CE1-CG2 4.12Å; F451-I555 HydrophobicContact CE2-CG1 4.45Å; F451-I555 HydrophobicContact CG-CD1 4.09Å; F451-I555 HydrophobicContact CZ-CD1 4.2Å; F451-I555 HydrophobicContact CZ-CG1 4.01Å; L462-I555 HydrophobicContact CD1-CG2 4.02Å; L462-I555 HydrophobicContact CD2-CG2 4.31Å; I472-I555 CarbonylContact O-C 3.47Å; I472-I555 WeakPolarHBondContact O-CA 3.37Å; A473-I555 HydrophobicContact CB-CD1 3.51Å; L553-I555 HydrophobicContact CD1-CD1 3.93Å; L553-I555 HydrophobicContact CD2-CD1 4.27Å; L553-I555 HydrophobicContact CG-CD1 3.94Å; I555-T557 PolarHBondContact O-N 3.46Å; I555-D567 WeakPolarHBondContact O-CA 3.31Å; I555-L568 HydrophobicContact CB-CB 4.03Å; I555-L568 HydrophobicContact CG1-CB 4.07Å; I555-L568 PolarHBondContact N-O 2.99Å; I555-L568 PolarHBondContact O-N 3.44Å; I555-F570 HydrophobicContact CG1-CD2 4.42Å; I555-F570 HydrophobicContact CG1-CE2 3.99Å
556	I	81.5	Confident	72.6	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.026	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	112.6	172.6	-60.2	172.3	0	0	0	106.9	S471 I472 L474 F484 N558 R562	S471-I556 CarbonylContact C-O 3.44Å; S471-I556 WeakPolarHBondContact CA-O 3.49Å; S471-I556 WeakPolarHBondContact CB-O 3.41Å; I472-I556 PolarHBondContact N-O 3.06Å; I472-I556 PolarHBondContact O-N 3.18Å; L474-I556 HydrophobicContact CD2-CD1 3.92Å; F484-I556 HydrophobicContact CE1-CD1 4.19Å; F484-I556 HydrophobicContact CZ-CD1 4.38Å; I556-N558 WeakPolarHBondContact CG2-O 3.36Å; I556-R562 HydrophobicContact CG2-CG 4.29Å
557	T	76	Confident	72.6	Confident	21 Å²	21	40.9 Å²	40.9	13%	0.129	20%	0.195	C	C	.	.	S	Bend	trans	-74.8	-33	-174.8	57.7	0	0	0	0	112.8	Y459 L462 S471 I555 I566 D567	Y459-T557 HydrophobicContact CD1-CG2 4.35Å; Y459-T557 HydrophobicContact CE1-CG2 3.98Å; L462-T557 HydrophobicContact CD1-CG2 4.26Å; S471-T557 WeakPolarHBondContact CB-O 3.41Å; S471-T557 PolarHBondContact OG-O 3.3Å; I555-T557 PolarHBondContact O-N 3.46Å; T557-I566 HydrophobicContact CG2-CG2 3.85Å; T557-D567 PolarHBondContact N-OD1 2.81Å; T557-D567 PolarHBondContact OG1-OD1 3.37Å
558	N	69.3	Low	72.6	Confident	63 Å²	63	40.5 Å²	40.5	34%	0.337	19%	0.193	S	C	.	.			trans	-137.1	122.1	172.6	-175.6	-6.9	0	0	0	111	I556 E560 Y561	I556-N558 WeakPolarHBondContact CG2-O 3.36Å; N558-E560 VanDerWaalsContact C-N 3.35Å; N558-E560 WeakPolarHBondContact OD1-CB 3.42Å; N558-E560 PolarHBondContact OD1-N 2.96Å; N558-Y561 CarbonylContact O-C 3.57Å; N558-Y561 VanDerWaalsContact O-O 3.05Å
559	Q	64.8	Low	72.4	Confident	55 Å²	55	39.2 Å²	39.2	26%	0.257	19%	0.186	S	C	.	.	S	Bend	trans	-68.1	-30.2	177.1	-72.6	175.3	37.7	0	0	113.4	H469 R470 S471 I472 Y561 W606	H469-Q559 VanDerWaalsContact C-NE2 3.28Å; H469-Q559 PolarHBondContact O-NE2 2.78Å; R470-Q559 WeakPolarHBondContact O-CG 3.49Å; R470-Q559 PolarHBondContact O-N 2.87Å; S471-Q559 PolarHBondContact O-NE2 3.46Å; S471-Q559 VanDerWaalsContact O-NE2 3.09Å; I472-Q559 HydrophobicContact CD1-CG 3.78Å; I472-Q559 HydrophobicContact CG1-CG 3.65Å; Q559-Y561 VanDerWaalsContact C-N 3.3Å; Q559-Y561 PolarHBondContact O-N 3.05Å; Q559-W606 HydrophobicContact CB-CH2 4.23Å; Q559-W606 HydrophobicContact CG-CH2 4.4Å
560	E	53.9	Low	72.2	Confident	155 Å²	155	39.1 Å²	39.1	72%	0.724	19%	0.186	S	C	*	.	S	Bend	trans	-74	-24.3	-178.7	-61	-172.2	-173.4	0	0	112.5	N558 R841	N558-E560 VanDerWaalsContact C-N 3.35Å; N558-E560 WeakPolarHBondContact OD1-CB 3.42Å; N558-E560 PolarHBondContact OD1-N 2.96Å; E560-R841 PolarHBondContact O-NH2 2.78Å
561	Y	52.5	Low	72.1	Confident	132 Å²	132	39.3 Å²	39.3	52%	0.518	18%	0.184	S	C	.	.	S	Bend	trans	-155.4	110.5	-176.9	173.4	-106.7	0	0	0	110.2	N558 Q559 N563	N558-Y561 CarbonylContact O-C 3.57Å; N558-Y561 VanDerWaalsContact O-O 3.05Å; Q559-Y561 VanDerWaalsContact C-N 3.3Å; Q559-Y561 PolarHBondContact O-N 3.05Å; Y561-N563 HydrophobicContact CD1-CB 4.34Å; Y561-N563 HydrophobicContact CE1-CB 3.84Å; Y561-N563 PolarHBondContact O-N 3.05Å
562	R	54.8	Low	72.2	Confident	46 Å²	46	39.1 Å²	39.1	17%	0.174	18%	0.183	C	C	.	.			trans	-69.8	118.7	168.7	-73.8	-173.6	178.9	164.9	1.8	109.6	I480 I556	I480-R562 PolarHBondContact O-NH1 2.94Å; I480-R562 PolarHBondContact O-NH2 3.02Å; I556-R562 HydrophobicContact CG2-CG 4.29Å
563	N	58.7	Low	72.2	Confident	33 Å²	33	39 Å²	39	18%	0.176	19%	0.185	C	C	.	.			trans	-101.9	109.3	161.9	-176.3	-33	0	0	0	107.5	Y561 E565 I566 D567	Y561-N563 HydrophobicContact CD1-CB 4.34Å; Y561-N563 HydrophobicContact CE1-CB 3.84Å; Y561-N563 PolarHBondContact O-N 3.05Å; N563-E565 PolarHBondContact O-N 3.27Å; N563-E565 PolarHBondContact OD1-N 2.91Å; N563-E565 PolarHBondContact OD1-OE2 2.78Å; N563-I566 HydrophobicContact CB-CB 4.24Å; N563-I566 HydrophobicContact CB-CD1 4.17Å; N563-I566 HydrophobicContact CB-CG1 4.18Å; N563-I566 WeakPolarHBondContact ND2-CD1 3.36Å; N563-I566 PolarHBondContact O-N 3.46Å; N563-I566 VanDerWaalsContact O-N 3.14Å; N563-I566 PolarHBondContact OD1-N 2.77Å; N563-D567 VanDerWaalsContact O-CB 3.25Å; N563-D567 WeakPolarHBondContact O-CB 3.25Å; N563-D567 PolarHBondContact O-N 2.82Å
564	H	57.8	Low	72.1	Confident	73 Å²	73	39.1 Å²	39.1	34%	0.338	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.6	-176.3	-73	-62.8	0	0	0	114.9
565	E	58.4	Low	72	Confident	92 Å²	92	43.4 Å²	43.4	43%	0.43	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-4.7	-179.8	-60.3	117.4	-179.9	0	0	113.3	W286 N563	W286-E565 WeakPolarHBondContact CB-OE2 3.24Å; W286-E565 VanDerWaalsContact CD1-CD 3.41Å; W286-E565 HydrophobicContact CG-CB 4.39Å; W286-E565 HydrophobicContact CG-CG 4.1Å; N563-E565 PolarHBondContact O-N 3.27Å; N563-E565 PolarHBondContact OD1-N 2.91Å; N563-E565 PolarHBondContact OD1-OE2 2.78Å
566	I	67.1	Low	71.7	Confident	51 Å²	51	43.6 Å²	43.6	26%	0.262	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-35.8	167.6	-52.8	175.8	0	0	0	110.2	Y459 T557 N563 L568	Y459-I566 HydrophobicContact CE1-CG2 3.76Å; Y459-I566 VanDerWaalsContact CE1-O 3.31Å; Y459-I566 WeakPolarHBondContact CE1-O 3.49Å; Y459-I566 PolarHBondContact OH-O 2.84Å; T557-I566 HydrophobicContact CG2-CG2 3.85Å; N563-I566 HydrophobicContact CB-CB 4.24Å; N563-I566 HydrophobicContact CB-CD1 4.17Å; N563-I566 HydrophobicContact CB-CG1 4.18Å; N563-I566 WeakPolarHBondContact ND2-CD1 3.36Å; N563-I566 PolarHBondContact O-N 3.46Å; N563-I566 VanDerWaalsContact O-N 3.14Å; N563-I566 PolarHBondContact OD1-N 2.77Å; I566-L568 PolarHBondContact O-N 2.88Å
567	D	73.7	Confident	71.2	Confident	12 Å²	12	46.1 Å²	46.1	6%	0.064	22%	0.218	C	C	.	.	S	Bend	trans	-62.5	122.7	175.1	-70.9	-11.6	0	0	0	111.4	I555 T557 N563 I593	I555-D567 WeakPolarHBondContact O-CA 3.31Å; T557-D567 PolarHBondContact N-OD1 2.81Å; T557-D567 PolarHBondContact OG1-OD1 3.37Å; N563-D567 VanDerWaalsContact O-CB 3.25Å; N563-D567 WeakPolarHBondContact O-CB 3.25Å; N563-D567 PolarHBondContact O-N 2.82Å; D567-I593 HydrophobicContact CB-CD1 4.41Å
568	L	79.1	Confident	70.5	Confident	6 Å²	6	48 Å²	48	3%	0.031	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	138.4	-174	-57.6	169.4	0	0	0	111.3	N375 F451 I454 Y459 A554 I555 I566 F570	N375-L568 HydrophobicContact CB-CD2 3.72Å; F451-L568 HydrophobicContact CZ-CD1 4.49Å; I454-L568 HydrophobicContact CD1-CD1 3.96Å; Y459-L568 HydrophobicContact CE1-CD1 4.13Å; Y459-L568 HydrophobicContact CE1-CD2 4.36Å; Y459-L568 HydrophobicContact CE1-CG 4.16Å; Y459-L568 VanDerWaalsContact OH-CD2 3.31Å; Y459-L568 WeakPolarHBondContact OH-CD2 3.31Å; A554-L568 CarbonylContact C-O 3.55Å; A554-L568 WeakPolarHBondContact CA-O 3.36Å; I555-L568 HydrophobicContact CB-CB 4.03Å; I555-L568 HydrophobicContact CG1-CB 4.07Å; I555-L568 PolarHBondContact N-O 2.99Å; I555-L568 PolarHBondContact O-N 3.44Å; I566-L568 PolarHBondContact O-N 2.88Å; L568-F570 HydrophobicContact CB-CE2 3.76Å; L568-F570 HydrophobicContact CB-CZ 3.9Å; L568-F570 HydrophobicContact CD1-CE2 4.22Å; L568-F570 HydrophobicContact CD1-CZ 4.01Å; L568-F570 HydrophobicContact CG-CZ 4.41Å
569	L	79.2	Confident	70	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	112.4	176	-177	69.8	0	0	0	111.3	L478 Y552 A554 R591 I593	L478-L569 HydrophobicContact CD2-CD2 4.12Å; Y552-L569 HydrophobicContact CD1-CD1 4.25Å; Y552-L569 HydrophobicContact CD1-CG 4.34Å; Y552-L569 HydrophobicContact CG-CD1 4.49Å; A554-L569 HydrophobicContact CB-CD1 4.05Å; L569-R591 HydrophobicContact CD2-CB 4.47Å; L569-R591 PolarHBondContact O-N 3.1Å; L569-I593 HydrophobicContact CB-CD1 4.19Å; L569-I593 HydrophobicContact CB-CG1 3.94Å; L569-I593 HydrophobicContact CD2-CG1 4.07Å
570	F	80.3	Confident	69.6	Low	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.1	178.9	-54.2	-70.8	0	0	0	110	N375 N376 V438 F451 Y552 L553 I555 L568 V588	N375-F570 HydrophobicContact CB-CE1 4.35Å; N375-F570 WeakPolarHBondContact O-CZ 3.03Å; N376-F570 HydrophobicContact CB-CD1 3.93Å; N376-F570 HydrophobicContact CB-CE1 3.78Å; V438-F570 HydrophobicContact CG2-CB 4.41Å; V438-F570 HydrophobicContact CG2-CD1 4.19Å; V438-F570 HydrophobicContact CG2-CD2 3.56Å; V438-F570 HydrophobicContact CG2-CE1 4.34Å; V438-F570 HydrophobicContact CG2-CE2 3.71Å; V438-F570 HydrophobicContact CG2-CG 3.79Å; V438-F570 HydrophobicContact CG2-CZ 4.1Å; F451-F570 HydrophobicContact CE2-CE2 4.13Å; Y552-F570 CarbonylContact C-O 3.52Å; Y552-F570 VanDerWaalsContact CA-O 3.3Å; Y552-F570 WeakPolarHBondContact CA-O 3.36Å; L553-F570 HydrophobicContact CB-CB 4.33Å; L553-F570 HydrophobicContact CD2-CD2 4.13Å; L553-F570 HydrophobicContact CG-CD2 4.28Å; L553-F570 PolarHBondContact N-O 2.92Å; L553-F570 PolarHBondContact O-N 2.76Å; I555-F570 HydrophobicContact CG1-CD2 4.42Å; I555-F570 HydrophobicContact CG1-CE2 3.99Å; L568-F570 HydrophobicContact CB-CE2 3.76Å; L568-F570 HydrophobicContact CB-CZ 3.9Å; L568-F570 HydrophobicContact CD1-CE2 4.22Å; L568-F570 HydrophobicContact CD1-CZ 4.01Å; L568-F570 HydrophobicContact CG-CZ 4.41Å; F570-V588 HydrophobicContact CB-CG1 3.89Å; F570-V588 HydrophobicContact CD1-CG1 4.44Å; F570-V588 HydrophobicContact CG-CG1 4.46Å
571	Q	81.4	Confident	69.5	Low	36 Å²	36	49 Å²	49	17%	0.168	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	137.9	162.6	-172.8	-172.8	-5.6	0	0	108.5	Y552 V588 F589 R591	Y552-Q571 HydrophobicContact CD1-CB 3.9Å; Y552-Q571 HydrophobicContact CD1-CG 4.21Å; Y552-Q571 HydrophobicContact CE1-CB 3.6Å; Y552-Q571 HydrophobicContact CE1-CG 3.66Å; Q571-V588 WeakPolarHBondContact O-CA 3.42Å; Q571-F589 PolarHBondContact N-O 3.32Å; Q571-F589 PolarHBondContact O-N 3.2Å; Q571-R591 HydrophobicContact CB-CG 4.27Å
572	F	85.6	Confident	69.5	Low	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	152.6	167.9	58.7	-98.8	0	0	0	112.2	V440 L447 I449 I475 L538 T550 G551 Y552 L553 Q587 V588	V440-F572 HydrophobicContact CG1-CD2 4.36Å; V440-F572 HydrophobicContact CG2-CB 3.75Å; V440-F572 HydrophobicContact CG2-CG 4.02Å; L447-F572 HydrophobicContact CD2-CE2 4.38Å; I449-F572 HydrophobicContact CD1-CD1 4.48Å; I449-F572 HydrophobicContact CD1-CD2 4.39Å; I449-F572 HydrophobicContact CD1-CE1 3.76Å; I449-F572 HydrophobicContact CD1-CE2 3.68Å; I449-F572 HydrophobicContact CD1-CZ 3.32Å; I449-F572 HydrophobicContact CG1-CE1 4.41Å; I449-F572 HydrophobicContact CG1-CE2 4.4Å; I449-F572 HydrophobicContact CG1-CZ 4.27Å; I475-F572 HydrophobicContact CG2-CZ 4.16Å; L538-F572 HydrophobicContact CD2-CE2 3.78Å; L538-F572 HydrophobicContact CD2-CZ 3.6Å; T550-F572 WeakPolarHBondContact CA-O 3.41Å; G551-F572 PolarHBondContact N-O 2.87Å; G551-F572 VanDerWaalsContact N-O 3.12Å; G551-F572 PolarHBondContact O-N 2.85Å; Y552-F572 VanDerWaalsContact C-CE1 3.45Å; L553-F572 HydrophobicContact CB-CD1 4.24Å; L553-F572 HydrophobicContact CB-CE1 4.16Å; F572-Q587 CarbonylContact C-O 3.54Å; F572-Q587 WeakPolarHBondContact CA-O 3.12Å; F572-V588 HydrophobicContact CB-CG2 4.27Å
573	T	84.4	Confident	69.5	Low	27 Å²	27	52.4 Å²	52.4	17%	0.166	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.5	170	69.1	0	0	0	0	109.2	Y549 T550 G586 Q587	Y549-T573 CarbonylContact O-C 3.6Å; Y549-T573 VanDerWaalsContact O-CA 3.28Å; Y549-T573 WeakPolarHBondContact O-CA 3.31Å; T550-T573 HydrophobicContact CG2-CG2 3.91Å; T573-G586 CarbonylContact O-C 3.5Å; T573-G586 WeakPolarHBondContact O-CA 3.47Å; T573-Q587 PolarHBondContact N-O 3.03Å; T573-Q587 PolarHBondContact O-N 3.05Å
574	C	85.7	Confident	69.5	Low	2 Å²	2	53.1 Å²	53.1	1%	0.014	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	122.2	175.1	-166	0	0	0	0	110.7	V440 C442 L447 Y549 I584	V440-C574 HydrophobicContact CG1-CB 4.02Å; C442-C574 HydrophobicContact CB-CB 3.77Å; C442-C574 WeakPolarHBondContact CB-SG 3.47Å; C442-C574 PolarHBondContact N-SG 3.19Å; C442-C574 WeakPolarHBondContact SG-CB 3.38Å; C442-C574 CovalentContact SG-SG 2.04Å; C442-C574 PolarHBondContact SG-SG 2.81Å; L447-C574 HydrophobicContact CD1-CB 4.49Å; Y549-C574 PolarHBondContact N-O 3.47Å; Y549-C574 PolarHBondContact O-N 2.94Å; C574-I584 PolarHBondContact SG-O 3.31Å; C574-I584 VanDerWaalsContact SG-O 3.37Å
575	K	82.6	Confident	69.7	Low	97 Å²	97	53.7 Å²	53.7	42%	0.422	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.3	-178.9	-175.2	-179.9	174.9	-173.8	0	110.1	T545 L548 I584	T545-K575 WeakPolarHBondContact OG1-CE 3.39Å; T545-K575 PolarHBondContact OG1-NZ 3.05Å; L548-K575 HydrophobicContact CD1-CB 3.94Å; K575-I584 WeakPolarHBondContact O-CD1 3.13Å; K575-I584 WeakPolarHBondContact O-CG2 3.42Å
576	T	79.4	Confident	69.8	Low	5 Å²	5	50 Å²	50	3%	0.031	27%	0.265	C	S	.	.			trans	-88.6	158.9	169.9	61.1	0	0	0	0	111.4	C442 D547 Y549	C442-T576 HydrophobicContact CB-CG2 3.83Å; D547-T576 PolarHBondContact N-OG1 2.89Å; D547-T576 PolarHBondContact O-N 3.39Å; D547-T576 PolarHBondContact O-OG1 3.43Å; Y549-T576 HydrophobicContact CE2-CG2 3.87Å
577	N	70.2	Confident	70	Confident	57 Å²	57	53.5 Å²	53.5	31%	0.305	28%	0.28	S	S	.	.			trans	-120	136.2	171.6	-164.5	8.2	0	0	0	110.9	T545 D579 V580 I584	T545-N577 CarbonylContact O-C 3.56Å; T545-N577 WeakPolarHBondContact O-CA 3.33Å; T545-N577 PolarHBondContact O-OD1 2.85Å; N577-D579 VanDerWaalsContact C-N 3.35Å; N577-D579 PolarHBondContact O-N 3.43Å; N577-V580 HydrophobicContact CB-CB 4.21Å; N577-V580 HydrophobicContact CB-CG2 4.15Å; N577-V580 WeakPolarHBondContact ND2-CG2 3.4Å; N577-I584 HydrophobicContact CB-CD1 3.93Å
578	N	60.8	Low	69.6	Low	62 Å²	62	53.7 Å²	53.7	33%	0.332	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-37.2	-177.5	-82.4	-29.3	0	0	0	112.5	M544 T545 G546	M544-N578 PolarHBondContact O-ND2 3.33Å; T545-N578 PolarHBondContact O-N 3.03Å; G546-N578 PolarHBondContact N-ND2 3.35Å
579	D	59.1	Low	68.9	Low	139 Å²	139	58 Å²	58	74%	0.743	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.6	-171.8	-52.4	-50.3	0	0	0	113.6	N577	N577-D579 VanDerWaalsContact C-N 3.35Å; N577-D579 PolarHBondContact O-N 3.43Å
580	V	56.5	Low	68.1	Low	57 Å²	57	60.5 Å²	60.5	35%	0.345	31%	0.311	S	S	.	.			trans	-123.4	110.6	-169.5	-174	0	0	0	0	110.2	N577 H582	N577-V580 HydrophobicContact CB-CB 4.21Å; N577-V580 HydrophobicContact CB-CG2 4.15Å; N577-V580 WeakPolarHBondContact ND2-CG2 3.4Å; V580-H582 HydrophobicContact CG1-CB 3.91Å; V580-H582 PolarHBondContact O-N 3.05Å
581	P	52.1	Low	67	Low	97 Å²	97	65.5 Å²	65.5	63%	0.63	33%	0.33	S	S	*	.			trans	-75	-3.9	-179.9	30.9	-35.6	0	0	0	113.8	Q443	Q443-P581 PolarHBondContact NE2-O 2.96Å
582	H	53.3	Low	65.7	Low	136 Å²	136	69.8 Å²	69.8	63%	0.63	35%	0.354	S	S	*	.	S	Bend	trans	-81	154.8	-178.5	-52.9	-56.9	0	0	0	112.6	V580	V580-H582 HydrophobicContact CG1-CB 3.91Å; V580-H582 PolarHBondContact O-N 3.05Å
583	R	54.6	Low	64.2	Low	113 Å²	113	71.6 Å²	71.6	43%	0.426	36%	0.364	S	S	.	.			trans	-69.8	137.7	177.4	-57.1	176.7	-174	147.7	2.7	109.6	F441 L498	F441-R583 HydrophobicContact CD1-CB 4.44Å; L498-R583 PolarHBondContact O-NH1 2.94Å
584	I	58.1	Low	62.4	Low	48 Å²	48	79.7 Å²	79.7	25%	0.246	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.5	175	-66.8	162.5	0	0	0	108.8	C442 C574 K575 N577	C442-I584 PolarHBondContact N-O 2.85Å; C442-I584 PolarHBondContact O-N 3.39Å; C574-I584 PolarHBondContact SG-O 3.31Å; C574-I584 VanDerWaalsContact SG-O 3.37Å; K575-I584 WeakPolarHBondContact O-CD1 3.13Å; K575-I584 WeakPolarHBondContact O-CG2 3.42Å; N577-I584 HydrophobicContact CB-CD1 3.93Å
585	P	61.4	Low	60.6	Low	85 Å²	85	81.9 Å²	81.9	55%	0.552	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	140.8	173.2	30.6	-34.4	0	0	0	110.7	V440	V440-P585 WeakPolarHBondContact O-CA 3.44Å
586	G	61.9	Low	58.6	Low	16 Å²	16	81 Å²	81	17%	0.165	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-82.9	150.8	172.7	0	0	0	0	0	112.3	V440 T573	V440-G586 PolarHBondContact O-N 3.4Å; T573-G586 CarbonylContact O-C 3.5Å; T573-G586 WeakPolarHBondContact O-CA 3.47Å
587	Q	69.9	Low	56.8	Low	123 Å²	123	85.6 Å²	85.6	58%	0.575	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	134.2	167.7	-64.1	179.2	-22.8	0	0	109.2	F572 T573 F589	F572-Q587 CarbonylContact C-O 3.54Å; F572-Q587 WeakPolarHBondContact CA-O 3.12Å; T573-Q587 PolarHBondContact N-O 3.03Å; T573-Q587 PolarHBondContact O-N 3.05Å; Q587-F589 HydrophobicContact CB-CE2 3.64Å; Q587-F589 HydrophobicContact CB-CZ 3.83Å; Q587-F589 HydrophobicContact CG-CZ 4.46Å
588	V	65.9	Low	55.5	Low	16 Å²	16	86.8 Å²	86.8	10%	0.097	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.7	175.2	-173.8	0	0	0	0	108.8	V438 V440 F570 Q571 F572	V438-V588 HydrophobicContact CB-CG1 4.06Å; V438-V588 HydrophobicContact CB-CG2 4.31Å; V438-V588 HydrophobicContact CG1-CG1 4.09Å; V438-V588 HydrophobicContact CG1-CG2 3.96Å; V440-V588 HydrophobicContact CG2-CG2 3.91Å; F570-V588 HydrophobicContact CB-CG1 3.89Å; F570-V588 HydrophobicContact CD1-CG1 4.44Å; F570-V588 HydrophobicContact CG-CG1 4.46Å; Q571-V588 WeakPolarHBondContact O-CA 3.42Å; F572-V588 HydrophobicContact CB-CG2 4.27Å
589	F	63.9	Low	54.4	Low	97 Å²	97	90.7 Å²	90.7	43%	0.425	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	127.9	177.6	-54.7	-80	0	0	0	108.7	Q571 Q587	Q571-F589 PolarHBondContact N-O 3.32Å; Q571-F589 PolarHBondContact O-N 3.2Å; Q587-F589 HydrophobicContact CB-CE2 3.64Å; Q587-F589 HydrophobicContact CB-CZ 3.83Å; Q587-F589 HydrophobicContact CG-CZ 4.46Å
590	E	62.8	Low	53.7	Low	57 Å²	57	85 Å²	85	27%	0.266	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	143.1	168	-176.7	174.4	-170	0	0	110.6	N375	N375-E590 WeakPolarHBondContact CB-OE1 3.34Å; N375-E590 PolarHBondContact N-OE2 2.85Å; N375-E590 PolarHBondContact ND2-OE1 3.01Å
591	R	57.3	Low	52.9	Low	106 Å²	106	89.1 Å²	89.1	40%	0.4	43%	0.434	S	S	.	.			trans	-130.5	119.6	165.9	-72.9	-157.9	-172.5	-164.1	-1.5	110.9	L569 Q571 I593	L569-R591 HydrophobicContact CD2-CB 4.47Å; L569-R591 PolarHBondContact O-N 3.1Å; Q571-R591 HydrophobicContact CB-CG 4.27Å; R591-I593 PolarHBondContact O-N 2.95Å
592	N	53.8	Low	52.4	Low	126 Å²	126	92 Å²	92	67%	0.674	44%	0.444	S	S	*	.			trans	-52.6	138.4	162.9	-55.6	58.4	0	0	0	109.9	K594	N592-K594 HydrophobicContact CB-CG 4.5Å; N592-K594 PolarHBondContact O-N 3.14Å
593	I	54.2	Low	51.7	Low	38 Å²	38	92.5 Å²	92.5	20%	0.195	45%	0.451	C	S	.	.			trans	-77.2	62.6	-176.9	-45.7	-176	0	0	0	111	D567 L569 R591 V595	D567-I593 HydrophobicContact CB-CD1 4.41Å; L569-I593 HydrophobicContact CB-CD1 4.19Å; L569-I593 HydrophobicContact CB-CG1 3.94Å; L569-I593 HydrophobicContact CD2-CG1 4.07Å; R591-I593 PolarHBondContact O-N 2.95Å; I593-V595 HydrophobicContact CG2-CB 4.26Å; I593-V595 HydrophobicContact CG2-CG2 3.73Å; I593-V595 PolarHBondContact O-N 2.7Å
594	K	47.9	Very low	50.9	Low	196 Å²	196	89.2 Å²	89.2	85%	0.852	45%	0.446	S	S	*	.			trans	-80	46.8	168.6	-65.9	-170.2	175.1	-171.7	0	111.3	N592	N592-K594 HydrophobicContact CB-CG 4.5Å; N592-K594 PolarHBondContact O-N 3.14Å
595	V	46	Very low	50.1	Low	49 Å²	49	90.1 Å²	90.1	30%	0.297	46%	0.455	S	S	.	.			trans	-79.2	136.2	176.5	179.7	0	0	0	0	108.4	I593 R597 L600	I593-V595 HydrophobicContact CG2-CB 4.26Å; I593-V595 HydrophobicContact CG2-CG2 3.73Å; I593-V595 PolarHBondContact O-N 2.7Å; V595-R597 PolarHBondContact O-N 2.7Å; V595-L600 HydrophobicContact CG1-CD1 3.75Å
596	N	41.1	Very low	49	Very low	78 Å²	78	90.3 Å²	90.3	42%	0.417	45%	0.445	S	S	.	.			trans	-65.7	137.3	-175.5	-159.8	7.2	0	0	0	111.1	E309 Q598	E309-N596 PolarHBondContact OE2-ND2 2.89Å; E309-N596 PolarHBondContact OE2-OD1 3.43Å; N596-Q598 VanDerWaalsContact C-N 3.28Å; N596-Q598 PolarHBondContact O-N 2.68Å
597	R	42.1	Very low	48.3	Very low	101 Å²	101	92.4 Å²	92.4	38%	0.381	46%	0.455	S	S	.	.	S	Bend	trans	-76.9	-10.8	-165.3	-74.4	178.3	168.3	141.6	0.1	114.1	D307 N308 L310 V595 L600 F601	D307-R597 PolarHBondContact O-NH1 2.04Å; N308-R597 WeakPolarHBondContact OD1-CD 2.94Å; N308-R597 VanDerWaalsContact OD1-CZ 3.27Å; N308-R597 PolarHBondContact OD1-NE 2.71Å; N308-R597 PolarHBondContact OD1-NH1 2.72Å; L310-R597 HydrophobicContact CD1-CB 4.15Å; V595-R597 PolarHBondContact O-N 2.7Å; R597-L600 WeakPolarHBondContact O-CB 3.39Å; R597-F601 WeakPolarHBondContact O-CD2 3.07Å; R597-F601 WeakPolarHBondContact O-CE2 3.49Å
598	Q	42.1	Very low	47.7	Very low	82 Å²	82	92.6 Å²	92.6	38%	0.383	45%	0.454	S	S	.	.	S	Bend	trans	-76	-47.8	-176.8	-110.4	68.2	-20	0	0	113.5	E309 N596 L600	E309-Q598 VanDerWaalsContact C-NE2 3.33Å; E309-Q598 PolarHBondContact O-NE2 2.98Å; N596-Q598 VanDerWaalsContact C-N 3.28Å; N596-Q598 PolarHBondContact O-N 2.68Å; Q598-L600 PolarHBondContact O-N 3.41Å
599	D	39.4	Very low	47.8	Very low	145 Å²	145	93.3 Å²	93.3	78%	0.775	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	13.4	-172.5	-56.7	-42.4	0	0	0	114
600	L	43.4	Very low	48.3	Very low	18 Å²	18	90.7 Å²	90.7	9%	0.094	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-14.8	-153.3	-138.2	75.3	0	0	0	114.7	Y481 V595 R597 Q598	Y481-L600 WeakPolarHBondContact CD1-O 3.37Å; Y481-L600 HydrophobicContact CD2-CD1 4.44Å; Y481-L600 HydrophobicContact CE1-CD1 4.38Å; Y481-L600 HydrophobicContact CE1-CG 3.95Å; Y481-L600 VanDerWaalsContact CE1-O 3.25Å; Y481-L600 WeakPolarHBondContact CE1-O 3.4Å; Y481-L600 HydrophobicContact CE2-CD1 3.47Å; Y481-L600 VanDerWaalsContact CE2-CD1 3.47Å; Y481-L600 HydrophobicContact CE2-CG 3.97Å; Y481-L600 VanDerWaalsContact CZ-CD1 3.47Å; Y481-L600 VanDerWaalsContact CZ-CG 3.46Å; Y481-L600 VanDerWaalsContact OH-CD1 3.3Å; Y481-L600 WeakPolarHBondContact OH-CD1 3.43Å; Y481-L600 VanDerWaalsContact OH-CG 3.26Å; Y481-L600 WeakPolarHBondContact OH-CG 3.37Å; V595-L600 HydrophobicContact CG1-CD1 3.75Å; R597-L600 WeakPolarHBondContact O-CB 3.39Å; Q598-L600 PolarHBondContact O-N 3.41Å
601	F	40	Very low	49	Very low	144 Å²	144	88 Å²	88	63%	0.632	44%	0.435	S	S	*	.	S	Bend	trans	-119.3	-18.5	-158.9	-73.6	-74.1	0	0	0	116.9	R597	R597-F601 WeakPolarHBondContact O-CD2 3.07Å; R597-F601 WeakPolarHBondContact O-CE2 3.49Å
602	D	41.4	Very low	50.3	Low	157 Å²	157	87.4 Å²	87.4	84%	0.84	44%	0.435	S	S	*	.	S	Bend	trans	-83	-14.5	-165.5	-86.8	-5.7	0	0	0	116.6
603	N	39.4	Very low	51.9	Low	147 Å²	147	82.4 Å²	82.4	79%	0.786	41%	0.408	S	S	*	.	S	Bend	trans	-145.7	26.2	-169	-88.5	-69.6	0	0	0	117
604	S	36	Very low	53.4	Low	44 Å²	44	81.6 Å²	81.6	31%	0.308	41%	0.405	S	S	.	.			trans	-80.5	131.9	179	-167.6	0	0	0	0	113	W606	S604-W606 VanDerWaalsContact C-N 3.26Å; S604-W606 PolarHBondContact O-N 2.85Å; S604-W606 VanDerWaalsContact O-N 3.09Å; S604-W606 VanDerWaalsContact OG-CD1 3.25Å
605	P	41.7	Very low	55.3	Low	67 Å²	67	72.3 Å²	72.3	44%	0.435	36%	0.364	S	S	.	.			trans	-88.7	41.6	-174.8	37.5	-37.8	0	0	0	113.8	K483	K483-P605 HydrophobicContact CB-CG 4.02Å; K483-P605 HydrophobicContact CG-CG 4.15Å
606	W	38.6	Very low	57.1	Low	90 Å²	90	71.5 Å²	71.5	34%	0.341	36%	0.357	S	S	.	.	S	Bend	trans	-98.1	153	170.4	-67.4	120.1	0	0	0	109.2	F484 Q559 S604 K608	F484-W606 HydrophobicContact CD2-CZ2 4.29Å; F484-W606 AromaticContact CE2-CE2 3.62Å; F484-W606 HydrophobicContact CE2-CH2 4.02Å; F484-W606 AromaticContact CE2-CZ2 3.28Å; F484-W606 HydrophobicContact CE2-CZ2 3.28Å; F484-W606 AromaticContact CE2-NE1 3.87Å; F484-W606 AromaticContact CZ-CZ2 3.58Å; F484-W606 HydrophobicContact CZ-CZ2 3.58Å; Q559-W606 HydrophobicContact CB-CH2 4.23Å; Q559-W606 HydrophobicContact CG-CH2 4.4Å; S604-W606 VanDerWaalsContact C-N 3.26Å; S604-W606 PolarHBondContact O-N 2.85Å; S604-W606 VanDerWaalsContact O-N 3.09Å; S604-W606 VanDerWaalsContact OG-CD1 3.25Å; W606-K608 PolarHBondContact O-N 3.5Å
607	P	47	Very low	59.2	Low	59 Å²	59	69.2 Å²	69.2	38%	0.383	34%	0.344	S	S	.	.			trans	-56.4	129.1	-179.5	23.1	-34.6	0	0	0	111	L609 E641 L642	P607-L609 PolarHBondContact O-N 2.75Å; P607-E641 WeakPolarHBondContact CA-OE2 3.21Å; P607-E641 HydrophobicContact CB-CB 4.31Å; P607-L642 HydrophobicContact CB-CD1 4.04Å; P607-L642 HydrophobicContact CB-CD2 4.29Å; P607-L642 HydrophobicContact CB-CG 3.72Å; P607-L642 HydrophobicContact CG-CD1 3.72Å; P607-L642 HydrophobicContact CG-CG 4Å
608	K	57.1	Low	61.1	Low	128 Å²	128	70.5 Å²	70.5	56%	0.557	36%	0.355	S	S	*	.			trans	-71.7	98.3	-176.6	-62.1	177.3	-165.2	151.9	0	110.1	W606 I639 D640 E641	W606-K608 PolarHBondContact O-N 3.5Å; K608-I639 HydrophobicContact CB-CG2 4.26Å; K608-I639 CarbonylContact O-C 3.54Å; K608-D640 WeakPolarHBondContact O-CA 3.16Å; K608-E641 HydrophobicContact CB-CG 4.08Å; K608-E641 WeakPolarHBondContact CD-OE1 3.48Å; K608-E641 PolarHBondContact N-OE2 2.69Å; K608-E641 IonicContact NZ-OE1 3.78Å; K608-E641 PolarHBondContact O-N 3.38Å
609	L	68.9	Low	62.9	Low	30 Å²	30	71.8 Å²	71.8	16%	0.157	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.4	154.7	-176.4	71.7	0	0	0	108.3	P607 L638 I639 D640 Y645 I808 R841 I843	P607-L609 PolarHBondContact O-N 2.75Å; L609-L638 HydrophobicContact CD1-CD1 3.98Å; L609-I639 CarbonylContact C-O 3.33Å; L609-I639 VanDerWaalsContact CA-O 3.3Å; L609-I639 WeakPolarHBondContact CA-O 3.32Å; L609-D640 HydrophobicContact CD1-CB 3.82Å; L609-Y645 HydrophobicContact CD1-CD2 3.51Å; L609-Y645 HydrophobicContact CD1-CE2 4.18Å; L609-Y645 HydrophobicContact CD1-CG 3.92Å; L609-Y645 HydrophobicContact CD2-CD2 3.79Å; L609-Y645 HydrophobicContact CD2-CE1 4.48Å; L609-Y645 HydrophobicContact CD2-CE2 3.6Å; L609-Y645 HydrophobicContact CD2-CG 4.34Å; L609-Y645 HydrophobicContact CG-CD2 4.27Å; L609-Y645 HydrophobicContact CG-CE2 4.48Å; L609-I808 HydrophobicContact CD1-CG2 4.49Å; L609-R841 HydrophobicContact CD2-CB 4.5Å; L609-R841 HydrophobicContact CD2-CG 4.5Å; L609-I843 HydrophobicContact CG-CD1 4.39Å
610	D	73.9	Confident	64.8	Low	42 Å²	42	66 Å²	66	23%	0.225	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	163.8	-179.7	-159.7	-1.4	0	0	0	111.5	I639 R845	D610-I639 HydrophobicContact CB-CB 4.34Å; D610-I639 PolarHBondContact N-O 3.35Å; D610-I639 PolarHBondContact O-N 2.84Å; D610-R845 IonicContact OD1-CZ 2.88Å; D610-R845 IonicContact OD1-NE 2.96Å; D610-R845 PolarHBondContact OD1-NE 2.93Å; D610-R845 IonicContact OD1-NH2 3.11Å; D610-R845 PolarHBondContact OD1-NH2 3.49Å; D610-R845 IonicContact OD2-CZ 3.9Å; D610-R845 IonicContact OD2-NE 2.7Å; D610-R845 IonicContact OD2-NH2 2.72Å; D610-R845 PolarHBondContact OD2-NH2 2.9Å
611	V	78.3	Confident	66.6	Low	0 Å²	0	70 Å²	70	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.5	166.1	179.8	0	0	0	0	108.5	F613 A636 E637 L638 V648 F806 I808 I843 R845	V611-F613 PolarHBondContact O-N 3.34Å; V611-A636 HydrophobicContact CG1-CB 3.88Å; V611-E637 CarbonylContact C-O 3.59Å; V611-E637 WeakPolarHBondContact CA-O 3.24Å; V611-L638 HydrophobicContact CG2-CD1 4.25Å; V611-V648 HydrophobicContact CG2-CG2 3.98Å; V611-F806 HydrophobicContact CB-CD2 4.37Å; V611-F806 HydrophobicContact CB-CG 4.38Å; V611-F806 HydrophobicContact CG1-CD1 4Å; V611-F806 HydrophobicContact CG1-CD2 4.02Å; V611-F806 HydrophobicContact CG1-CE1 4.13Å; V611-F806 HydrophobicContact CG1-CE2 4.15Å; V611-F806 HydrophobicContact CG1-CG 3.95Å; V611-F806 HydrophobicContact CG1-CZ 4.21Å; V611-F806 HydrophobicContact CG2-CB 4.16Å; V611-F806 HydrophobicContact CG2-CG 4.34Å; V611-I808 HydrophobicContact CG2-CD1 3.71Å; V611-I808 HydrophobicContact CG2-CG1 4.21Å; V611-I843 HydrophobicContact CB-CG2 4.39Å; V611-I843 HydrophobicContact CG2-CB 4.45Å; V611-I843 HydrophobicContact CG2-CG2 4.5Å; V611-R845 WeakPolarHBondContact O-CD 3.41Å; V611-R845 VanDerWaalsContact O-CG 3.24Å; V611-R845 WeakPolarHBondContact O-CG 3.14Å; V611-R845 PolarHBondContact O-NE 2.88Å
612	K	84.4	Confident	68.6	Low	95 Å²	95	67.1 Å²	67.1	41%	0.413	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	113.8	172.9	166.6	-179.7	158.5	-150.8	0	108.5	T614 A636 E637 I639	K612-T614 HydrophobicContact CG-CG2 4.45Å; K612-A636 WeakPolarHBondContact O-CA 3.4Å; K612-E637 HydrophobicContact CB-CB 4.25Å; K612-E637 WeakPolarHBondContact CD-OE2 3.27Å; K612-E637 VanDerWaalsContact CE-OE2 3.24Å; K612-E637 WeakPolarHBondContact CE-OE2 3.2Å; K612-E637 PolarHBondContact N-O 3.39Å; K612-E637 VanDerWaalsContact NZ-CD 3.34Å; K612-E637 IonicContact NZ-OE1 3.96Å; K612-E637 PolarHBondContact NZ-OE1 3.42Å; K612-E637 IonicContact NZ-OE2 2.6Å; K612-E637 PolarHBondContact NZ-OE2 3.44Å; K612-E637 PolarHBondContact O-N 2.73Å; K612-I639 HydrophobicContact CB-CD1 3.94Å; K612-I639 HydrophobicContact CB-CG1 4.41Å
613	F	87.2	Confident	70.6	Confident	20 Å²	20	61 Å²	61	9%	0.088	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.2	-176.3	-176.8	-129.9	0	0	0	110.7	V611 F634 A636 F709 C804 F806 R845 I847	V611-F613 PolarHBondContact O-N 3.34Å; F613-F634 HydrophobicContact CE2-CB 3.85Å; F613-F634 HydrophobicContact CE2-CD1 4.28Å; F613-F634 HydrophobicContact CE2-CG 4.09Å; F613-F634 HydrophobicContact CZ-CB 4.33Å; F613-F634 AromaticContact CZ-CD1 3.96Å; F613-F634 HydrophobicContact CZ-CD1 3.96Å; F613-F634 HydrophobicContact CZ-CE1 4.45Å; F613-F634 HydrophobicContact CZ-CG 4.06Å; F613-A636 HydrophobicContact CD2-CB 4.37Å; F613-F709 HydrophobicContact CE2-CZ 4.43Å; F613-C804 HydrophobicContact CE1-CB 4.22Å; F613-C804 HydrophobicContact CE2-CB 4.41Å; F613-C804 HydrophobicContact CZ-CB 4.06Å; F613-C804 WeakPolarHBondContact CZ-SG 3.3Å; F613-F806 HydrophobicContact CB-CE2 4.47Å; F613-F806 HydrophobicContact CD2-CE2 4.22Å; F613-F806 AromaticContact CD2-CZ 3.62Å; F613-F806 HydrophobicContact CD2-CZ 3.62Å; F613-F806 AromaticContact CE2-CZ 3.97Å; F613-F806 HydrophobicContact CE2-CZ 3.97Å; F613-F806 HydrophobicContact CG-CE2 4.3Å; F613-F806 HydrophobicContact CG-CZ 4.16Å; F613-R845 HydrophobicContact CB-CB 3.83Å; F613-R845 HydrophobicContact CD1-CB 4.33Å; F613-R845 HydrophobicContact CG-CB 4.4Å; F613-I847 HydrophobicContact CD1-CB 4.2Å; F613-I847 HydrophobicContact CD1-CG2 3.84Å; F613-I847 HydrophobicContact CE1-CB 4.36Å; F613-I847 HydrophobicContact CE1-CG2 3.53Å; F613-I847 HydrophobicContact CZ-CG2 4.39Å
614	T	86.6	Confident	72.6	Confident	22 Å²	22	59.4 Å²	59.4	14%	0.135	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	148	-177.5	62.3	0	0	0	0	112.4	K612 E635	K612-T614 HydrophobicContact CG-CG2 4.45Å; T614-E635 PolarHBondContact N-O 2.83Å; T614-E635 PolarHBondContact O-N 3.4Å
615	V	85.8	Confident	74.7	Confident	1 Å²	1	61 Å²	61	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.8	164	-168.4	0	0	0	0	108	S622 V623 I632 F634 I847 L849	V615-S622 VanDerWaalsContact O-CA 3.31Å; V615-S622 WeakPolarHBondContact O-CA 3.42Å; V615-V623 HydrophobicContact CB-CG2 4.32Å; V615-V623 HydrophobicContact CG1-CG2 3.98Å; V615-V623 PolarHBondContact O-N 2.82Å; V615-I632 HydrophobicContact CG1-CB 4Å; V615-I632 HydrophobicContact CG1-CD1 3.87Å; V615-I632 HydrophobicContact CG1-CG2 4.25Å; V615-F634 HydrophobicContact CG1-CD1 4.48Å; V615-F634 HydrophobicContact CG1-CE1 4.46Å; V615-F634 HydrophobicContact CG2-CD1 4.01Å; V615-F634 HydrophobicContact CG2-CE1 3.91Å; V615-I847 HydrophobicContact CG2-CD1 4.04Å; V615-I847 HydrophobicContact CG2-CG1 4.3Å; V615-I847 HydrophobicContact CG2-CG2 3.67Å; V615-L849 HydrophobicContact CB-CD1 4.46Å; V615-L849 HydrophobicContact CG1-CD1 4.29Å; V615-L849 HydrophobicContact CG1-CD2 4.4Å; V615-L849 HydrophobicContact CG2-CD1 4.47Å
616	K	85.7	Confident	76.6	Confident	32 Å²	32	58.4 Å²	58.4	14%	0.139	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152.5	177.1	-70.2	179.4	176.1	-173.8	0	112.2	G620 Q621 I632 R633 E635	K616-G620 WeakPolarHBondContact CD-O 3.3Å; K616-Q621 WeakPolarHBondContact CA-O 3.35Å; K616-I632 CarbonylContact O-C 3.56Å; K616-I632 WeakPolarHBondContact O-CA 3.5Å; K616-R633 HydrophobicContact CB-CG 4.19Å; K616-R633 PolarHBondContact N-O 3.12Å; K616-R633 PolarHBondContact O-N 2.93Å; K616-E635 HydrophobicContact CD-CB 4.28Å; K616-E635 WeakPolarHBondContact CD-OE2 3.31Å; K616-E635 WeakPolarHBondContact CE-OE1 3.3Å; K616-E635 WeakPolarHBondContact CE-OE2 3.26Å; K616-E635 IonicContact NZ-OE1 2.7Å; K616-E635 PolarHBondContact NZ-OE1 3.47Å; K616-E635 IonicContact NZ-OE2 3.72Å; K616-E635 PolarHBondContact NZ-OE2 2.85Å
617	D	84.4	Confident	78.6	Confident	29 Å²	29	58.2 Å²	58.2	16%	0.155	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-177	172.4	77.9	-23	0	0	0	112.7	N619 G620 Q621 V623	D617-N619 VanDerWaalsContact CG-N 3.32Å; D617-N619 PolarHBondContact O-N 2.89Å; D617-N619 WeakPolarHBondContact OD1-CA 3.25Å; D617-N619 WeakPolarHBondContact OD1-CB 3.37Å; D617-N619 PolarHBondContact OD1-N 2.82Å; D617-N619 WeakPolarHBondContact OD2-CB 3.24Å; D617-N619 PolarHBondContact OD2-ND2 2.65Å; D617-G620 PolarHBondContact O-N 2.8Å; D617-G620 PolarHBondContact OD1-N 2.65Å; D617-Q621 PolarHBondContact N-O 2.88Å; D617-Q621 PolarHBondContact OD1-N 3.31Å; D617-V623 HydrophobicContact CB-CG1 4.1Å
618	E	81.1	Confident	79.9	Confident	128 Å²	128	57.4 Å²	57.4	60%	0.598	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.7	171.2	60.6	-176.5	-170	0	0	113.7	G620 P631	E618-G620 VanDerWaalsContact C-N 3.33Å; E618-P631 HydrophobicContact CB-CG 4.09Å; E618-P631 HydrophobicContact CG-CG 4.38Å; E618-P631 WeakPolarHBondContact OE2-CG 3.43Å
619	N	81.1	Confident	80.5	Confident	109 Å²	109	54.3 Å²	54.3	58%	0.583	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-2.6	178.1	-54.5	-78.8	0	0	0	113.1	D617 Q621	D617-N619 VanDerWaalsContact CG-N 3.32Å; D617-N619 PolarHBondContact O-N 2.89Å; D617-N619 WeakPolarHBondContact OD1-CA 3.25Å; D617-N619 WeakPolarHBondContact OD1-CB 3.37Å; D617-N619 PolarHBondContact OD1-N 2.82Å; D617-N619 WeakPolarHBondContact OD2-CB 3.24Å; D617-N619 PolarHBondContact OD2-ND2 2.65Å; N619-Q621 VanDerWaalsContact C-N 3.29Å; N619-Q621 HydrophobicContact CB-CG 4.23Å; N619-Q621 PolarHBondContact O-N 2.7Å
620	G	78.3	Confident	80.8	Confident	23 Å²	23	54.9 Å²	54.9	24%	0.237	30%	0.296	C	S	.	.	S	Bend	trans	74.7	12.2	-175.9	0	0	0	0	0	114.9	K616 D617 E618	K616-G620 WeakPolarHBondContact CD-O 3.3Å; D617-G620 PolarHBondContact O-N 2.8Å; D617-G620 PolarHBondContact OD1-N 2.65Å; E618-G620 VanDerWaalsContact C-N 3.33Å
621	Q	81.1	Confident	81.1	Confident	103 Å²	103	53.9 Å²	53.9	48%	0.481	29%	0.293	S	S	.	.			trans	-82.4	140.1	174.4	-57.2	-170.9	30.8	0	0	109.8	K616 D617 N619	K616-Q621 WeakPolarHBondContact CA-O 3.35Å; D617-Q621 PolarHBondContact N-O 2.88Å; D617-Q621 PolarHBondContact OD1-N 3.31Å; N619-Q621 VanDerWaalsContact C-N 3.29Å; N619-Q621 HydrophobicContact CB-CG 4.23Å; N619-Q621 PolarHBondContact O-N 2.7Å
622	S	81.9	Confident	81.3	Confident	84 Å²	84	53.9 Å²	53.9	59%	0.587	29%	0.293	S	S	*	.	B	Isolated β-bridge	trans	-73.6	129.8	179	-58.4	0	0	0	0	110.7	V615	V615-S622 VanDerWaalsContact O-CA 3.31Å; V615-S622 WeakPolarHBondContact O-CA 3.42Å
623	V	83.6	Confident	81.3	Confident	28 Å²	28	51.7 Å²	51.7	17%	0.17	28%	0.281	C	S	.	.			trans	-122.2	139.2	-174.5	-69.4	0	0	0	0	112.2	V615 D617 I626 I632	V615-V623 HydrophobicContact CB-CG2 4.32Å; V615-V623 HydrophobicContact CG1-CG2 3.98Å; V615-V623 PolarHBondContact O-N 2.82Å; D617-V623 HydrophobicContact CB-CG1 4.1Å; V623-I626 HydrophobicContact CB-CG2 4.24Å; V623-I626 HydrophobicContact CG2-CG2 3.96Å; V623-I632 HydrophobicContact CG2-CG2 4.42Å
624	Q	81.3	Confident	81.3	Confident	114 Å²	114	50.8 Å²	50.8	53%	0.533	28%	0.278	S	S	.	.	S	Bend	trans	-113	-14.9	172.8	-67.3	179.8	-10.9	0	0	112.6	Y850	Q624-Y850 WeakPolarHBondContact O-CD2 3.06Å; Q624-Y850 PolarHBondContact O-N 2.89Å
625	T	80.3	Confident	81.2	Confident	76 Å²	76	50.9 Å²	50.9	47%	0.466	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	128	-177.2	60.8	0	0	0	0	109.2	Y850	T625-Y850 WeakPolarHBondContact CA-O 3.17Å; T625-Y850 HydrophobicContact CG2-CD2 4.15Å
626	I	83.1	Confident	81.1	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.072	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	160.1	-179.5	56.6	158.1	0	0	0	112	V623 T630 I632 L732 L849 Y850 L851 I852	V623-I626 HydrophobicContact CB-CG2 4.24Å; V623-I626 HydrophobicContact CG2-CG2 3.96Å; I626-T630 WeakPolarHBondContact CB-OG1 3.44Å; I626-I632 HydrophobicContact CD1-CD1 4.45Å; I626-I632 HydrophobicContact CD1-CG2 4.2Å; I626-I632 HydrophobicContact CG2-CG2 4.04Å; I626-L732 HydrophobicContact CD1-CD1 3.79Å; I626-L849 HydrophobicContact CD1-CD2 3.73Å; I626-L849 HydrophobicContact CD1-CG 4.32Å; I626-L849 HydrophobicContact CG1-CD1 4.24Å; I626-L849 HydrophobicContact CG1-CD2 4.07Å; I626-L849 HydrophobicContact CG1-CG 4.09Å; I626-L849 HydrophobicContact CG2-CD1 4.3Å; I626-Y850 PolarHBondContact N-O 3.22Å; I626-L851 HydrophobicContact CD1-CD1 3.75Å; I626-L851 HydrophobicContact CG1-CD1 3.88Å; I626-I852 PolarHBondContact O-N 2.7Å
627	L	79.4	Confident	80.9	Confident	85 Å²	85	50.8 Å²	50.8	45%	0.445	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	152.9	168.8	-171.1	75.8	0	0	0	109.1	T630 Y795 I852	L627-T630 HydrophobicContact CB-CG2 3.88Å; L627-T630 WeakPolarHBondContact O-CG2 3.42Å; L627-T630 PolarHBondContact O-N 2.85Å; L627-T630 PolarHBondContact O-OG1 2.94Å; L627-T630 VanDerWaalsContact O-OG1 3.04Å; L627-Y795 HydrophobicContact CD1-CE1 4.44Å; L627-I852 HydrophobicContact CD1-CB 4.21Å; L627-I852 HydrophobicContact CD1-CG2 4Å; L627-I852 WeakPolarHBondContact CD1-O 3.12Å
628	E	73.8	Confident	80.6	Confident	43 Å²	43	49.7 Å²	49.7	20%	0.201	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	142.6	167.9	-172.3	171.4	-152.6	0	0	111.9	T630 Y733 L734 I852	E628-T630 VanDerWaalsContact C-N 3.28Å; E628-T630 PolarHBondContact O-N 2.88Å; E628-Y733 WeakPolarHBondContact OE1-CA 3.35Å; E628-L734 PolarHBondContact OE1-N 2.99Å; E628-I852 PolarHBondContact N-O 2.9Å
629	S	69.7	Low	80.5	Confident	62 Å²	62	46.1 Å²	46.1	43%	0.434	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	15.5	-176.8	72.6	0	0	0	0	117.4	Y731 L732	S629-Y731 WeakPolarHBondContact O-CD1 3.31Å; S629-L732 PolarHBondContact N-O 2.73Å
630	T	76.4	Confident	80.1	Confident	42 Å²	42	42.1 Å²	42.1	26%	0.258	23%	0.234	S	C	.	.			trans	-76	142.2	165.8	58.5	0	0	0	0	111.7	I626 L627 E628	I626-T630 WeakPolarHBondContact CB-OG1 3.44Å; L627-T630 HydrophobicContact CB-CG2 3.88Å; L627-T630 WeakPolarHBondContact O-CG2 3.42Å; L627-T630 PolarHBondContact O-N 2.85Å; L627-T630 PolarHBondContact O-OG1 2.94Å; L627-T630 VanDerWaalsContact O-OG1 3.04Å; E628-T630 VanDerWaalsContact C-N 3.28Å; E628-T630 PolarHBondContact O-N 2.88Å
631	P	79.3	Confident	79.5	Confident	22 Å²	22	46 Å²	46	14%	0.143	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	129.9	174.4	30.4	-32.6	0	0	0	111	E618 L729 F730 Y731	E618-P631 HydrophobicContact CB-CG 4.09Å; E618-P631 HydrophobicContact CG-CG 4.38Å; E618-P631 WeakPolarHBondContact OE2-CG 3.43Å; P631-L729 HydrophobicContact CB-CB 4.46Å; P631-L729 HydrophobicContact CB-CD2 4.39Å; P631-F730 WeakPolarHBondContact CA-O 3.31Å; P631-Y731 HydrophobicContact CB-CD1 4.13Å; P631-Y731 HydrophobicContact CB-CE1 3.66Å; P631-Y731 HydrophobicContact CG-CE1 4.15Å
632	I	83.1	Confident	78.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	163.6	172.8	59.4	162.8	0	0	0	111.3	V615 K616 V623 I626 L729 F730 L732 L849	V615-I632 HydrophobicContact CG1-CB 4Å; V615-I632 HydrophobicContact CG1-CD1 3.87Å; V615-I632 HydrophobicContact CG1-CG2 4.25Å; K616-I632 CarbonylContact O-C 3.56Å; K616-I632 WeakPolarHBondContact O-CA 3.5Å; V623-I632 HydrophobicContact CG2-CG2 4.42Å; I626-I632 HydrophobicContact CD1-CD1 4.45Å; I626-I632 HydrophobicContact CD1-CG2 4.2Å; I626-I632 HydrophobicContact CG2-CG2 4.04Å; I632-L729 WeakPolarHBondContact O-CA 3.31Å; I632-F730 HydrophobicContact CD1-CE2 3.59Å; I632-F730 HydrophobicContact CD1-CZ 3.63Å; I632-F730 HydrophobicContact CG1-CD2 4.11Å; I632-F730 HydrophobicContact CG1-CE1 4.29Å; I632-F730 HydrophobicContact CG1-CE2 3.63Å; I632-F730 HydrophobicContact CG1-CZ 3.71Å; I632-F730 PolarHBondContact N-O 3.26Å; I632-F730 WeakPolarHBondContact O-CD1 3.43Å; I632-F730 PolarHBondContact O-N 2.86Å; I632-L732 HydrophobicContact CD1-CD1 3.6Å; I632-L732 HydrophobicContact CD1-CG 4.46Å; I632-L732 HydrophobicContact CG1-CD1 4.48Å; I632-L849 HydrophobicContact CD1-CD2 3.84Å
633	R	85	Confident	78	Confident	48 Å²	48	46.4 Å²	46.4	18%	0.181	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	157.9	170.9	54.4	-177.8	179	134.3	-1.8	110.9	K616 T727 L729	K616-R633 HydrophobicContact CB-CG 4.19Å; K616-R633 PolarHBondContact N-O 3.12Å; K616-R633 PolarHBondContact O-N 2.93Å; R633-T727 WeakPolarHBondContact CA-OG1 2.92Å; R633-T727 WeakPolarHBondContact CB-O 3.39Å; R633-T727 WeakPolarHBondContact CB-OG1 3.37Å; R633-L729 HydrophobicContact CB-CD2 3.98Å; R633-L729 HydrophobicContact CG-CD2 3.87Å
634	F	86	Confident	77.3	Confident	1 Å²	1	47.4 Å²	47.4	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	146	169.9	-58.4	-49.7	0	0	0	111	F613 V615 F709 Q726 T727 F730 F802	F613-F634 HydrophobicContact CE2-CB 3.85Å; F613-F634 HydrophobicContact CE2-CD1 4.28Å; F613-F634 HydrophobicContact CE2-CG 4.09Å; F613-F634 HydrophobicContact CZ-CB 4.33Å; F613-F634 AromaticContact CZ-CD1 3.96Å; F613-F634 HydrophobicContact CZ-CD1 3.96Å; F613-F634 HydrophobicContact CZ-CE1 4.45Å; F613-F634 HydrophobicContact CZ-CG 4.06Å; V615-F634 HydrophobicContact CG1-CD1 4.48Å; V615-F634 HydrophobicContact CG1-CE1 4.46Å; V615-F634 HydrophobicContact CG2-CD1 4.01Å; V615-F634 HydrophobicContact CG2-CE1 3.91Å; F634-F709 HydrophobicContact CB-CE1 3.95Å; F634-F709 HydrophobicContact CB-CZ 3.69Å; F634-F709 HydrophobicContact CD2-CZ 4.17Å; F634-F709 HydrophobicContact CG-CZ 4.37Å; F634-Q726 CarbonylContact O-C 3.45Å; F634-Q726 WeakPolarHBondContact O-CA 3.15Å; F634-T727 HydrophobicContact CB-CG2 3.93Å; F634-T727 HydrophobicContact CD2-CG2 4.21Å; F634-T727 PolarHBondContact N-OG1 2.91Å; F634-T727 PolarHBondContact O-N 3.13Å; F634-F730 HydrophobicContact CD2-CE1 4.01Å; F634-F730 HydrophobicContact CD2-CZ 4.09Å; F634-F730 HydrophobicContact CE1-CZ 4.06Å; F634-F730 AromaticContact CE2-CE1 3.89Å; F634-F730 HydrophobicContact CE2-CE1 3.89Å; F634-F730 AromaticContact CE2-CZ 3.53Å; F634-F730 HydrophobicContact CE2-CZ 3.53Å; F634-F730 HydrophobicContact CG-CE1 4.48Å; F634-F730 HydrophobicContact CZ-CE1 4.25Å; F634-F730 HydrophobicContact CZ-CE2 4.41Å; F634-F730 AromaticContact CZ-CZ 3.5Å; F634-F730 HydrophobicContact CZ-CZ 3.5Å; F634-F730 VanDerWaalsContact CZ-CZ 3.5Å; F634-F802 HydrophobicContact CE1-CD1 4.02Å; F634-F802 HydrophobicContact CE1-CE1 4.37Å; F634-F802 HydrophobicContact CE1-CG 4.19Å; F634-F802 HydrophobicContact CE2-CD1 4.33Å; F634-F802 AromaticContact CZ-CD1 3.38Å; F634-F802 HydrophobicContact CZ-CD1 3.38Å; F634-F802 AromaticContact CZ-CE1 3.64Å; F634-F802 HydrophobicContact CZ-CE1 3.64Å; F634-F802 HydrophobicContact CZ-CG 4.01Å; F634-F802 HydrophobicContact CZ-CZ 4.47Å
635	E	84.2	Confident	76.8	Confident	25 Å²	25	43.3 Å²	43.3	12%	0.117	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.5	172.1	-169.9	-179.9	108.7	0	0	109.8	T614 K616 L725	T614-E635 PolarHBondContact N-O 2.83Å; T614-E635 PolarHBondContact O-N 3.4Å; K616-E635 HydrophobicContact CD-CB 4.28Å; K616-E635 WeakPolarHBondContact CD-OE2 3.31Å; K616-E635 WeakPolarHBondContact CE-OE1 3.3Å; K616-E635 WeakPolarHBondContact CE-OE2 3.26Å; K616-E635 IonicContact NZ-OE1 2.7Å; K616-E635 PolarHBondContact NZ-OE1 3.47Å; K616-E635 IonicContact NZ-OE2 3.72Å; K616-E635 PolarHBondContact NZ-OE2 2.85Å; E635-L725 WeakPolarHBondContact CA-O 3.43Å
636	A	83.3	Confident	76.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.2	178.3	0	0	0	0	0	110.3	V611 K612 F613 H724 L725 F806	V611-A636 HydrophobicContact CG1-CB 3.88Å; K612-A636 WeakPolarHBondContact O-CA 3.4Å; F613-A636 HydrophobicContact CD2-CB 4.37Å; A636-H724 WeakPolarHBondContact O-CA 3.39Å; A636-L725 HydrophobicContact CB-CB 4.45Å; A636-L725 PolarHBondContact N-O 2.85Å; A636-L725 PolarHBondContact O-N 2.75Å; A636-F806 HydrophobicContact CB-CD1 4.2Å; A636-F806 HydrophobicContact CB-CE1 3.31Å; A636-F806 HydrophobicContact CB-CZ 3.71Å
637	E	81.8	Confident	75.8	Confident	30 Å²	30	44.8 Å²	44.8	14%	0.14	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	119.8	-173.5	171.3	-178.8	166	0	0	109.3	V611 K612 I639 H724	V611-E637 CarbonylContact C-O 3.59Å; V611-E637 WeakPolarHBondContact CA-O 3.24Å; K612-E637 HydrophobicContact CB-CB 4.25Å; K612-E637 WeakPolarHBondContact CD-OE2 3.27Å; K612-E637 VanDerWaalsContact CE-OE2 3.24Å; K612-E637 WeakPolarHBondContact CE-OE2 3.2Å; K612-E637 PolarHBondContact N-O 3.39Å; K612-E637 VanDerWaalsContact NZ-CD 3.34Å; K612-E637 IonicContact NZ-OE1 3.96Å; K612-E637 PolarHBondContact NZ-OE1 3.42Å; K612-E637 IonicContact NZ-OE2 2.6Å; K612-E637 PolarHBondContact NZ-OE2 3.44Å; K612-E637 PolarHBondContact O-N 2.73Å; E637-I639 PolarHBondContact O-N 2.82Å; E637-H724 VanDerWaalsContact CG-CE1 3.5Å; E637-H724 WeakPolarHBondContact CG-CE1 3.3Å; E637-H724 IonicContact OE2-CE1 2.72Å
638	L	79.8	Confident	75.8	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.3	174.5	-176.9	64.7	0	0	0	110	L609 V611 V648 H723 I808	L609-L638 HydrophobicContact CD1-CD1 3.98Å; V611-L638 HydrophobicContact CG2-CD1 4.25Å; L638-V648 HydrophobicContact CB-CG1 4.13Å; L638-H723 HydrophobicContact CB-CB 3.97Å; L638-H723 HydrophobicContact CD2-CB 4.11Å; L638-H723 PolarHBondContact N-O 2.85Å; L638-I808 HydrophobicContact CD1-CD1 3.93Å; L638-I808 HydrophobicContact CD1-CG1 4.39Å; L638-I808 HydrophobicContact CD1-CG2 3.71Å; L638-I808 HydrophobicContact CD2-CG2 4.19Å
639	I	77.8	Confident	75.9	Confident	53 Å²	53	40.7 Å²	40.7	27%	0.272	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.3	166.6	-56.9	175.4	0	0	0	106.3	K608 L609 D610 K612 E637	K608-I639 HydrophobicContact CB-CG2 4.26Å; K608-I639 CarbonylContact O-C 3.54Å; L609-I639 CarbonylContact C-O 3.33Å; L609-I639 VanDerWaalsContact CA-O 3.3Å; L609-I639 WeakPolarHBondContact CA-O 3.32Å; D610-I639 HydrophobicContact CB-CB 4.34Å; D610-I639 PolarHBondContact N-O 3.35Å; D610-I639 PolarHBondContact O-N 2.84Å; K612-I639 HydrophobicContact CB-CD1 3.94Å; K612-I639 HydrophobicContact CB-CG1 4.41Å; E637-I639 PolarHBondContact O-N 2.82Å
640	D	72.8	Confident	76.2	Confident	25 Å²	25	38 Å²	38	13%	0.134	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	100	171.2	-179.6	-0.9	0	0	0	109.5	K608 L609 L642 N643 V644 Y645	K608-D640 WeakPolarHBondContact O-CA 3.16Å; L609-D640 HydrophobicContact CD1-CB 3.82Å; D640-L642 PolarHBondContact O-N 3.48Å; D640-L642 VanDerWaalsContact O-N 3.13Å; D640-L642 PolarHBondContact OD1-N 2.69Å; D640-N643 PolarHBondContact O-N 2.96Å; D640-N643 PolarHBondContact OD1-N 3.43Å; D640-N643 PolarHBondContact OD2-N 3.36Å; D640-V644 PolarHBondContact OD2-N 3.49Å; D640-Y645 WeakPolarHBondContact OD2-CD2 3.47Å; D640-Y645 PolarHBondContact OD2-N 2.66Å
641	E	66.1	Low	76	Confident	105 Å²	105	37.1 Å²	37.1	49%	0.491	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.9	179.7	-69.3	175.8	163.8	0	0	113.6	P607 K608	P607-E641 WeakPolarHBondContact CA-OE2 3.21Å; P607-E641 HydrophobicContact CB-CB 4.31Å; K608-E641 HydrophobicContact CB-CG 4.08Å; K608-E641 WeakPolarHBondContact CD-OE1 3.48Å; K608-E641 PolarHBondContact N-OE2 2.69Å; K608-E641 IonicContact NZ-OE1 3.78Å; K608-E641 PolarHBondContact O-N 3.38Å
642	L	64.5	Low	76	Confident	109 Å²	109	38 Å²	38	57%	0.571	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-8.6	177.2	-65.3	-175.3	0	0	0	115.1	P607 D640 V644	P607-L642 HydrophobicContact CB-CD1 4.04Å; P607-L642 HydrophobicContact CB-CD2 4.29Å; P607-L642 HydrophobicContact CB-CG 3.72Å; P607-L642 HydrophobicContact CG-CD1 3.72Å; P607-L642 HydrophobicContact CG-CG 4Å; D640-L642 PolarHBondContact O-N 3.48Å; D640-L642 VanDerWaalsContact O-N 3.13Å; D640-L642 PolarHBondContact OD1-N 2.69Å; L642-V644 HydrophobicContact CB-CG2 3.73Å; L642-V644 HydrophobicContact CD1-CG2 4.34Å; L642-V644 PolarHBondContact O-N 3.37Å
643	N	66.7	Low	75.7	Confident	86 Å²	86	38.1 Å²	38.1	46%	0.46	19%	0.189	S	C	.	.			trans	53	35.2	-172.8	-65.4	-110	0	0	0	113.7	D640 N721	D640-N643 PolarHBondContact O-N 2.96Å; D640-N643 PolarHBondContact OD1-N 3.43Å; D640-N643 PolarHBondContact OD2-N 3.36Å; N643-N721 WeakPolarHBondContact OD1-CB 3.32Å; N643-N721 PolarHBondContact OD1-ND2 3.02Å
644	V	68.7	Low	75.4	Confident	49 Å²	49	37.3 Å²	37.3	30%	0.297	19%	0.186	S	C	.	.			trans	-78.6	-35.1	175.8	171.5	0	0	0	0	110.9	D640 L642 K810	D640-V644 PolarHBondContact OD2-N 3.49Å; L642-V644 HydrophobicContact CB-CG2 3.73Å; L642-V644 HydrophobicContact CD1-CG2 4.34Å; L642-V644 PolarHBondContact O-N 3.37Å; V644-K810 HydrophobicContact CG1-CD 4.3Å; V644-K810 HydrophobicContact CG1-CG 4.08Å; V644-K810 WeakPolarHBondContact O-CG 3.5Å
645	Y	71.8	Confident	75	Confident	29 Å²	29	37.5 Å²	37.5	11%	0.114	19%	0.187	C	C	.	.			trans	-97.7	140.8	-177	-64.6	-91.3	0	0	0	111.1	L609 D640 I808 K810 R841	L609-Y645 HydrophobicContact CD1-CD2 3.51Å; L609-Y645 HydrophobicContact CD1-CE2 4.18Å; L609-Y645 HydrophobicContact CD1-CG 3.92Å; L609-Y645 HydrophobicContact CD2-CD2 3.79Å; L609-Y645 HydrophobicContact CD2-CE1 4.48Å; L609-Y645 HydrophobicContact CD2-CE2 3.6Å; L609-Y645 HydrophobicContact CD2-CG 4.34Å; L609-Y645 HydrophobicContact CG-CD2 4.27Å; L609-Y645 HydrophobicContact CG-CE2 4.48Å; D640-Y645 WeakPolarHBondContact OD2-CD2 3.47Å; D640-Y645 PolarHBondContact OD2-N 2.66Å; Y645-I808 HydrophobicContact CD1-CB 4.45Å; Y645-I808 HydrophobicContact CD1-CG2 3.69Å; Y645-I808 HydrophobicContact CG-CG2 3.86Å; Y645-K810 HydrophobicContact CE1-CB 4.5Å; Y645-R841 HydrophobicContact CE1-CG 4.22Å; Y645-R841 WeakPolarHBondContact OH-CD 3.49Å; Y645-R841 PolarHBondContact OH-NE 3.36Å
646	K	71.7	Confident	74.4	Confident	116 Å²	116	36.9 Å²	36.9	50%	0.504	19%	0.185	S	C	.	.			trans	-127.2	4.5	-165.8	-61.3	-172.6	-179.2	-174.6	0	114.2	H723 C809 K810	K646-H723 VanDerWaalsContact C-CE1 3.48Å; K646-H723 PolarHBondContact O-CE1 2.9Å; K646-H723 PolarHBondContact O-ND1 2.75Å; K646-C809 PolarHBondContact N-O 3.05Å; K646-K810 WeakPolarHBondContact CG-O 3.16Å
647	A	70.5	Confident	73.5	Confident	5 Å²	5	38 Å²	38	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	154.3	175.1	0	0	0	0	0	111.2	I808 C809 L812 C815	A647-I808 WeakPolarHBondContact O-CA 3.37Å; A647-I808 WeakPolarHBondContact O-CG2 3.06Å; A647-C809 HydrophobicContact CB-CB 4.31Å; A647-C809 PolarHBondContact N-O 3.18Å; A647-C809 PolarHBondContact O-N 2.84Å; A647-L812 HydrophobicContact CB-CD1 3.74Å; A647-C815 HydrophobicContact CB-CB 3.46Å; A647-C815 VanDerWaalsContact CB-CB 3.46Å
648	V	77.9	Confident	72.3	Confident	9 Å²	9	41.7 Å²	41.7	6%	0.055	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.3	168.9	55.8	0	0	0	0	108.2	V611 L638 H723 L725 F806 R807 I808	V611-V648 HydrophobicContact CG2-CG2 3.98Å; L638-V648 HydrophobicContact CB-CG1 4.13Å; V648-H723 HydrophobicContact CG1-CB 4.34Å; V648-L725 HydrophobicContact CG1-CD1 4.01Å; V648-L725 HydrophobicContact CG1-CG 4.05Å; V648-L725 HydrophobicContact CG2-CD1 4.3Å; V648-F806 HydrophobicContact CG2-CB 4.03Å; V648-F806 HydrophobicContact CG2-CD1 3.97Å; V648-F806 HydrophobicContact CG2-CG 4.4Å; V648-R807 CarbonylContact C-O 3.54Å; V648-R807 WeakPolarHBondContact CA-O 3.36Å; V648-I808 HydrophobicContact CG2-CG1 4.26Å
649	T	76.3	Confident	71.1	Confident	32 Å²	32	46.7 Å²	46.7	20%	0.196	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	161.2	-179.3	42.6	0	0	0	0	109.9	F806 R807 C815	T649-F806 CarbonylContact O-C 3.45Å; T649-F806 WeakPolarHBondContact O-CA 3.4Å; T649-R807 PolarHBondContact N-O 3.38Å; T649-R807 PolarHBondContact O-N 3.18Å; T649-R807 WeakPolarHBondContact OG1-CB 3.27Å; T649-R807 PolarHBondContact OG1-O 3.1Å; T649-R807 VanDerWaalsContact OG1-O 3.06Å; T649-C815 HydrophobicContact CG2-CB 3.72Å; T649-C815 WeakPolarHBondContact CG2-O 3.38Å; T649-C815 PolarHBondContact OG1-SG 3.4Å
650	V	76.9	Confident	69.3	Low	6 Å²	6	50.4 Å²	50.4	4%	0.036	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	120.4	177.6	176.6	0	0	0	0	110.2	C653 K676 G677 F709 L725 F806	V650-C653 VanDerWaalsContact CG1-SG 3.58Å; V650-K676 CarbonylContact O-C 3.59Å; V650-G677 PolarHBondContact O-N 3.28Å; V650-G677 VanDerWaalsContact O-N 3.14Å; V650-F709 HydrophobicContact CB-CD2 4.01Å; V650-F709 HydrophobicContact CB-CE2 4.31Å; V650-F709 HydrophobicContact CG1-CD2 4.25Å; V650-F709 HydrophobicContact CG1-CE2 4.17Å; V650-F709 HydrophobicContact CG2-CB 4.42Å; V650-F709 HydrophobicContact CG2-CD1 4.2Å; V650-F709 HydrophobicContact CG2-CD2 3.62Å; V650-F709 HydrophobicContact CG2-CE1 4.3Å; V650-F709 HydrophobicContact CG2-CE2 3.74Å; V650-F709 HydrophobicContact CG2-CG 3.84Å; V650-F709 HydrophobicContact CG2-CZ 4.08Å; V650-L725 HydrophobicContact CG2-CD1 4.24Å; V650-F806 HydrophobicContact CG2-CD1 3.67Å; V650-F806 HydrophobicContact CG2-CE1 3.45Å; V650-F806 VanDerWaalsContact CG2-CE1 3.45Å; V650-F806 HydrophobicContact CG2-CZ 4.36Å
651	E	72.9	Confident	67.4	Low	23 Å²	23	53.7 Å²	53.7	11%	0.107	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-48.5	173.3	-71.5	-59.6	102.2	0	0	111.5	Y675 K676 I805 R807	E651-Y675 CarbonylContact O-C 3.58Å; E651-Y675 WeakPolarHBondContact O-CA 3.39Å; E651-K676 PolarHBondContact O-N 2.87Å; E651-K676 VanDerWaalsContact OE2-CE 3.28Å; E651-K676 WeakPolarHBondContact OE2-CE 3.31Å; E651-I805 HydrophobicContact CB-CG2 4.3Å; E651-I805 PolarHBondContact N-O 3.36Å; E651-R807 HydrophobicContact CG-CB 3.94Å; E651-R807 IonicContact OE1-CZ 2.68Å; E651-R807 IonicContact OE1-NH1 3.31Å; E651-R807 PolarHBondContact OE1-NH1 2.86Å; E651-R807 IonicContact OE1-NH2 2.65Å; E651-R807 IonicContact OE2-CZ 3.61Å; E651-R807 IonicContact OE2-NH1 2.77Å; E651-R807 PolarHBondContact OE2-NH1 2.91Å; E651-R807 IonicContact OE2-NH2 3.21Å; E651-R807 PolarHBondContact OE2-NH2 2.74Å
652	E	77.7	Confident	66.1	Low	41 Å²	41	52.9 Å²	52.9	19%	0.192	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	148	-176.1	-58.1	-169.7	152	0	0	110.7	Y654 L672 L674 Y675 C804 I805	E652-Y654 HydrophobicContact CB-CD2 4.4Å; E652-Y654 HydrophobicContact CB-CE2 3.7Å; E652-Y654 VanDerWaalsContact OE2-CE2 3.26Å; E652-Y654 WeakPolarHBondContact OE2-CE2 3.02Å; E652-Y654 PolarHBondContact OE2-OH 3.28Å; E652-L672 HydrophobicContact CB-CD1 4.04Å; E652-L674 CarbonylContact C-O 3.46Å; E652-L674 WeakPolarHBondContact CA-O 3.24Å; E652-Y675 HydrophobicContact CG-CD2 4.05Å; E652-Y675 HydrophobicContact CG-CE2 4.44Å; E652-C804 CarbonylContact O-C 3.59Å; E652-C804 WeakPolarHBondContact O-CA 3.44Å; E652-I805 HydrophobicContact CB-CB 4.47Å; E652-I805 HydrophobicContact CB-CD1 4.31Å; E652-I805 PolarHBondContact O-N 2.84Å
653	C	77.9	Confident	64.8	Low	3 Å²	3	54.9 Å²	54.9	2%	0.02	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	133.1	164.3	-63.3	0	0	0	0	111.7	V650 L673 L674 T803 C804	V650-C653 VanDerWaalsContact CG1-SG 3.58Å; C653-L673 PolarHBondContact O-N 2.79Å; C653-L674 HydrophobicContact CB-CB 4.02Å; C653-L674 HydrophobicContact CB-CD1 3.75Å; C653-L674 PolarHBondContact N-O 2.86Å; C653-L674 PolarHBondContact O-N 2.77Å; C653-T803 CarbonylContact C-O 3.51Å; C653-T803 VanDerWaalsContact CA-O 3.31Å; C653-T803 WeakPolarHBondContact CA-O 3.43Å; C653-C804 HydrophobicContact CB-CB 4.13Å; C653-C804 WeakPolarHBondContact CB-SG 3.13Å; C653-C804 WeakPolarHBondContact SG-CB 3.36Å; C653-C804 CovalentContact SG-SG 2.04Å; C653-C804 PolarHBondContact SG-SG 2.92Å
654	Y	78	Confident	63.1	Low	31 Å²	31	63 Å²	63	12%	0.122	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	154.4	-177.5	-61.6	-99.8	0	0	0	111.7	E652 E670 T671 L672 F802 T803	E652-Y654 HydrophobicContact CB-CD2 4.4Å; E652-Y654 HydrophobicContact CB-CE2 3.7Å; E652-Y654 VanDerWaalsContact OE2-CE2 3.26Å; E652-Y654 WeakPolarHBondContact OE2-CE2 3.02Å; E652-Y654 PolarHBondContact OE2-OH 3.28Å; Y654-E670 HydrophobicContact CD1-CB 4.35Å; Y654-T671 CarbonylContact C-O 3.53Å; Y654-T671 WeakPolarHBondContact CA-O 3.15Å; Y654-L672 HydrophobicContact CD1-CB 4.06Å; Y654-L672 HydrophobicContact CD1-CD1 3.97Å; Y654-L672 HydrophobicContact CD2-CD1 4.11Å; Y654-L672 HydrophobicContact CE1-CB 4.01Å; Y654-L672 HydrophobicContact CE1-CD1 3.69Å; Y654-L672 HydrophobicContact CE1-CG 4.36Å; Y654-L672 HydrophobicContact CE2-CD1 3.82Å; Y654-L672 HydrophobicContact CG-CD1 4.17Å; Y654-F802 CarbonylContact O-C 3.53Å; Y654-F802 WeakPolarHBondContact O-CA 3.17Å; Y654-T803 PolarHBondContact N-O 2.05Å; Y654-T803 PolarHBondContact O-N 3.2Å
655	V	76.9	Confident	61.5	Low	5 Å²	5	66.4 Å²	66.4	3%	0.03	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.4	162	166.6	0	0	0	0	109.7	E670 T671 L673 I691 F802	V655-E670 WeakPolarHBondContact O-CA 3.21Å; V655-T671 PolarHBondContact N-O 3.4Å; V655-T671 PolarHBondContact O-N 2.84Å; V655-L673 HydrophobicContact CG2-CD1 3.55Å; V655-L673 HydrophobicContact CG2-CD2 4.13Å; V655-L673 HydrophobicContact CG2-CG 3.87Å; V655-I691 HydrophobicContact CG1-CD1 3.85Å; V655-F802 HydrophobicContact CG2-CD1 3.35Å; V655-F802 HydrophobicContact CG2-CE1 3.2Å; V655-F802 HydrophobicContact CG2-CG 4.16Å; V655-F802 HydrophobicContact CG2-CZ 3.88Å
656	I	71.7	Confident	60	Low	12 Å²	12	71.7 Å²	71.7	6%	0.062	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.8	170.4	-45.3	178.3	0	0	0	107.6	E670 K801	I656-E670 WeakPolarHBondContact CD1-OE1 3.15Å; I656-E670 HydrophobicContact CG1-CG 4.22Å; I656-K801 HydrophobicContact CB-CB 4.35Å; I656-K801 PolarHBondContact N-O 3.48Å; I656-K801 PolarHBondContact O-N 2.96Å
657	D	64.5	Low	58.8	Low	24 Å²	24	73.2 Å²	73.2	13%	0.128	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	108.4	179.2	-173.2	-0.7	0	0	0	109.9	I659 T690 I691 L800	D657-I659 VanDerWaalsContact C-N 3.32Å; D657-I659 PolarHBondContact O-N 3.41Å; D657-I659 VanDerWaalsContact O-N 3.13Å; D657-I659 VanDerWaalsContact OD1-CG1 3.3Å; D657-I659 WeakPolarHBondContact OD1-CG1 3.48Å; D657-T690 PolarHBondContact OD2-OG1 2.69Å; D657-I691 HydrophobicContact CB-CD1 4.24Å; D657-L800 HydrophobicContact CB-CD2 4.49Å
658	R	57.9	Low	57.8	Low	107 Å²	107	77.3 Å²	77.3	40%	0.404	40%	0.402	S	S	.	.			trans	-88.9	65.5	-177.3	-74.6	177.6	162.9	-163.7	-5.7	111.4	D311 K660 E799	D311-R658 IonicContact OD2-CZ 2.81Å; D311-R658 IonicContact OD2-NE 2.61Å; D311-R658 IonicContact OD2-NH2 2.7Å; D311-R658 PolarHBondContact OD2-NH2 2.82Å; R658-K660 PolarHBondContact O-N 3.25Å; R658-E799 HydrophobicContact CB-CB 4.31Å; R658-E799 HydrophobicContact CB-CG 4.32Å; R658-E799 WeakPolarHBondContact CD-OE1 3.32Å; R658-E799 IonicContact CZ-OE1 3.7Å; R658-E799 PolarHBondContact N-O 3.24Å; R658-E799 VanDerWaalsContact N-O 3.09Å; R658-E799 IonicContact NE-OE1 2.85Å; R658-E799 IonicContact NH1-OE1 3.56Å; R658-E799 PolarHBondContact NH1-OE1 3.01Å
659	I	53.9	Low	56.8	Low	111 Å²	111	83.8 Å²	83.8	57%	0.569	43%	0.43	S	S	*	.			trans	-66.6	107.4	175.1	-54.8	-175.2	0	0	0	109.8	D657 S661	D657-I659 VanDerWaalsContact C-N 3.32Å; D657-I659 PolarHBondContact O-N 3.41Å; D657-I659 VanDerWaalsContact O-N 3.13Å; D657-I659 VanDerWaalsContact OD1-CG1 3.3Å; D657-I659 WeakPolarHBondContact OD1-CG1 3.48Å; I659-S661 PolarHBondContact O-N 2.83Å
660	K	39.3	Very low	56.2	Low	131 Å²	131	85 Å²	85	57%	0.57	43%	0.433	S	S	*	.			trans	-57.5	108.2	171.8	-82.2	-164.3	171.2	-167.5	0	110.8	R658 D784	R658-K660 PolarHBondContact O-N 3.25Å; K660-D784 IonicContact NZ-OD1 2.98Å; K660-D784 PolarHBondContact NZ-OD1 2.88Å; K660-D784 IonicContact NZ-OD2 3.8Å; K660-D784 PolarHBondContact NZ-OD2 3.13Å
661	S	33.8	Very low	55.7	Low	93 Å²	93	85.8 Å²	85.8	65%	0.65	44%	0.438	S	S	*	.			trans	-136.4	136.8	159.2	-169.3	0	0	0	0	110	I659 Q663	I659-S661 PolarHBondContact O-N 2.83Å; S661-Q663 PolarHBondContact O-N 3.26Å
662	G	38.1	Very low	55.5	Low	88 Å²	88	85.9 Å²	85.9	91%	0.907	44%	0.439	S	S	*	.	S	Bend	trans	-81.3	35.9	-169.4	0	0	0	0	0	115.5
663	Q	37	Very low	55.2	Low	152 Å²	152	84.4 Å²	84.4	71%	0.71	43%	0.433	S	S	*	.	S	Bend	trans	-129.9	133.2	179.6	-70.9	-176	-53	0	0	111	S661 N665	S661-Q663 PolarHBondContact O-N 3.26Å; Q663-N665 VanDerWaalsContact C-N 3.33Å; Q663-N665 PolarHBondContact O-N 3.4Å
664	R	31	Very low	54.9	Low	256 Å²	256	84.3 Å²	84.3	97%	0.966	43%	0.432	S	S	*	.			trans	-79.5	78.1	175.1	-65.5	178.9	-177.1	157.8	-2.1	110.5
665	N	36.4	Very low	54.5	Low	121 Å²	121	86.7 Å²	86.7	65%	0.647	44%	0.441	S	S	*	.			trans	-137.9	110.7	160.8	-67.3	-41.3	0	0	0	104.8	Q663	Q663-N665 VanDerWaalsContact C-N 3.33Å; Q663-N665 PolarHBondContact O-N 3.4Å
666	E	39.4	Very low	54	Low	140 Å²	140	88.1 Å²	88.1	65%	0.654	45%	0.447	S	S	*	.				69	136.4	100.1	-65.4	-169.5	148.9	0	0	114.2	K188	K188-E666 IonicContact NZ-OE1 2.84Å; K188-E666 PolarHBondContact NZ-OE1 2.89Å
667	D	45.8	Very low	53.6	Low	147 Å²	147	88 Å²	88	79%	0.786	45%	0.449	S	S	*	.			trans	62.8	64.3	178.6	-62.4	-3	0	0	0	118.3	K669	D667-K669 PolarHBondContact O-N 3.46Å
668	S	51.4	Low	53.6	Low	91 Å²	91	87.8 Å²	87.8	64%	0.636	45%	0.449	S	S	*	.			trans	-67.1	95.1	157.1	56.5	0	0	0	0	110.4	E670	S668-E670 PolarHBondContact O-N 3.38Å; S668-E670 VanDerWaalsContact O-N 3.1Å
669	K	55.6	Low	53.9	Low	146 Å²	146	83.8 Å²	83.8	64%	0.635	44%	0.437	S	S	*	.			trans	-65.3	108.2	-176.2	-73.5	-172.3	173.2	-172.8	0	113	D667	D667-K669 PolarHBondContact O-N 3.46Å
670	E	64.6	Low	54.3	Low	57 Å²	57	80.9 Å²	80.9	27%	0.266	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	134.4	168.4	-53.6	-165.6	132.9	0	0	111.1	I313 Y654 V655 I656 S668	I313-E670 WeakPolarHBondContact CD1-OE1 3.35Å; I313-E670 WeakPolarHBondContact CD1-OE2 3.48Å; Y654-E670 HydrophobicContact CD1-CB 4.35Å; V655-E670 WeakPolarHBondContact O-CA 3.21Å; I656-E670 WeakPolarHBondContact CD1-OE1 3.15Å; I656-E670 HydrophobicContact CG1-CG 4.22Å; S668-E670 PolarHBondContact O-N 3.38Å; S668-E670 VanDerWaalsContact O-N 3.1Å
671	T	66.2	Low	55	Low	23 Å²	23	76.4 Å²	76.4	14%	0.141	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	110.9	174.7	-53.1	0	0	0	0	109.5	Y654 V655 L673 L685 S689	Y654-T671 CarbonylContact C-O 3.53Å; Y654-T671 WeakPolarHBondContact CA-O 3.15Å; V655-T671 PolarHBondContact N-O 3.4Å; V655-T671 PolarHBondContact O-N 2.84Å; T671-L673 HydrophobicContact CG2-CD2 4.14Å; T671-L673 PolarHBondContact O-N 2.87Å; T671-L685 HydrophobicContact CG2-CD1 3.95Å; T671-S689 WeakPolarHBondContact OG1-CB 3.48Å
672	L	67.6	Low	55.9	Low	24 Å²	24	77.1 Å²	77.1	13%	0.126	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	124	171.3	-175.8	66.9	0	0	0	108.9	I199 E652 Y654 L674 I680	I199-L672 HydrophobicContact CD1-CD2 4.19Å; E652-L672 HydrophobicContact CB-CD1 4.04Å; Y654-L672 HydrophobicContact CD1-CB 4.06Å; Y654-L672 HydrophobicContact CD1-CD1 3.97Å; Y654-L672 HydrophobicContact CD2-CD1 4.11Å; Y654-L672 HydrophobicContact CE1-CB 4.01Å; Y654-L672 HydrophobicContact CE1-CD1 3.69Å; Y654-L672 HydrophobicContact CE1-CG 4.36Å; Y654-L672 HydrophobicContact CE2-CD1 3.82Å; Y654-L672 HydrophobicContact CG-CD1 4.17Å; L672-L674 VanDerWaalsContact CD1-O 3.28Å; L672-L674 WeakPolarHBondContact CD1-O 3.48Å; L672-I680 HydrophobicContact CB-CD1 3.87Å; L672-I680 HydrophobicContact CD2-CD1 3.87Å; L672-I680 HydrophobicContact CG-CD1 3.82Å; L672-I680 VanDerWaalsContact O-CD1 3.28Å; L672-I680 WeakPolarHBondContact O-CD1 3.16Å
673	L	72.2	Confident	56.4	Low	11 Å²	11	78 Å²	78	6%	0.058	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-41	178.3	-60.5	-163.4	0	0	0	112.2	C653 V655 T671 P679 I680 L685 L693 F802	C653-L673 PolarHBondContact O-N 2.79Å; V655-L673 HydrophobicContact CG2-CD1 3.55Å; V655-L673 HydrophobicContact CG2-CD2 4.13Å; V655-L673 HydrophobicContact CG2-CG 3.87Å; T671-L673 HydrophobicContact CG2-CD2 4.14Å; T671-L673 PolarHBondContact O-N 2.87Å; L673-P679 WeakPolarHBondContact O-CA 3.45Å; L673-I680 PolarHBondContact O-N 3.35Å; L673-I680 VanDerWaalsContact O-N 3.14Å; L673-L685 HydrophobicContact CD2-CD1 4.46Å; L673-L693 HydrophobicContact CD1-CD1 3.92Å; L673-L693 HydrophobicContact CD2-CD1 3.65Å; L673-L693 HydrophobicContact CG-CD1 4.3Å; L673-F802 HydrophobicContact CD1-CD1 4.14Å; L673-F802 HydrophobicContact CD1-CE1 3.86Å
674	L	72.6	Confident	56.9	Low	0 Å²	0	73.9 Å²	73.9	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.5	-170.4	-70.1	135.1	0	0	0	110.2	E652 C653 L672 C678 L707 F709	E652-L674 CarbonylContact C-O 3.46Å; E652-L674 WeakPolarHBondContact CA-O 3.24Å; C653-L674 HydrophobicContact CB-CB 4.02Å; C653-L674 HydrophobicContact CB-CD1 3.75Å; C653-L674 PolarHBondContact N-O 2.86Å; C653-L674 PolarHBondContact O-N 2.77Å; L672-L674 VanDerWaalsContact CD1-O 3.28Å; L672-L674 WeakPolarHBondContact CD1-O 3.48Å; L674-C678 CarbonylContact C-O 3.47Å; L674-C678 VanDerWaalsContact CA-O 3.29Å; L674-C678 WeakPolarHBondContact CA-O 3.45Å; L674-L707 HydrophobicContact CD1-CD2 4.34Å; L674-L707 HydrophobicContact CD2-CB 4.32Å; L674-L707 HydrophobicContact CD2-CD2 4.11Å; L674-L707 WeakPolarHBondContact CD2-O 3.36Å; L674-F709 HydrophobicContact CD1-CE2 4.05Å; L674-F709 HydrophobicContact CD2-CD2 4.42Å
675	Y	69.2	Low	57.8	Low	81 Å²	81	62.4 Å²	62.4	32%	0.318	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	126	176.7	-178.3	-103.7	0	0	0	110.6	E651 E652 G677 C678	E651-Y675 CarbonylContact O-C 3.58Å; E651-Y675 WeakPolarHBondContact O-CA 3.39Å; E652-Y675 HydrophobicContact CG-CD2 4.05Å; E652-Y675 HydrophobicContact CG-CE2 4.44Å; Y675-G677 PolarHBondContact O-N 3.32Å; Y675-G677 VanDerWaalsContact O-N 3.11Å; Y675-C678 PolarHBondContact N-O 3.38Å; Y675-C678 PolarHBondContact O-N 3.24Å
676	K	65.9	Low	58.3	Low	35 Å²	35	61.6 Å²	61.6	15%	0.152	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	39.1	46.6	-174.3	-62.6	-172.4	177.7	-175.9	0	113	D293 V650 E651	D293-K676 IonicContact OD1-NZ 3.7Å; D293-K676 IonicContact OD2-NZ 3.97Å; D293-K676 PolarHBondContact OD2-NZ 2.88Å; V650-K676 CarbonylContact O-C 3.59Å; E651-K676 PolarHBondContact O-N 2.87Å; E651-K676 VanDerWaalsContact OE2-CE 3.28Å; E651-K676 WeakPolarHBondContact OE2-CE 3.31Å
677	G	63.6	Low	58.6	Low	10 Å²	10	61.5 Å²	61.5	10%	0.103	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-6.3	177.8	0	0	0	0	0	117.2	V650 Y675	V650-G677 PolarHBondContact O-N 3.28Å; V650-G677 VanDerWaalsContact O-N 3.14Å; Y675-G677 PolarHBondContact O-N 3.32Å; Y675-G677 VanDerWaalsContact O-N 3.11Å
678	C	63.1	Low	58.7	Low	20 Å²	20	58.1 Å²	58.1	14%	0.135	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	155.2	178.6	-64.5	0	0	0	0	112	L674 Y675 C821	L674-C678 CarbonylContact C-O 3.47Å; L674-C678 VanDerWaalsContact CA-O 3.29Å; L674-C678 WeakPolarHBondContact CA-O 3.45Å; Y675-C678 PolarHBondContact N-O 3.38Å; Y675-C678 PolarHBondContact O-N 3.24Å; C678-C821 VanDerWaalsContact CA-SG 3.53Å; C678-C821 HydrophobicContact CB-CB 3.89Å; C678-C821 WeakPolarHBondContact CB-SG 3.26Å; C678-C821 VanDerWaalsContact SG-CA 3.52Å; C678-C821 WeakPolarHBondContact SG-CB 3.38Å; C678-C821 CovalentContact SG-SG 2.04Å; C678-C821 PolarHBondContact SG-SG 3.34Å
679	P	64.7	Low	58.6	Low	22 Å²	22	54.5 Å²	54.5	14%	0.143	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	162.2	176.2	-3.1	23.1	0	0	0	112.1	L673 F706 L707	L673-P679 WeakPolarHBondContact O-CA 3.45Å; P679-F706 HydrophobicContact CG-CB 3.68Å; P679-F706 HydrophobicContact CG-CD1 3.89Å; P679-F706 HydrophobicContact CG-CG 4.2Å; P679-L707 HydrophobicContact CB-CB 4.15Å; P679-L707 HydrophobicContact CG-CB 3.6Å
680	I	63	Low	58.4	Low	50 Å²	50	51.1 Å²	51.1	26%	0.256	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-79.7	141.3	167.8	-53.3	-167.3	0	0	0	110.8	L672 L673 L684	L672-I680 HydrophobicContact CB-CD1 3.87Å; L672-I680 HydrophobicContact CD2-CD1 3.87Å; L672-I680 HydrophobicContact CG-CD1 3.82Å; L672-I680 VanDerWaalsContact O-CD1 3.28Å; L672-I680 WeakPolarHBondContact O-CD1 3.16Å; L673-I680 PolarHBondContact O-N 3.35Å; L673-I680 VanDerWaalsContact O-N 3.14Å; I680-L684 HydrophobicContact CD1-CD2 4.48Å; I680-L684 HydrophobicContact CG2-CB 3.64Å; I680-L684 HydrophobicContact CG2-CD2 3.66Å; I680-L684 HydrophobicContact CG2-CG 4.28Å
681	S	54.4	Low	57.9	Low	38 Å²	38	49 Å²	49	27%	0.266	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-61.6	144.7	176.2	-176.1	0	0	0	0	113	T683 L684 L685	S681-T683 PolarHBondContact O-N 2.68Å; S681-T683 VanDerWaalsContact O-N 3.08Å; S681-T683 PolarHBondContact OG-OG1 3.45Å; S681-L684 PolarHBondContact O-N 2.67Å; S681-L685 PolarHBondContact O-N 3.31Å
682	K	52.8	Low	57.4	Low	108 Å²	108	48.1 Å²	48.1	47%	0.47	26%	0.26	S	S	.	.	H	α-helix	trans	-55.1	-28.6	-178.3	-69.8	172.3	179.7	162.3	0	113.8	L684 L685 N686	K682-L684 VanDerWaalsContact C-N 3.28Å; K682-L684 PolarHBondContact O-N 3.4Å; K682-L685 PolarHBondContact O-N 3.31Å; K682-N686 PolarHBondContact O-N 2.77Å
683	T	47.3	Very low	57	Low	106 Å²	106	48 Å²	48	65%	0.65	26%	0.259	S	S	*	.	H	α-helix	trans	-65.2	-29.3	178.4	48.3	0	0	0	0	113.1	S681	S681-T683 PolarHBondContact O-N 2.68Å; S681-T683 VanDerWaalsContact O-N 3.08Å; S681-T683 PolarHBondContact OG-OG1 3.45Å
684	L	47.9	Very low	56	Low	66 Å²	66	49.9 Å²	49.9	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-82.9	-40.5	174.9	-145.9	85.5	0	0	0	111.5	I202 I680 S681 K682	I202-L684 HydrophobicContact CD1-CD1 4.47Å; I202-L684 HydrophobicContact CD1-CD2 4.01Å; I680-L684 HydrophobicContact CD1-CD2 4.48Å; I680-L684 HydrophobicContact CG2-CB 3.64Å; I680-L684 HydrophobicContact CG2-CD2 3.66Å; I680-L684 HydrophobicContact CG2-CG 4.28Å; S681-L684 PolarHBondContact O-N 2.67Å; K682-L684 VanDerWaalsContact C-N 3.28Å; K682-L684 PolarHBondContact O-N 3.4Å
685	L	49.6	Very low	54.9	Low	14 Å²	14	52 Å²	52	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-62.3	-48.8	-175	-145.9	82.8	0	0	0	111.9	T671 L673 S681 K682 N687 L688 S689 L693	T671-L685 HydrophobicContact CG2-CD1 3.95Å; L673-L685 HydrophobicContact CD2-CD1 4.46Å; S681-L685 PolarHBondContact O-N 3.31Å; K682-L685 PolarHBondContact O-N 3.31Å; L685-N687 PolarHBondContact O-N 3.39Å; L685-L688 PolarHBondContact O-N 2.69Å; L685-L688 VanDerWaalsContact O-N 3.14Å; L685-S689 PolarHBondContact O-N 3.43Å; L685-S689 PolarHBondContact O-OG 2.79Å; L685-L693 HydrophobicContact CD2-CB 4.08Å; L685-L693 HydrophobicContact CD2-CD1 4.19Å; L685-L693 HydrophobicContact CD2-CG 4.33Å
686	N	46.7	Very low	53.8	Low	104 Å²	104	52.6 Å²	52.6	56%	0.556	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-17.9	-172.2	-73.3	0.4	0	0	0	115	K682	K682-N686 PolarHBondContact O-N 2.77Å
687	N	46.1	Very low	52.3	Low	139 Å²	139	56.6 Å²	56.6	74%	0.743	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-13.2	-178.9	-72.2	-20.3	0	0	0	113.6	L685	L685-N687 PolarHBondContact O-N 3.39Å
688	L	47.8	Very low	50.9	Low	76 Å²	76	62 Å²	62	40%	0.398	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-31.2	-167.5	-91.3	67.1	0	0	0	114.8	P198 L685	P198-L688 HydrophobicContact CB-CD2 3.67Å; P198-L688 HydrophobicContact CG-CD2 3.34Å; L685-L688 PolarHBondContact O-N 2.69Å; L685-L688 VanDerWaalsContact O-N 3.14Å
689	S	49.4	Very low	49.4	Very low	14 Å²	14	69.6 Å²	69.6	10%	0.098	37%	0.374	C	S	.	.			trans	-112.5	144.7	-170.2	59.5	0	0	0	0	115.1	T671 L685 I691 N735	T671-S689 WeakPolarHBondContact OG1-CB 3.48Å; L685-S689 PolarHBondContact O-N 3.43Å; L685-S689 PolarHBondContact O-OG 2.79Å; S689-I691 PolarHBondContact O-N 2.74Å; S689-I691 PolarHBondContact OG-O 2.75Å; S689-N735 PolarHBondContact O-ND2 2.71Å
690	T	50.9	Low	47.8	Very low	75 Å²	75	78.6 Å²	78.6	46%	0.46	41%	0.406	S	S	.	.	S	Bend	trans	-67.1	-7.6	166.1	32.3	0	0	0	0	113.5	D657 N735	D657-T690 PolarHBondContact OD2-OG1 2.69Å; T690-N735 PolarHBondContact O-N 3.18Å
691	I	55.7	Low	46.3	Very low	13 Å²	13	83.2 Å²	83.2	7%	0.067	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.9	-171.6	-58.2	159.1	0	0	0	108.6	V655 D657 S689 L732 Y733 L734 L800	V655-I691 HydrophobicContact CG1-CD1 3.85Å; D657-I691 HydrophobicContact CB-CD1 4.24Å; S689-I691 PolarHBondContact O-N 2.74Å; S689-I691 PolarHBondContact OG-O 2.75Å; I691-L732 HydrophobicContact CG2-CD2 3.73Å; I691-Y733 CarbonylContact C-O 3.46Å; I691-Y733 WeakPolarHBondContact CA-O 3.48Å; I691-L734 HydrophobicContact CG1-CD2 4.4Å; I691-L800 HydrophobicContact CD1-CD1 4.2Å; I691-L800 HydrophobicContact CD1-CD2 3.44Å; I691-L800 VanDerWaalsContact CD1-CD2 3.44Å; I691-L800 HydrophobicContact CD1-CG 4.45Å; I691-L800 HydrophobicContact CG1-CD2 4.49Å
692	G	54.5	Low	45.2	Very low	5 Å²	5	89.7 Å²	89.7	5%	0.052	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	151.8	173.5	0	0	0	0	0	111.9	Y733	G692-Y733 PolarHBondContact N-O 3.4Å; G692-Y733 PolarHBondContact O-N 2.99Å
693	L	59.5	Low	44.3	Very low	20 Å²	20	92.5 Å²	92.5	11%	0.105	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.4	177	-73.6	167.1	0	0	0	110.5	L673 L685 F730 Y731 L732	L673-L693 HydrophobicContact CD1-CD1 3.92Å; L673-L693 HydrophobicContact CD2-CD1 3.65Å; L673-L693 HydrophobicContact CG-CD1 4.3Å; L685-L693 HydrophobicContact CD2-CB 4.08Å; L685-L693 HydrophobicContact CD2-CD1 4.19Å; L685-L693 HydrophobicContact CD2-CG 4.33Å; L693-F730 HydrophobicContact CD2-CD2 3.65Å; L693-F730 HydrophobicContact CD2-CE2 3.93Å; L693-Y731 WeakPolarHBondContact CA-O 3.43Å; L693-L732 HydrophobicContact CD2-CD2 3.54Å; L693-L732 HydrophobicContact CD2-CG 4.05Å; L693-L732 HydrophobicContact CG-CD2 4.48Å
694	T	50.5	Low	44	Very low	52 Å²	52	92.6 Å²	92.6	32%	0.319	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	160.7	168.3	82	0	0	0	0	112.3	Y731 Y733	T694-Y731 PolarHBondContact N-O 3.46Å; T694-Y731 VanDerWaalsContact N-O 3.11Å; T694-Y731 PolarHBondContact O-N 2.93Å; T694-Y733 HydrophobicContact CG2-CD2 4.09Å; T694-Y733 HydrophobicContact CG2-CE2 3.59Å; T694-Y733 WeakPolarHBondContact OG1-CE2 3.25Å; T694-Y733 PolarHBondContact OG1-OH 3.09Å; T694-Y733 VanDerWaalsContact OG1-OH 3.04Å
695	F	51.4	Low	43.5	Very low	44 Å²	44	93.8 Å²	93.8	19%	0.193	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	153.2	-175.4	-57.7	-65.4	0	0	0	110.6	T697 N705 L707 F730	F695-T697 PolarHBondContact O-N 2.8Å; F695-T697 VanDerWaalsContact O-N 3.11Å; F695-N705 WeakPolarHBondContact CG-O 3.22Å; F695-L707 HydrophobicContact CE1-CB 3.55Å; F695-L707 HydrophobicContact CE1-CD1 3.82Å; F695-L707 HydrophobicContact CE1-CG 3.72Å; F695-L707 HydrophobicContact CZ-CB 3.81Å; F695-L707 HydrophobicContact CZ-CD1 4.21Å; F695-L707 HydrophobicContact CZ-CG 4.33Å; F695-F730 HydrophobicContact CD1-CB 3.62Å; F695-F730 HydrophobicContact CE1-CB 3.59Å; F695-F730 HydrophobicContact CE1-CG 4.47Å
696	H	44.2	Very low	43.3	Very low	94 Å²	94	95.1 Å²	95.1	44%	0.435	48%	0.483	S	S	.	.			trans	-75.4	99.5	175.8	-165.3	-46	0	0	0	110.8	N698 Y731	H696-N698 PolarHBondContact CE1-OD1 3.01Å; H696-N698 PolarHBondContact ND1-OD1 3.32Å; H696-N698 PolarHBondContact O-N 2.9Å; H696-N698 VanDerWaalsContact O-N 3.11Å; H696-Y731 HydrophobicContact CB-CE2 4.01Å; H696-Y731 PolarHBondContact CD2-OH 2.89Å; H696-Y731 VanDerWaalsContact CD2-OH 3.25Å
697	T	35.4	Very low	43.3	Very low	118 Å²	118	90.2 Å²	90.2	72%	0.724	46%	0.457	S	S	*	.			trans	-68.1	105.9	167.9	52.8	0	0	0	0	109.6	F695	F695-T697 PolarHBondContact O-N 2.8Å; F695-T697 VanDerWaalsContact O-N 3.11Å
698	N	34.5	Very low	43.7	Very low	123 Å²	123	85.4 Å²	85.4	66%	0.658	43%	0.431	S	S	*	.			trans	-76.2	144.3	166.3	-86.7	-27.8	0	0	0	109.9	H696 Y700	H696-N698 PolarHBondContact CE1-OD1 3.01Å; H696-N698 PolarHBondContact ND1-OD1 3.32Å; H696-N698 PolarHBondContact O-N 2.9Å; H696-N698 VanDerWaalsContact O-N 3.11Å; N698-Y700 VanDerWaalsContact C-N 3.3Å; N698-Y700 PolarHBondContact O-N 2.93Å
699	H	30.7	Very low	44.1	Very low	181 Å²	181	82.6 Å²	82.6	84%	0.838	42%	0.415	S	S	*	.	S	Bend	trans	-85.3	47.2	-148	-160.5	-54.1	0	0	0	115.1
700	Y	32.1	Very low	44.3	Very low	211 Å²	211	86.2 Å²	86.2	83%	0.827	43%	0.431	S	S	*	.	S	Bend	trans	-146.9	117.6	171	-92.2	-78.5	0	0	0	113	N698	N698-Y700 VanDerWaalsContact C-N 3.3Å; N698-Y700 PolarHBondContact O-N 2.93Å
701	N	30.9	Very low	44.3	Very low	147 Å²	147	87.1 Å²	87.1	79%	0.786	44%	0.438	S	S	*	.	S	Bend	trans	66.5	160.4	167.1	-60.4	-10.9	0	0	0	118.2	E703	N701-E703 PolarHBondContact O-N 2.88Å; N701-E703 VanDerWaalsContact O-N 3.12Å
702	N	30.6	Very low	44.1	Very low	174 Å²	174	88.7 Å²	88.7	93%	0.93	45%	0.448	S	S	*	.	S	Bend	trans	-86.2	72.5	-161.6	-61	-18.1	0	0	0	113.2
703	E	35.5	Very low	43.4	Very low	167 Å²	167	95 Å²	95	78%	0.78	49%	0.486	S	S	*	.			trans	-122.4	137.3	169.9	-68.5	-177.4	-179.2	0	0	111.2	N701 N705	N701-E703 PolarHBondContact O-N 2.88Å; N701-E703 VanDerWaalsContact O-N 3.12Å; E703-N705 PolarHBondContact O-N 2.83Å; E703-N705 VanDerWaalsContact O-N 3.15Å
704	E	39.1	Very low	42.4	Very low	108 Å²	108	99.4 Å²	99.4	51%	0.505	51%	0.514	S	S	.	.			trans	-81.9	90.3	-178.9	-65.8	-166	117.5	0	0	109.7	F706 S823	E704-F706 HydrophobicContact CB-CE1 4.25Å; E704-F706 HydrophobicContact CB-CE2 3.85Å; E704-F706 HydrophobicContact CB-CZ 3.7Å; E704-F706 WeakPolarHBondContact O-CD2 3.06Å; E704-F706 WeakPolarHBondContact O-CE2 3.31Å; E704-F706 WeakPolarHBondContact O-CG 3.05Å; E704-F706 PolarHBondContact O-N 2.83Å; E704-S823 WeakPolarHBondContact OE2-CB 3.06Å
705	N	38.5	Very low	41.5	Very low	90 Å²	90	102.6 Å²	102.6	48%	0.481	54%	0.538	S	S	.	.			trans	-64.3	107.7	176.8	-79.2	11.4	0	0	0	111	F695 E703	F695-N705 WeakPolarHBondContact CG-O 3.22Å; E703-N705 PolarHBondContact O-N 2.83Å; E703-N705 VanDerWaalsContact O-N 3.15Å
706	F	44.7	Very low	40.6	Very low	42 Å²	42	105 Å²	105	18%	0.184	56%	0.56	C	S	.	*			trans	-89.8	150	-177.5	-71.5	-63	0	0	0	112.3	P679 E704 I708 C821	P679-F706 HydrophobicContact CG-CB 3.68Å; P679-F706 HydrophobicContact CG-CD1 3.89Å; P679-F706 HydrophobicContact CG-CG 4.2Å; E704-F706 HydrophobicContact CB-CE1 4.25Å; E704-F706 HydrophobicContact CB-CE2 3.85Å; E704-F706 HydrophobicContact CB-CZ 3.7Å; E704-F706 WeakPolarHBondContact O-CD2 3.06Å; E704-F706 WeakPolarHBondContact O-CE2 3.31Å; E704-F706 WeakPolarHBondContact O-CG 3.05Å; E704-F706 PolarHBondContact O-N 2.83Å; F706-I708 VanDerWaalsContact C-N 3.27Å; F706-I708 HydrophobicContact CB-CD1 4.37Å; F706-I708 HydrophobicContact CB-CG1 4.05Å; F706-I708 PolarHBondContact O-N 3.12Å; F706-C821 HydrophobicContact CD2-CB 3.97Å; F706-C821 WeakPolarHBondContact CD2-O 3.41Å; F706-C821 VanDerWaalsContact CE2-O 3.27Å; F706-C821 WeakPolarHBondContact CE2-O 3.44Å; F706-C821 HydrophobicContact CG-CB 4.39Å
707	L	47.9	Very low	39.9	Very low	2 Å²	2	105.7 Å²	105.7	1%	0.01	58%	0.576	C	S	.	*			trans	-65.1	76.6	171	-143.3	176	0	0	0	110.9	L674 P679 F695 T727 F730	L674-L707 HydrophobicContact CD1-CD2 4.34Å; L674-L707 HydrophobicContact CD2-CB 4.32Å; L674-L707 HydrophobicContact CD2-CD2 4.11Å; L674-L707 WeakPolarHBondContact CD2-O 3.36Å; P679-L707 HydrophobicContact CB-CB 4.15Å; P679-L707 HydrophobicContact CG-CB 3.6Å; F695-L707 HydrophobicContact CE1-CB 3.55Å; F695-L707 HydrophobicContact CE1-CD1 3.82Å; F695-L707 HydrophobicContact CE1-CG 3.72Å; F695-L707 HydrophobicContact CZ-CB 3.81Å; F695-L707 HydrophobicContact CZ-CD1 4.21Å; F695-L707 HydrophobicContact CZ-CG 4.33Å; L707-T727 HydrophobicContact CD2-CG2 3.34Å; L707-F730 HydrophobicContact CD1-CB 4.39Å; L707-F730 HydrophobicContact CD1-CD1 3.67Å; L707-F730 HydrophobicContact CD1-CD2 4.36Å; L707-F730 HydrophobicContact CD1-CE1 3.98Å; L707-F730 HydrophobicContact CD1-CG 3.89Å; L707-F730 HydrophobicContact CD1-CZ 4.45Å; L707-F730 HydrophobicContact CD2-CD1 4.13Å; L707-F730 HydrophobicContact CD2-CE1 4.25Å; L707-F730 HydrophobicContact CG-CD1 3.83Å; L707-F730 HydrophobicContact CG-CE1 4.35Å; L707-F730 HydrophobicContact CG-CG 4.33Å
708	I	53.5	Low	39.7	Very low	38 Å²	38	104.6 Å²	104.6	20%	0.195	57%	0.573	C	S	.	*			trans	-95.1	132.3	-178.8	-60.4	173.2	0	0	0	109.9	F706 Q710	F706-I708 VanDerWaalsContact C-N 3.27Å; F706-I708 HydrophobicContact CB-CD1 4.37Å; F706-I708 HydrophobicContact CB-CG1 4.05Å; F706-I708 PolarHBondContact O-N 3.12Å; I708-Q710 HydrophobicContact CB-CG 4.3Å; I708-Q710 HydrophobicContact CG2-CG 3.78Å; I708-Q710 PolarHBondContact O-N 2.91Å
709	F	57.1	Low	39.7	Very low	16 Å²	16	104.7 Å²	104.7	7%	0.07	58%	0.583	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.1	106.3	165.9	-88.1	-81.6	0	0	0	110.1	F613 F634 V650 L674 L725 Q726 T727	F613-F709 HydrophobicContact CE2-CZ 4.43Å; F634-F709 HydrophobicContact CB-CE1 3.95Å; F634-F709 HydrophobicContact CB-CZ 3.69Å; F634-F709 HydrophobicContact CD2-CZ 4.17Å; F634-F709 HydrophobicContact CG-CZ 4.37Å; V650-F709 HydrophobicContact CB-CD2 4.01Å; V650-F709 HydrophobicContact CB-CE2 4.31Å; V650-F709 HydrophobicContact CG1-CD2 4.25Å; V650-F709 HydrophobicContact CG1-CE2 4.17Å; V650-F709 HydrophobicContact CG2-CB 4.42Å; V650-F709 HydrophobicContact CG2-CD1 4.2Å; V650-F709 HydrophobicContact CG2-CD2 3.62Å; V650-F709 HydrophobicContact CG2-CE1 4.3Å; V650-F709 HydrophobicContact CG2-CE2 3.74Å; V650-F709 HydrophobicContact CG2-CG 3.84Å; V650-F709 HydrophobicContact CG2-CZ 4.08Å; L674-F709 HydrophobicContact CD1-CE2 4.05Å; L674-F709 HydrophobicContact CD2-CD2 4.42Å; F709-L725 HydrophobicContact CD1-CB 3.83Å; F709-Q726 CarbonylContact C-O 3.58Å; F709-Q726 WeakPolarHBondContact CA-O 3.36Å; F709-T727 HydrophobicContact CD1-CG2 3.61Å; F709-T727 HydrophobicContact CD2-CG2 3.75Å; F709-T727 HydrophobicContact CE1-CG2 3.49Å; F709-T727 VanDerWaalsContact CE1-CG2 3.49Å; F709-T727 HydrophobicContact CE2-CG2 3.61Å; F709-T727 HydrophobicContact CG-CG2 3.77Å; F709-T727 HydrophobicContact CZ-CG2 3.5Å; F709-T727 VanDerWaalsContact CZ-CG2 3.5Å
710	Q	53.1	Low	40	Very low	91 Å²	91	99.7 Å²	99.7	43%	0.425	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.4	140.6	-179.2	-60.6	-172.5	16	0	0	111.9	I708 Q726	I708-Q710 HydrophobicContact CB-CG 4.3Å; I708-Q710 HydrophobicContact CG2-CG 3.78Å; I708-Q710 PolarHBondContact O-N 2.91Å; Q710-Q726 PolarHBondContact N-O 3.26Å; Q710-Q726 PolarHBondContact O-N 2.82Å; Q710-Q726 VanDerWaalsContact O-N 3.09Å
711	P	51.7	Low	40.7	Very low	94 Å²	94	95.3 Å²	95.3	61%	0.61	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.4	130.6	171.2	31.2	-33.3	0	0	0	110.9	T713 L725	P711-T713 PolarHBondContact O-N 2.83Å; P711-L725 HydrophobicContact CB-CD2 4.34Å
712	T	50.8	Low	41.7	Very low	46 Å²	46	93 Å²	93	28%	0.282	54%	0.544	S	S	.	.			trans	-82.9	104.9	-173.3	53.6	0	0	0	0	112.9	T714 Q726	T712-T714 VanDerWaalsContact C-N 3.28Å; T712-T714 PolarHBondContact O-N 2.97Å; T712-Q726 HydrophobicContact CG2-CB 4.42Å; T712-Q726 VanDerWaalsContact CG2-CD 3.47Å; T712-Q726 HydrophobicContact CG2-CG 3.67Å
713	T	40.3	Very low	43.5	Very low	137 Å²	137	88 Å²	88	84%	0.84	51%	0.514	S	S	*	.			trans	-80.9	69	170.4	57.2	0	0	0	0	111.5	P711 S715	P711-T713 PolarHBondContact O-N 2.83Å; T713-S715 PolarHBondContact O-N 2.97Å
714	T	37.6	Very low	45	Very low	113 Å²	113	82.6 Å²	82.6	69%	0.693	49%	0.489	S	S	*	.			trans	-72.1	97.2	177.8	47	0	0	0	0	111.4	T712 S716	T712-T714 VanDerWaalsContact C-N 3.28Å; T712-T714 PolarHBondContact O-N 2.97Å; T714-S716 PolarHBondContact O-N 2.76Å
715	S	31.7	Very low	46.6	Very low	118 Å²	118	78 Å²	78	83%	0.825	47%	0.468	S	S	*	.			trans	-75	63.4	176.6	59.2	0	0	0	0	112.4	T713	T713-S715 PolarHBondContact O-N 2.97Å
716	S	32.8	Very low	48.5	Very low	95 Å²	95	76.7 Å²	76.7	66%	0.664	46%	0.459	S	S	*	.	S	Bend	trans	-158	116.5	174.4	-49.1	0	0	0	0	112.5	T714	T714-S716 PolarHBondContact O-N 2.76Å
717	S	29.7	Very low	49.8	Very low	108 Å²	108	74.8 Å²	74.8	76%	0.755	45%	0.451	S	S	*	.			trans	52.7	133.5	155.2	49.6	0	0	0	0	121.8
718	S	30.9	Very low	50.8	Low	96 Å²	96	78.3 Å²	78.3	67%	0.671	47%	0.47	S	S	*	.			trans	62.1	84.8	155.2	48.6	0	0	0	0	119.9	S720	S718-S720 PolarHBondContact O-N 3.44Å
719	S	33.8	Very low	51.8	Low	124 Å²	124	79.5 Å²	79.5	87%	0.867	48%	0.476	S	S	*	.				51.7	55.9	119.7	66.6	0	0	0	0	119.2
720	S	37	Very low	52.7	Low	77 Å²	77	78.8 Å²	78.8	54%	0.538	47%	0.473	S	S	.	.			trans	-149.2	141.7	158.7	72.4	0	0	0	0	112.2	S718 H722	S718-S720 PolarHBondContact O-N 3.44Å; S720-H722 VanDerWaalsContact C-N 3.28Å; S720-H722 VanDerWaalsContact CB-ND1 3.3Å; S720-H722 WeakPolarHBondContact CB-ND1 3.08Å; S720-H722 PolarHBondContact O-N 2.85Å; S720-H722 PolarHBondContact OG-ND1 3.29Å
721	N	46.9	Very low	53.7	Low	119 Å²	119	76.6 Å²	76.6	64%	0.636	46%	0.461	S	S	*	.			trans	-89.5	34.8	-172.4	-65.1	-19	0	0	0	113.3	N643 H723	N643-N721 WeakPolarHBondContact OD1-CB 3.32Å; N643-N721 PolarHBondContact OD1-ND2 3.02Å; N721-H723 PolarHBondContact O-CD2 2.81Å; N721-H723 PolarHBondContact O-N 3.09Å
722	H	53.4	Low	54.8	Low	97 Å²	97	72.3 Å²	72.3	45%	0.449	43%	0.433	S	S	.	.			trans	-76.6	119.9	-176.4	-62.8	99.9	0	0	0	111	S720 H724	S720-H722 VanDerWaalsContact C-N 3.28Å; S720-H722 VanDerWaalsContact CB-ND1 3.3Å; S720-H722 WeakPolarHBondContact CB-ND1 3.08Å; S720-H722 PolarHBondContact O-N 2.85Å; S720-H722 PolarHBondContact OG-ND1 3.29Å; H722-H724 VanDerWaalsContact CB-NE2 3.32Å; H722-H724 WeakPolarHBondContact CB-NE2 3.15Å; H722-H724 PolarHBondContact O-CD2 2.87Å; H722-H724 PolarHBondContact O-N 3.27Å
723	H	67	Low	55.7	Low	69 Å²	69	73.5 Å²	73.5	32%	0.319	43%	0.433	S	S	.	.			trans	-87.9	104.6	176.3	-66.3	-82.9	0	0	0	109.8	L638 K646 V648 N721	L638-H723 HydrophobicContact CB-CB 3.97Å; L638-H723 HydrophobicContact CD2-CB 4.11Å; L638-H723 PolarHBondContact N-O 2.85Å; K646-H723 VanDerWaalsContact C-CE1 3.48Å; K646-H723 PolarHBondContact O-CE1 2.9Å; K646-H723 PolarHBondContact O-ND1 2.75Å; V648-H723 HydrophobicContact CG1-CB 4.34Å; N721-H723 PolarHBondContact O-CD2 2.81Å; N721-H723 PolarHBondContact O-N 3.09Å
724	H	68.5	Low	56.9	Low	55 Å²	55	68.5 Å²	68.5	26%	0.255	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	142.5	179.1	-65	-91.8	0	0	0	112.4	A636 E637 H722	A636-H724 WeakPolarHBondContact O-CA 3.39Å; E637-H724 VanDerWaalsContact CG-CE1 3.5Å; E637-H724 WeakPolarHBondContact CG-CE1 3.3Å; E637-H724 IonicContact OE2-CE1 2.72Å; H722-H724 VanDerWaalsContact CB-NE2 3.32Å; H722-H724 WeakPolarHBondContact CB-NE2 3.15Å; H722-H724 PolarHBondContact O-CD2 2.87Å; H722-H724 PolarHBondContact O-N 3.27Å
725	L	72.9	Confident	57.7	Low	12 Å²	12	66.4 Å²	66.4	6%	0.063	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.1	164.1	-59	171.2	0	0	0	109	E635 A636 V648 V650 F709 P711	E635-L725 WeakPolarHBondContact CA-O 3.43Å; A636-L725 HydrophobicContact CB-CB 4.45Å; A636-L725 PolarHBondContact N-O 2.85Å; A636-L725 PolarHBondContact O-N 2.75Å; V648-L725 HydrophobicContact CG1-CD1 4.01Å; V648-L725 HydrophobicContact CG1-CG 4.05Å; V648-L725 HydrophobicContact CG2-CD1 4.3Å; V650-L725 HydrophobicContact CG2-CD1 4.24Å; F709-L725 HydrophobicContact CD1-CB 3.83Å; P711-L725 HydrophobicContact CB-CD2 4.34Å
726	Q	77.1	Confident	58.3	Low	61 Å²	61	63.1 Å²	63.1	29%	0.285	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	156.1	171.3	69.4	176.9	7.5	0	0	111	F634 F709 Q710 T712	F634-Q726 CarbonylContact O-C 3.45Å; F634-Q726 WeakPolarHBondContact O-CA 3.15Å; F709-Q726 CarbonylContact C-O 3.58Å; F709-Q726 WeakPolarHBondContact CA-O 3.36Å; Q710-Q726 PolarHBondContact N-O 3.26Å; Q710-Q726 PolarHBondContact O-N 2.82Å; Q710-Q726 VanDerWaalsContact O-N 3.09Å; T712-Q726 HydrophobicContact CG2-CB 4.42Å; T712-Q726 VanDerWaalsContact CG2-CD 3.47Å; T712-Q726 HydrophobicContact CG2-CG 3.67Å
727	T	72.8	Confident	58.2	Low	3 Å²	3	64.5 Å²	64.5	2%	0.018	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	160.1	167.9	71.9	0	0	0	0	112.2	R633 F634 L707 F709	R633-T727 WeakPolarHBondContact CA-OG1 2.92Å; R633-T727 WeakPolarHBondContact CB-O 3.39Å; R633-T727 WeakPolarHBondContact CB-OG1 3.37Å; F634-T727 HydrophobicContact CB-CG2 3.93Å; F634-T727 HydrophobicContact CD2-CG2 4.21Å; F634-T727 PolarHBondContact N-OG1 2.91Å; F634-T727 PolarHBondContact O-N 3.13Å; L707-T727 HydrophobicContact CD2-CG2 3.34Å; F709-T727 HydrophobicContact CD1-CG2 3.61Å; F709-T727 HydrophobicContact CD2-CG2 3.75Å; F709-T727 HydrophobicContact CE1-CG2 3.49Å; F709-T727 VanDerWaalsContact CE1-CG2 3.49Å; F709-T727 HydrophobicContact CE2-CG2 3.61Å; F709-T727 HydrophobicContact CG-CG2 3.77Å; F709-T727 HydrophobicContact CZ-CG2 3.5Å; F709-T727 VanDerWaalsContact CZ-CG2 3.5Å
728	D	69.3	Low	58.1	Low	75 Å²	75	66.4 Å²	66.4	40%	0.401	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-61	164.6	158.1	-76.4	-34.2	0	0	0	112
729	L	74.4	Confident	57.9	Low	64 Å²	64	72.4 Å²	72.4	34%	0.335	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-78	130.8	179.5	-69.5	168.5	0	0	0	111.7	P631 I632 R633	P631-L729 HydrophobicContact CB-CB 4.46Å; P631-L729 HydrophobicContact CB-CD2 4.39Å; I632-L729 WeakPolarHBondContact O-CA 3.31Å; R633-L729 HydrophobicContact CB-CD2 3.98Å; R633-L729 HydrophobicContact CG-CD2 3.87Å
730	F	74.7	Confident	57.5	Low	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	164.4	179.1	67.1	-91	0	0	0	111.8	P631 I632 F634 L693 F695 L707 L732	P631-F730 WeakPolarHBondContact CA-O 3.31Å; I632-F730 HydrophobicContact CD1-CE2 3.59Å; I632-F730 HydrophobicContact CD1-CZ 3.63Å; I632-F730 HydrophobicContact CG1-CD2 4.11Å; I632-F730 HydrophobicContact CG1-CE1 4.29Å; I632-F730 HydrophobicContact CG1-CE2 3.63Å; I632-F730 HydrophobicContact CG1-CZ 3.71Å; I632-F730 PolarHBondContact N-O 3.26Å; I632-F730 WeakPolarHBondContact O-CD1 3.43Å; I632-F730 PolarHBondContact O-N 2.86Å; F634-F730 HydrophobicContact CD2-CE1 4.01Å; F634-F730 HydrophobicContact CD2-CZ 4.09Å; F634-F730 HydrophobicContact CE1-CZ 4.06Å; F634-F730 AromaticContact CE2-CE1 3.89Å; F634-F730 HydrophobicContact CE2-CE1 3.89Å; F634-F730 AromaticContact CE2-CZ 3.53Å; F634-F730 HydrophobicContact CE2-CZ 3.53Å; F634-F730 HydrophobicContact CG-CE1 4.48Å; F634-F730 HydrophobicContact CZ-CE1 4.25Å; F634-F730 HydrophobicContact CZ-CE2 4.41Å; F634-F730 AromaticContact CZ-CZ 3.5Å; F634-F730 HydrophobicContact CZ-CZ 3.5Å; F634-F730 VanDerWaalsContact CZ-CZ 3.5Å; L693-F730 HydrophobicContact CD2-CD2 3.65Å; L693-F730 HydrophobicContact CD2-CE2 3.93Å; F695-F730 HydrophobicContact CD1-CB 3.62Å; F695-F730 HydrophobicContact CE1-CB 3.59Å; F695-F730 HydrophobicContact CE1-CG 4.47Å; L707-F730 HydrophobicContact CD1-CB 4.39Å; L707-F730 HydrophobicContact CD1-CD1 3.67Å; L707-F730 HydrophobicContact CD1-CD2 4.36Å; L707-F730 HydrophobicContact CD1-CE1 3.98Å; L707-F730 HydrophobicContact CD1-CG 3.89Å; L707-F730 HydrophobicContact CD1-CZ 4.45Å; L707-F730 HydrophobicContact CD2-CD1 4.13Å; L707-F730 HydrophobicContact CD2-CE1 4.25Å; L707-F730 HydrophobicContact CG-CD1 3.83Å; L707-F730 HydrophobicContact CG-CE1 4.35Å; L707-F730 HydrophobicContact CG-CG 4.33Å; F730-L732 HydrophobicContact CE2-CG 4.48Å
731	Y	75.1	Confident	57.2	Low	46 Å²	46	78.8 Å²	78.8	18%	0.18	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.1	-173.7	-59.9	-78.9	0	0	0	111.3	S629 P631 L693 T694 H696 Y733	S629-Y731 WeakPolarHBondContact O-CD1 3.31Å; P631-Y731 HydrophobicContact CB-CD1 4.13Å; P631-Y731 HydrophobicContact CB-CE1 3.66Å; P631-Y731 HydrophobicContact CG-CE1 4.15Å; L693-Y731 WeakPolarHBondContact CA-O 3.43Å; T694-Y731 PolarHBondContact N-O 3.46Å; T694-Y731 VanDerWaalsContact N-O 3.11Å; T694-Y731 PolarHBondContact O-N 2.93Å; H696-Y731 HydrophobicContact CB-CE2 4.01Å; H696-Y731 PolarHBondContact CD2-OH 2.89Å; H696-Y731 VanDerWaalsContact CD2-OH 3.25Å; Y731-Y733 VanDerWaalsContact CB-CE2 3.41Å; Y731-Y733 WeakPolarHBondContact CB-OH 3.4Å; Y731-Y733 HydrophobicContact CG-CE2 4.49Å
732	L	74	Confident	56.2	Low	3 Å²	3	77.2 Å²	77.2	2%	0.016	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138	173.8	-74.9	157.3	0	0	0	111.3	I626 S629 I632 I691 L693 F730 L800 F802 L849 L851	I626-L732 HydrophobicContact CD1-CD1 3.79Å; S629-L732 PolarHBondContact N-O 2.73Å; I632-L732 HydrophobicContact CD1-CD1 3.6Å; I632-L732 HydrophobicContact CD1-CG 4.46Å; I632-L732 HydrophobicContact CG1-CD1 4.48Å; I691-L732 HydrophobicContact CG2-CD2 3.73Å; L693-L732 HydrophobicContact CD2-CD2 3.54Å; L693-L732 HydrophobicContact CD2-CG 4.05Å; L693-L732 HydrophobicContact CG-CD2 4.48Å; F730-L732 HydrophobicContact CE2-CG 4.48Å; L732-L800 HydrophobicContact CD1-CD1 4.49Å; L732-L800 HydrophobicContact CD2-CD1 4.45Å; L732-F802 HydrophobicContact CD1-CZ 4.01Å; L732-F802 HydrophobicContact CD2-CZ 4.18Å; L732-L849 HydrophobicContact CD1-CD2 3.94Å; L732-L851 HydrophobicContact CB-CD1 4.41Å
733	Y	69.8	Low	55	Low	71 Å²	71	79.7 Å²	79.7	28%	0.278	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	158.7	176.6	-51.2	-95.2	0	0	0	110.6	E628 I691 G692 T694 Y731	E628-Y733 WeakPolarHBondContact OE1-CA 3.35Å; I691-Y733 CarbonylContact C-O 3.46Å; I691-Y733 WeakPolarHBondContact CA-O 3.48Å; G692-Y733 PolarHBondContact N-O 3.4Å; G692-Y733 PolarHBondContact O-N 2.99Å; T694-Y733 HydrophobicContact CG2-CD2 4.09Å; T694-Y733 HydrophobicContact CG2-CE2 3.59Å; T694-Y733 WeakPolarHBondContact OG1-CE2 3.25Å; T694-Y733 PolarHBondContact OG1-OH 3.09Å; T694-Y733 VanDerWaalsContact OG1-OH 3.04Å; Y731-Y733 VanDerWaalsContact CB-CE2 3.41Å; Y731-Y733 WeakPolarHBondContact CB-OH 3.4Å; Y731-Y733 HydrophobicContact CG-CE2 4.49Å
734	L	64.7	Low	53.2	Low	32 Å²	32	84.3 Å²	84.3	17%	0.168	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.6	173.6	-69.7	154.7	0	0	0	111.1	E628 I691 G736 Y798 L851 E853	E628-L734 PolarHBondContact OE1-N 2.99Å; I691-L734 HydrophobicContact CG1-CD2 4.4Å; L734-G736 VanDerWaalsContact C-N 3.3Å; L734-G736 PolarHBondContact O-N 2.79Å; L734-Y798 HydrophobicContact CD1-CD2 3.9Å; L734-Y798 HydrophobicContact CD1-CE1 4.4Å; L734-Y798 HydrophobicContact CD1-CE2 3.35Å; L734-Y798 HydrophobicContact CD2-CD1 4.23Å; L734-Y798 HydrophobicContact CD2-CE1 3.97Å; L734-Y798 HydrophobicContact CD2-CE2 4.33Å; L734-Y798 HydrophobicContact CG-CE2 4.49Å; L734-L851 HydrophobicContact CD1-CD2 4.13Å; L734-L851 HydrophobicContact CD2-CD2 4.41Å; L734-L851 HydrophobicContact CG-CD2 4.08Å; L734-E853 HydrophobicContact CD1-CB 3.84Å; L734-E853 HydrophobicContact CD1-CG 4.05Å
735	N	56	Low	51.2	Low	69 Å²	69	87.3 Å²	87.3	37%	0.369	46%	0.462	S	S	.	.			trans	-77.5	77.8	178.8	-72.8	-20.8	0	0	0	110.5	S689 T690	S689-N735 PolarHBondContact O-ND2 2.71Å; T690-N735 PolarHBondContact O-N 3.18Å
736	G	44.2	Very low	49.1	Very low	50 Å²	50	94.9 Å²	94.9	52%	0.515	50%	0.495	S	S	.	.			trans	-66.3	164.2	168.8	0	0	0	0	0	113	L734 L738	L734-G736 VanDerWaalsContact C-N 3.3Å; L734-G736 PolarHBondContact O-N 2.79Å; G736-L738 PolarHBondContact O-N 2.9Å
737	P	31.2	Very low	46.7	Very low	123 Å²	123	98.9 Å²	98.9	80%	0.799	52%	0.517	S	S	*	.			trans	-59.6	122	179.6	24.2	-33.5	0	0	0	111.5	Y739	P737-Y739 PolarHBondContact O-N 3.21Å
738	L	26.5	Very low	44.6	Very low	148 Å²	148	105.6 Å²	105.6	78%	0.775	55%	0.551	S	S	*	*			trans	-72.2	85.6	-162.6	-169.3	79.7	0	0	0	113.9	G736 I740	G736-L738 PolarHBondContact O-N 2.9Å; L738-I740 HydrophobicContact CD2-CD1 3.97Å; L738-I740 HydrophobicContact CD2-CG1 3.69Å; L738-I740 HydrophobicContact CG-CG1 3.83Å; L738-I740 PolarHBondContact O-N 3Å; L738-I740 VanDerWaalsContact O-N 3.17Å
739	Y	27.3	Very low	42.6	Very low	223 Å²	223	108.4 Å²	108.4	88%	0.875	57%	0.566	S	S	*	*			trans	-76.9	95.1	161.5	-84.8	-80.9	0	0	0	110.3	P737 Q741	P737-Y739 PolarHBondContact O-N 3.21Å; Y739-Q741 PolarHBondContact O-N 3.27Å; Y739-Q741 VanDerWaalsContact O-N 3.07Å
740	I	25.4	Very low	40.3	Very low	146 Å²	146	113.8 Å²	113.8	75%	0.749	59%	0.587	S	S	*	*			trans	-67	102.9	174.5	-55.4	172.4	0	0	0	109.2	L738	L738-I740 HydrophobicContact CD2-CD1 3.97Å; L738-I740 HydrophobicContact CD2-CG1 3.69Å; L738-I740 HydrophobicContact CG-CG1 3.83Å; L738-I740 PolarHBondContact O-N 3Å; L738-I740 VanDerWaalsContact O-N 3.17Å
741	Q	29.9	Very low	38.1	Very low	189 Å²	189	119.5 Å²	119.5	88%	0.883	62%	0.622	S	S	*	*			trans	-144.4	138.1	154.3	-145.3	163.1	15.1	0	0	113.9	Y739	Y739-Q741 PolarHBondContact O-N 3.27Å; Y739-Q741 VanDerWaalsContact O-N 3.07Å
742	S	26.6	Very low	35.9	Very low	86 Å²	86	124.1 Å²	124.1	60%	0.601	65%	0.648	S	S	*	*			trans	-78.2	157.7	-164.6	56.4	0	0	0	0	115.8
743	N	27.2	Very low	33.7	Very low	148 Å²	148	133.4 Å²	133.4	79%	0.791	69%	0.688	S	S	*	*			trans	87.5	145.4	149.9	-59.1	-30	0	0	0	120.1
744	Q	30.6	Very low	32	Very low	166 Å²	166	137.2 Å²	137.2	78%	0.776	71%	0.712	S	S	*	*			trans	74	88.7	168.9	-57.5	-167	7.2	0	0	117.7	K746	Q744-K746 PolarHBondContact O-N 2.68Å
745	S	26.1	Very low	30.4	Very low	119 Å²	119	142.6 Å²	142.6	83%	0.832	74%	0.741	S	S	*	*			trans	-54.2	128.4	154	43.7	0	0	0	0	111.7
746	K	27.6	Very low	29.2	Very low	170 Å²	170	146.5 Å²	146.5	74%	0.739	76%	0.761	S	S	*	*			trans	-132.8	101.4	162.2	-97.1	177	178.8	163.6	0	109.7	Q744 I748	Q744-K746 PolarHBondContact O-N 2.68Å; K746-I748 PolarHBondContact O-N 3.41Å
747	I	27.7	Very low	28.9	Very low	146 Å²	146	150.2 Å²	150.2	75%	0.749	77%	0.769	S	S	*	*			trans	-63.3	114.3	173.2	-63.5	164.9	0	0	0	108.4	N749	I747-N749 HydrophobicContact CG2-CB 4.49Å; I747-N749 WeakPolarHBondContact CG2-OD1 3.14Å
748	I	27.6	Very low	29.2	Very low	144 Å²	144	150.3 Å²	150.3	74%	0.738	76%	0.764	S	S	*	*			trans	-107	77.6	173.6	-54.2	-176.4	0	0	0	108.7	K746 K750	K746-I748 PolarHBondContact O-N 3.41Å; I748-K750 HydrophobicContact CG2-CB 4.42Å; I748-K750 PolarHBondContact O-N 3.04Å
749	N	27.7	Very low	29.5	Very low	133 Å²	133	149.8 Å²	149.8	71%	0.711	76%	0.762	S	S	*	*			trans	-68.9	78.8	171.7	-76.6	-1	0	0	0	110.3	I747 T751	I747-N749 HydrophobicContact CG2-CB 4.49Å; I747-N749 WeakPolarHBondContact CG2-OD1 3.14Å; N749-T751 PolarHBondContact O-N 3.11Å
750	K	25.8	Very low	29.9	Very low	178 Å²	178	146 Å²	146	77%	0.774	76%	0.756	S	S	*	*			trans	-76.7	64.6	-177.4	-161	177	-176.8	-179.8	0	111.8	I748 I752	I748-K750 HydrophobicContact CG2-CB 4.42Å; I748-K750 PolarHBondContact O-N 3.04Å; K750-I752 PolarHBondContact O-N 3.13Å; K750-I752 VanDerWaalsContact O-N 3.11Å
751	T	28.1	Very low	30.4	Very low	120 Å²	120	147 Å²	147	74%	0.736	76%	0.763	S	S	*	*			trans	-63.6	107.5	175.8	45.2	0	0	0	0	110.7	N749 K753	N749-T751 PolarHBondContact O-N 3.11Å; T751-K753 VanDerWaalsContact C-N 3.3Å; T751-K753 PolarHBondContact O-N 3.18Å
752	I	30.6	Very low	30.3	Very low	142 Å²	142	147.4 Å²	147.4	73%	0.728	76%	0.762	S	S	*	*			trans	-79.6	79.2	-179.7	-53.5	-176.9	0	0	0	109.6	K750 I754	K750-I752 PolarHBondContact O-N 3.13Å; K750-I752 VanDerWaalsContact O-N 3.11Å; I752-I754 HydrophobicContact CG2-CG1 4.02Å; I752-I754 PolarHBondContact O-N 3.11Å
753	K	27.3	Very low	30.5	Very low	198 Å²	198	150.3 Å²	150.3	86%	0.861	77%	0.769	S	S	*	*			trans	-73.1	98.6	167.1	-94.1	-176.1	172.5	177.1	0	110.1	T751 N755	T751-K753 VanDerWaalsContact C-N 3.3Å; T751-K753 PolarHBondContact O-N 3.18Å; K753-N755 PolarHBondContact O-N 3.35Å
754	I	34.7	Very low	30.4	Very low	151 Å²	151	149.6 Å²	149.6	77%	0.774	77%	0.765	S	S	*	*			trans	-80	111.1	165.4	-57.3	-176.4	0	0	0	107.9	I752	I752-I754 HydrophobicContact CG2-CG1 4.02Å; I752-I754 PolarHBondContact O-N 3.11Å
755	N	30.7	Very low	30.2	Very low	145 Å²	145	150.5 Å²	150.5	78%	0.775	77%	0.767	S	S	*	*			trans	-77.8	127.8	178.4	-166.7	19.1	0	0	0	110.1	K753	K753-N755 PolarHBondContact O-N 3.35Å
756	N	29.9	Very low	30.3	Very low	151 Å²	151	150.1 Å²	150.1	81%	0.807	76%	0.755	S	S	*	*			trans	-96.2	118.6	-167.8	-157.6	8.7	0	0	0	110.6
757	N	37.6	Very low	30.3	Very low	128 Å²	128	151.8 Å²	151.8	68%	0.684	76%	0.763	S	S	*	*			trans	-149.3	103.7	178.2	-117.9	-23.7	0	0	0	112.6
758	N	37.4	Very low	30.1	Very low	126 Å²	126	150.4 Å²	150.4	67%	0.674	76%	0.756	S	S	*	*			trans	61.9	91.9	153.6	-58.8	-21.5	0	0	0	120.7
759	N	34.2	Very low	30.1	Very low	137 Å²	137	151.9 Å²	151.9	73%	0.733	76%	0.758	S	S	*	*				86.2	132.7	121	-60.8	-12.9	0	0	0	121.7
760	N	34	Very low	30	Very low	143 Å²	143	154.6 Å²	154.6	77%	0.765	76%	0.764	S	S	*	*			trans	77.3	58.7	149.9	-56.3	-6.4	0	0	0	119.6
761	N	36.9	Very low	30.1	Very low	166 Å²	166	152.3 Å²	152.3	89%	0.888	76%	0.755	S	S	*	*				-171.9	132	105.2	-91.3	-24.8	0	0	0	111.8	I763	N761-I763 PolarHBondContact O-N 3.44Å
762	K	26.9	Very low	30	Very low	199 Å²	199	152.3 Å²	152.3	87%	0.865	75%	0.751	S	S	*	*			trans	-83.1	111.6	-170.8	-75	-179.7	175.1	177.8	0	113
763	I	30.9	Very low	29.9	Very low	147 Å²	147	153.3 Å²	153.3	75%	0.754	75%	0.753	S	S	*	*			trans	-132.6	93.5	145	-57.8	-177.5	0	0	0	107.8	N761 K765	N761-I763 PolarHBondContact O-N 3.44Å; I763-K765 VanDerWaalsContact C-N 3.28Å; I763-K765 HydrophobicContact CG2-CG 4.13Å; I763-K765 PolarHBondContact O-N 3.44Å
764	N	25.6	Very low	29.9	Very low	132 Å²	132	150.6 Å²	150.6	71%	0.706	75%	0.753	S	S	*	*			trans	-74.5	81.6	172.7	-75.7	18.9	0	0	0	109.7	N766	N764-N766 PolarHBondContact O-N 2.77Å
765	K	27.6	Very low	29.9	Very low	186 Å²	186	147 Å²	147	81%	0.809	74%	0.735	S	S	*	*			trans	-75.6	75.4	159.6	-81.9	-170.4	175.9	-173.5	0	109.2	I763 F767	I763-K765 VanDerWaalsContact C-N 3.28Å; I763-K765 HydrophobicContact CG2-CG 4.13Å; I763-K765 PolarHBondContact O-N 3.44Å; K765-F767 PolarHBondContact O-N 2.79Å
766	N	28.1	Very low	29.9	Very low	110 Å²	110	148.4 Å²	148.4	59%	0.588	74%	0.742	S	S	*	*			trans	-55.1	131.1	158.3	-64.6	1.3	0	0	0	107.1	N764 L768	N764-N766 PolarHBondContact O-N 2.77Å; N766-L768 HydrophobicContact CB-CD1 4.41Å; N766-L768 PolarHBondContact O-N 2.95Å
767	F	26.7	Very low	30.1	Very low	205 Å²	205	148.7 Å²	148.7	90%	0.899	74%	0.738	S	S	*	*			trans	-70.2	87.1	157	-90.6	-93	0	0	0	106.6	K765 F769	K765-F767 PolarHBondContact O-N 2.79Å; F767-F769 PolarHBondContact O-N 3.31Å; F767-F769 VanDerWaalsContact O-N 3.12Å
768	L	24.4	Very low	30	Very low	117 Å²	117	148.4 Å²	148.4	61%	0.613	73%	0.733	S	S	*	*			trans	-71.4	104.7	177.6	-149.9	86.6	0	0	0	107.3	N766 F770	N766-L768 HydrophobicContact CB-CD1 4.41Å; N766-L768 PolarHBondContact O-N 2.95Å; L768-F770 PolarHBondContact O-N 2.83Å
769	F	26.1	Very low	30	Very low	175 Å²	175	145.6 Å²	145.6	77%	0.768	72%	0.718	S	S	*	*			trans	-54.7	129	154.5	-80.4	-102.3	0	0	0	106.6	F767 H771	F767-F769 PolarHBondContact O-N 3.31Å; F767-F769 VanDerWaalsContact O-N 3.12Å; F769-H771 VanDerWaalsContact C-N 3.3Å; F769-H771 PolarHBondContact O-N 3.04Å
770	F	27.3	Very low	30.3	Very low	191 Å²	191	147.3 Å²	147.3	84%	0.838	73%	0.727	S	S	*	*			trans	-70.3	88.3	-173.9	-84	-85.6	0	0	0	110.7	L768	L768-F770 PolarHBondContact O-N 2.83Å
771	H	27.4	Very low	30.6	Very low	129 Å²	129	146.8 Å²	146.8	60%	0.597	72%	0.723	S	S	*	*			trans	-101.6	128.9	176.9	-165.6	81	0	0	0	108.7	F769	F769-H771 VanDerWaalsContact C-N 3.3Å; F769-H771 PolarHBondContact O-N 3.04Å
772	N	26.4	Very low	31.2	Very low	121 Å²	121	142 Å²	142	65%	0.647	70%	0.697	S	S	*	*	S	Bend	trans	76.4	114.5	-173	-62	-41.1	0	0	0	118.4
773	Q	28.3	Very low	32.7	Very low	163 Å²	163	136.1 Å²	136.1	76%	0.762	68%	0.675	S	S	*	*	S	Bend	trans	74.2	137.5	133.3	-64.1	174	-16.7	0	0	120.9
774	T	27.5	Very low	33.9	Very low	141 Å²	141	133.6 Å²	133.6	87%	0.865	66%	0.663	S	S	*	*			trans	56.4	65.6	159	54.2	0	0	0	0	118.3
775	I	33.1	Very low	35.6	Very low	76 Å²	76	131.4 Å²	131.4	39%	0.39	65%	0.65	S	S	.	*			trans	-140.5	77	162.3	-47.3	178.7	0	0	0	110.8	Q778 L779	I775-Q778 HydrophobicContact CG2-CB 3.73Å; I775-Q778 HydrophobicContact CG2-CG 4.26Å; I775-L779 HydrophobicContact CG2-CD1 4.21Å
776	N	30.8	Very low	37.2	Very low	173 Å²	173	129.4 Å²	129.4	93%	0.925	64%	0.639	S	S	*	*	S	Bend	trans	-92.8	-13.6	173.6	-95.3	30.3	0	0	0	114.1
777	E	34.3	Very low	38.7	Very low	157 Å²	157	125.7 Å²	125.7	73%	0.734	62%	0.617	S	S	*	*	S	Bend	trans	-104.9	-4.3	-172.4	-67.2	-172.7	136.7	0	0	115.3
778	Q	35.3	Very low	40.4	Very low	123 Å²	123	121.7 Å²	121.7	58%	0.575	60%	0.601	S	S	*	*	S	Bend	trans	-118	-2.4	-169.3	-59.6	-173.5	-25.5	0	0	115.8	I775 N780	I775-Q778 HydrophobicContact CG2-CB 3.73Å; I775-Q778 HydrophobicContact CG2-CG 4.26Å; Q778-N780 PolarHBondContact O-N 3.03Å
779	L	37.9	Very low	42.3	Very low	67 Å²	67	121 Å²	121	35%	0.351	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-76.7	-14.8	-176.9	-98.2	89.6	0	0	0	115.3	I775 L781	I775-L779 HydrophobicContact CG2-CD1 4.21Å; L779-L781 PolarHBondContact O-N 3.28Å; L779-L781 VanDerWaalsContact O-N 3.13Å
780	N	40.2	Very low	44.1	Very low	173 Å²	173	114 Å²	114	93%	0.925	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-73.6	3.5	176.8	-73.2	-12.2	0	0	0	113.7	Q778	Q778-N780 PolarHBondContact O-N 3.03Å
781	L	40.4	Very low	45.9	Very low	131 Å²	131	108.7 Å²	108.7	69%	0.686	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-124.1	38.4	-176.4	-147.7	102.2	0	0	0	113.5	L779 D783	L779-L781 PolarHBondContact O-N 3.28Å; L779-L781 VanDerWaalsContact O-N 3.13Å; L781-D783 PolarHBondContact O-N 3.07Å
782	I	49.8	Very low	47.7	Very low	67 Å²	67	109.6 Å²	109.6	34%	0.344	55%	0.548	S	S	.	.			trans	-74.2	84	165.5	-57.7	179.6	0	0	0	108.1	Y850	I782-Y850 HydrophobicContact CD1-CE2 4.05Å
783	D	57.9	Low	49.6	Very low	75 Å²	75	109.6 Å²	109.6	40%	0.401	55%	0.547	S	S	.	.			trans	-43.5	145.6	-173.7	-70.8	-40	0	0	0	113.9	L781 I785 Y786 K787	L781-D783 PolarHBondContact O-N 3.07Å; D783-I785 HydrophobicContact CB-CB 3.77Å; D783-I785 HydrophobicContact CB-CD1 4.38Å; D783-I785 HydrophobicContact CB-CG1 4.1Å; D783-I785 PolarHBondContact O-N 3.32Å; D783-I785 VanDerWaalsContact O-N 3.13Å; D783-Y786 WeakPolarHBondContact O-CA 3.22Å; D783-Y786 WeakPolarHBondContact O-CB 3.37Å; D783-Y786 PolarHBondContact O-N 3.45Å; D783-K787 PolarHBondContact O-N 3.49Å
784	D	56.6	Low	51.5	Low	94 Å²	94	102.1 Å²	102.1	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-60.3	-21	164.5	-75	-50.5	0	0	0	112.1	K660 Y786 K787 Q788	K660-D784 IonicContact NZ-OD1 2.98Å; K660-D784 PolarHBondContact NZ-OD1 2.88Å; K660-D784 IonicContact NZ-OD2 3.8Å; K660-D784 PolarHBondContact NZ-OD2 3.13Å; D784-Y786 VanDerWaalsContact C-N 3.27Å; D784-Y786 PolarHBondContact O-N 2.92Å; D784-K787 PolarHBondContact O-N 2.68Å; D784-Q788 VanDerWaalsContact O-CB 3.23Å; D784-Q788 WeakPolarHBondContact O-CB 3.47Å; D784-Q788 PolarHBondContact O-N 2.66Å
785	I	60.6	Low	53.6	Low	85 Å²	85	99.7 Å²	99.7	44%	0.436	49%	0.49	S	S	.	.	H	α-helix	trans	-57.2	-37.7	166.7	-55.9	172.9	0	0	0	111.5	D783 K789	D783-I785 HydrophobicContact CB-CB 3.77Å; D783-I785 HydrophobicContact CB-CD1 4.38Å; D783-I785 HydrophobicContact CB-CG1 4.1Å; D783-I785 PolarHBondContact O-N 3.32Å; D783-I785 VanDerWaalsContact O-N 3.13Å; I785-K789 HydrophobicContact CG2-CD 4.15Å; I785-K789 WeakPolarHBondContact O-CB 3.5Å; I785-K789 VanDerWaalsContact O-CG 3.27Å; I785-K789 WeakPolarHBondContact O-CG 3.02Å; I785-K789 PolarHBondContact O-N 3.44Å
786	Y	61.6	Low	55.4	Low	145 Å²	145	100.3 Å²	100.3	57%	0.569	49%	0.49	S	S	*	.	H	α-helix	trans	-74.4	-41.9	179	-149.1	-81.5	0	0	0	111	D783 D784 Q788 K789 L790	D783-Y786 WeakPolarHBondContact O-CA 3.22Å; D783-Y786 WeakPolarHBondContact O-CB 3.37Å; D783-Y786 PolarHBondContact O-N 3.45Å; D784-Y786 VanDerWaalsContact C-N 3.27Å; D784-Y786 PolarHBondContact O-N 2.92Å; Y786-Q788 VanDerWaalsContact C-N 3.31Å; Y786-Q788 PolarHBondContact O-N 2.75Å; Y786-K789 PolarHBondContact O-N 2.97Å; Y786-L790 HydrophobicContact CD1-CD1 3.97Å; Y786-L790 HydrophobicContact CD1-CG 4.24Å; Y786-L790 HydrophobicContact CE1-CD1 4.2Å; Y786-L790 HydrophobicContact CE1-CG 4.36Å; Y786-L790 WeakPolarHBondContact O-CG 3.33Å; Y786-L790 PolarHBondContact O-N 2.74Å
787	K	60.9	Low	57.3	Low	32 Å²	32	93.5 Å²	93.5	14%	0.139	45%	0.453	C	S	.	.	H	α-helix	trans	-62.3	-39.2	173	-55	-159.8	-176	-156.7	0	111.2	D783 D784 L790 N791 L797	D783-K787 PolarHBondContact O-N 3.49Å; D784-K787 PolarHBondContact O-N 2.68Å; K787-L790 PolarHBondContact O-N 2.76Å; K787-N791 VanDerWaalsContact O-CG 3.31Å; K787-N791 PolarHBondContact O-N 3.33Å; K787-N791 VanDerWaalsContact O-N 3.11Å; K787-N791 PolarHBondContact O-ND2 2.81Å; K787-L797 HydrophobicContact CD-CD2 4.27Å; K787-L797 HydrophobicContact CG-CD2 4.11Å
788	Q	61.1	Low	59.2	Low	120 Å²	120	87.5 Å²	87.5	56%	0.561	42%	0.424	S	S	*	.	H	α-helix	trans	-65	-44.6	175.3	-171.2	175.3	15.2	0	0	112.6	D784 Y786 L790 N791 E792	D784-Q788 VanDerWaalsContact O-CB 3.23Å; D784-Q788 WeakPolarHBondContact O-CB 3.47Å; D784-Q788 PolarHBondContact O-N 2.66Å; Y786-Q788 VanDerWaalsContact C-N 3.31Å; Y786-Q788 PolarHBondContact O-N 2.75Å; Q788-L790 PolarHBondContact O-N 3.46Å; Q788-N791 WeakPolarHBondContact O-CB 3.03Å; Q788-N791 PolarHBondContact O-N 2.7Å; Q788-E792 PolarHBondContact O-N 2.85Å
789	K	64.6	Low	61.1	Low	104 Å²	104	83.2 Å²	83.2	45%	0.452	40%	0.404	S	S	.	.	H	α-helix	trans	-64.3	-36.7	175.9	-76.7	166.5	-177	164.4	0	113	I785 Y786 E792 I793	I785-K789 HydrophobicContact CG2-CD 4.15Å; I785-K789 WeakPolarHBondContact O-CB 3.5Å; I785-K789 VanDerWaalsContact O-CG 3.27Å; I785-K789 WeakPolarHBondContact O-CG 3.02Å; I785-K789 PolarHBondContact O-N 3.44Å; Y786-K789 PolarHBondContact O-N 2.97Å; K789-E792 PolarHBondContact O-N 2.85Å; K789-I793 WeakPolarHBondContact O-CD1 3.48Å; K789-I793 VanDerWaalsContact O-CG1 3.29Å; K789-I793 WeakPolarHBondContact O-CG1 3.46Å; K789-I793 PolarHBondContact O-N 2.85Å
790	L	64.8	Low	62.9	Low	28 Å²	28	80 Å²	80	15%	0.147	39%	0.387	C	S	.	.	H	α-helix	trans	-63.3	-45.7	173.2	-72.2	171.2	0	0	0	110.7	Y786 K787 Q788 E792 I793 G794 Y795 L797	Y786-L790 HydrophobicContact CD1-CD1 3.97Å; Y786-L790 HydrophobicContact CD1-CG 4.24Å; Y786-L790 HydrophobicContact CE1-CD1 4.2Å; Y786-L790 HydrophobicContact CE1-CG 4.36Å; Y786-L790 WeakPolarHBondContact O-CG 3.33Å; Y786-L790 PolarHBondContact O-N 2.74Å; K787-L790 PolarHBondContact O-N 2.76Å; Q788-L790 PolarHBondContact O-N 3.46Å; L790-E792 VanDerWaalsContact C-N 3.3Å; L790-E792 PolarHBondContact O-N 2.94Å; L790-I793 PolarHBondContact O-N 3.43Å; L790-G794 PolarHBondContact O-N 3.35Å; L790-G794 VanDerWaalsContact O-N 3.08Å; L790-Y795 CarbonylContact C-O 3.46Å; L790-Y795 PolarHBondContact O-N 3.02Å; L790-Y795 VanDerWaalsContact O-O 3.09Å; L790-L797 HydrophobicContact CD1-CB 4.1Å; L790-L797 HydrophobicContact CD1-CD1 4.22Å; L790-L797 HydrophobicContact CD1-CD2 4.42Å; L790-L797 HydrophobicContact CD1-CG 4.5Å
791	N	65.5	Low	64.9	Low	78 Å²	78	72.7 Å²	72.7	42%	0.417	35%	0.347	S	S	.	.	H	α-helix	trans	-59.3	-38.1	175.9	-69.2	-24.3	0	0	0	112.4	K787 Q788 I793 G794 Y795	K787-N791 VanDerWaalsContact O-CG 3.31Å; K787-N791 PolarHBondContact O-N 3.33Å; K787-N791 VanDerWaalsContact O-N 3.11Å; K787-N791 PolarHBondContact O-ND2 2.81Å; Q788-N791 WeakPolarHBondContact O-CB 3.03Å; Q788-N791 PolarHBondContact O-N 2.7Å; N791-I793 VanDerWaalsContact C-N 3.29Å; N791-I793 PolarHBondContact O-N 2.82Å; N791-G794 PolarHBondContact O-N 2.89Å; N791-Y795 WeakPolarHBondContact CA-O 3.12Å; N791-Y795 PolarHBondContact N-O 3.37Å; N791-Y795 VanDerWaalsContact N-O 3.14Å; N791-Y795 PolarHBondContact OD1-O 2.96Å
792	E	64.1	Low	67	Low	148 Å²	148	66.6 Å²	66.6	69%	0.692	32%	0.315	S	S	*	.	H	α-helix	trans	-63.9	-29.7	174.6	-74.1	-173.1	163.8	0	0	113.8	Q788 K789 L790	Q788-E792 PolarHBondContact O-N 2.85Å; K789-E792 PolarHBondContact O-N 2.85Å; L790-E792 VanDerWaalsContact C-N 3.3Å; L790-E792 PolarHBondContact O-N 2.94Å
793	I	65.8	Low	68.5	Low	121 Å²	121	63.6 Å²	63.6	62%	0.621	30%	0.3	S	S	*	.	H	α-helix	trans	-89.5	-11.9	-179	-61.9	166.2	0	0	0	111.3	K789 L790 N791 Y795	K789-I793 WeakPolarHBondContact O-CD1 3.48Å; K789-I793 VanDerWaalsContact O-CG1 3.29Å; K789-I793 WeakPolarHBondContact O-CG1 3.46Å; K789-I793 PolarHBondContact O-N 2.85Å; L790-I793 PolarHBondContact O-N 3.43Å; N791-I793 VanDerWaalsContact C-N 3.29Å; N791-I793 PolarHBondContact O-N 2.82Å; I793-Y795 HydrophobicContact CB-CD2 4.37Å; I793-Y795 HydrophobicContact CG2-CD2 3.88Å; I793-Y795 HydrophobicContact CG2-CE2 3.97Å
794	G	69.6	Low	69.7	Low	6 Å²	6	60.1 Å²	60.1	6%	0.062	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	96	31.8	-179.2	0	0	0	0	0	114.2	L790 N791 I855	L790-G794 PolarHBondContact O-N 3.35Å; L790-G794 VanDerWaalsContact O-N 3.08Å; N791-G794 PolarHBondContact O-N 2.89Å; G794-I855 WeakPolarHBondContact O-CB 3.49Å; G794-I855 PolarHBondContact O-N 2.95Å
795	Y	70.7	Confident	70.9	Confident	90 Å²	90	57 Å²	57	35%	0.353	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.6	176.5	-68.7	-82.5	0	0	0	111.4	L627 L790 N791 I793 I852 E853	L627-Y795 HydrophobicContact CD1-CE1 4.44Å; L790-Y795 CarbonylContact C-O 3.46Å; L790-Y795 PolarHBondContact O-N 3.02Å; L790-Y795 VanDerWaalsContact O-O 3.09Å; N791-Y795 WeakPolarHBondContact CA-O 3.12Å; N791-Y795 PolarHBondContact N-O 3.37Å; N791-Y795 VanDerWaalsContact N-O 3.14Å; N791-Y795 PolarHBondContact OD1-O 2.96Å; I793-Y795 HydrophobicContact CB-CD2 4.37Å; I793-Y795 HydrophobicContact CG2-CD2 3.88Å; I793-Y795 HydrophobicContact CG2-CE2 3.97Å; Y795-I852 HydrophobicContact CD1-CG2 3.6Å; Y795-I852 HydrophobicContact CE1-CG2 4.42Å; Y795-I852 HydrophobicContact CG-CG2 4.16Å; Y795-E853 CarbonylContact C-O 3.6Å; Y795-E853 VanDerWaalsContact CA-O 3.28Å; Y795-E853 WeakPolarHBondContact CA-O 3.42Å
796	K	71.4	Confident	71.8	Confident	90 Å²	90	52.9 Å²	52.9	39%	0.391	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.6	177.2	-174.5	176.5	169.1	-161.1	0	110	Y798 I852 E853 I855	K796-Y798 HydrophobicContact CB-CE2 4.25Å; K796-Y798 HydrophobicContact CD-CE2 3.9Å; K796-Y798 WeakPolarHBondContact CD-OH 3.4Å; K796-Y798 VanDerWaalsContact CE-CZ 3.44Å; K796-Y798 VanDerWaalsContact CE-OH 3.27Å; K796-Y798 WeakPolarHBondContact CE-OH 3.46Å; K796-Y798 HydrophobicContact CG-CD2 4.47Å; K796-Y798 HydrophobicContact CG-CE2 3.84Å; K796-Y798 PolarHBondContact NZ-OH 3.37Å; K796-I852 WeakPolarHBondContact O-CA 3.1Å; K796-E853 HydrophobicContact CB-CB 4.34Å; K796-E853 PolarHBondContact N-O 3.19Å; K796-E853 PolarHBondContact O-N 2.89Å; K796-I855 HydrophobicContact CB-CD1 4.28Å; K796-I855 HydrophobicContact CB-CG1 4.3Å
797	L	71.4	Confident	72.5	Confident	29 Å²	29	46.7 Å²	46.7	15%	0.152	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	118.5	-174.7	-169.9	80.9	0	0	0	111.1	K787 L790 Y850 L851 I852	K787-L797 HydrophobicContact CD-CD2 4.27Å; K787-L797 HydrophobicContact CG-CD2 4.11Å; L790-L797 HydrophobicContact CD1-CB 4.1Å; L790-L797 HydrophobicContact CD1-CD1 4.22Å; L790-L797 HydrophobicContact CD1-CD2 4.42Å; L790-L797 HydrophobicContact CD1-CG 4.5Å; L797-Y850 HydrophobicContact CD2-CD1 4.26Å; L797-Y850 HydrophobicContact CG-CD1 4.42Å; L797-L851 WeakPolarHBondContact CA-O 3.35Å; L797-I852 HydrophobicContact CD1-CD1 4.49Å; L797-I852 HydrophobicContact CD1-CG1 3.7Å
798	Y	72.9	Confident	73.4	Confident	32 Å²	32	45.2 Å²	45.2	13%	0.125	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	155.7	174	-58.1	-104.1	0	0	0	110.6	L734 K796 Y850 L851 E853	L734-Y798 HydrophobicContact CD1-CD2 3.9Å; L734-Y798 HydrophobicContact CD1-CE1 4.4Å; L734-Y798 HydrophobicContact CD1-CE2 3.35Å; L734-Y798 HydrophobicContact CD2-CD1 4.23Å; L734-Y798 HydrophobicContact CD2-CE1 3.97Å; L734-Y798 HydrophobicContact CD2-CE2 4.33Å; L734-Y798 HydrophobicContact CG-CE2 4.49Å; K796-Y798 HydrophobicContact CB-CE2 4.25Å; K796-Y798 HydrophobicContact CD-CE2 3.9Å; K796-Y798 WeakPolarHBondContact CD-OH 3.4Å; K796-Y798 VanDerWaalsContact CE-CZ 3.44Å; K796-Y798 VanDerWaalsContact CE-OH 3.27Å; K796-Y798 WeakPolarHBondContact CE-OH 3.46Å; K796-Y798 HydrophobicContact CG-CD2 4.47Å; K796-Y798 HydrophobicContact CG-CE2 3.84Å; K796-Y798 PolarHBondContact NZ-OH 3.37Å; Y798-Y850 VanDerWaalsContact O-CA 3.29Å; Y798-Y850 WeakPolarHBondContact O-CA 3.33Å; Y798-L851 PolarHBondContact N-O 3.06Å; Y798-L851 PolarHBondContact O-N 2.04Å; Y798-E853 HydrophobicContact CE2-CB 3.81Å; Y798-E853 WeakPolarHBondContact CE2-OE2 3.13Å; Y798-E853 VanDerWaalsContact CZ-OE2 3.27Å; Y798-E853 PolarHBondContact OH-OE2 2.81Å
799	E	75.1	Confident	74	Confident	32 Å²	32	39.5 Å²	39.5	15%	0.15	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	106.5	179.4	-179.4	-177.8	143.5	0	0	108.8	R658 Y850	R658-E799 HydrophobicContact CB-CB 4.31Å; R658-E799 HydrophobicContact CB-CG 4.32Å; R658-E799 WeakPolarHBondContact CD-OE1 3.32Å; R658-E799 IonicContact CZ-OE1 3.7Å; R658-E799 PolarHBondContact N-O 3.24Å; R658-E799 VanDerWaalsContact N-O 3.09Å; R658-E799 IonicContact NE-OE1 2.85Å; R658-E799 IonicContact NH1-OE1 3.56Å; R658-E799 PolarHBondContact NH1-OE1 3.01Å; E799-Y850 HydrophobicContact CB-CD1 4.07Å; E799-Y850 HydrophobicContact CB-CE1 3.94Å; E799-Y850 HydrophobicContact CG-CD1 4.24Å; E799-Y850 HydrophobicContact CG-CE1 3.73Å
800	L	77	Confident	74.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	121.3	-179.3	-53.5	-175.2	0	0	0	109.1	D657 I691 L732 F802 P848 L849 L851	D657-L800 HydrophobicContact CB-CD2 4.49Å; I691-L800 HydrophobicContact CD1-CD1 4.2Å; I691-L800 HydrophobicContact CD1-CD2 3.44Å; I691-L800 VanDerWaalsContact CD1-CD2 3.44Å; I691-L800 HydrophobicContact CD1-CG 4.45Å; I691-L800 HydrophobicContact CG1-CD2 4.49Å; L732-L800 HydrophobicContact CD1-CD1 4.49Å; L732-L800 HydrophobicContact CD2-CD1 4.45Å; L800-F802 HydrophobicContact CB-CD2 4.34Å; L800-F802 HydrophobicContact CB-CE2 3.75Å; L800-F802 HydrophobicContact CB-CZ 4.44Å; L800-F802 HydrophobicContact CD1-CE2 4.26Å; L800-F802 HydrophobicContact CD1-CZ 4.3Å; L800-P848 CarbonylContact O-C 3.6Å; L800-P848 WeakPolarHBondContact O-CA 3.36Å; L800-L849 PolarHBondContact N-O 3.01Å; L800-L849 PolarHBondContact O-N 2.82Å; L800-L851 HydrophobicContact CD1-CB 4.35Å; L800-L851 HydrophobicContact CD1-CD2 4.36Å
801	K	81.8	Confident	74.4	Confident	20 Å²	20	43 Å²	43	9%	0.087	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	109.8	171.5	178.8	170.5	172.4	171.6	0	108.8	L310 D311 I656 S846	L310-K801 PolarHBondContact O-NZ 2.89Å; D311-K801 IonicContact OD2-NZ 3.68Å; D311-K801 PolarHBondContact OD2-NZ 3.34Å; I656-K801 HydrophobicContact CB-CB 4.35Å; I656-K801 PolarHBondContact N-O 3.48Å; I656-K801 PolarHBondContact O-N 2.96Å; K801-S846 WeakPolarHBondContact CE-OG 3.47Å
802	F	84.3	Confident	74.4	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.009	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.8	171.6	-67.3	-94.9	0	0	0	108.8	F634 Y654 V655 L673 L732 L800 S846 I847 L849	F634-F802 HydrophobicContact CE1-CD1 4.02Å; F634-F802 HydrophobicContact CE1-CE1 4.37Å; F634-F802 HydrophobicContact CE1-CG 4.19Å; F634-F802 HydrophobicContact CE2-CD1 4.33Å; F634-F802 AromaticContact CZ-CD1 3.38Å; F634-F802 HydrophobicContact CZ-CD1 3.38Å; F634-F802 AromaticContact CZ-CE1 3.64Å; F634-F802 HydrophobicContact CZ-CE1 3.64Å; F634-F802 HydrophobicContact CZ-CG 4.01Å; F634-F802 HydrophobicContact CZ-CZ 4.47Å; Y654-F802 CarbonylContact O-C 3.53Å; Y654-F802 WeakPolarHBondContact O-CA 3.17Å; V655-F802 HydrophobicContact CG2-CD1 3.35Å; V655-F802 HydrophobicContact CG2-CE1 3.2Å; V655-F802 HydrophobicContact CG2-CG 4.16Å; V655-F802 HydrophobicContact CG2-CZ 3.88Å; L673-F802 HydrophobicContact CD1-CD1 4.14Å; L673-F802 HydrophobicContact CD1-CE1 3.86Å; L732-F802 HydrophobicContact CD1-CZ 4.01Å; L732-F802 HydrophobicContact CD2-CZ 4.18Å; L800-F802 HydrophobicContact CB-CD2 4.34Å; L800-F802 HydrophobicContact CB-CE2 3.75Å; L800-F802 HydrophobicContact CB-CZ 4.44Å; L800-F802 HydrophobicContact CD1-CE2 4.26Å; L800-F802 HydrophobicContact CD1-CZ 4.3Å; F802-S846 CarbonylContact O-C 3.34Å; F802-S846 WeakPolarHBondContact O-CA 2.97Å; F802-S846 WeakPolarHBondContact O-CB 3.12Å; F802-I847 HydrophobicContact CB-CG2 4.04Å; F802-I847 PolarHBondContact N-O 2.93Å; F802-I847 PolarHBondContact O-N 2.95Å; F802-L849 HydrophobicContact CD2-CB 4.07Å; F802-L849 HydrophobicContact CD2-CD2 4.49Å; F802-L849 HydrophobicContact CE2-CB 3.84Å; F802-L849 HydrophobicContact CE2-CD2 3.7Å; F802-L849 HydrophobicContact CE2-CG 4.42Å; F802-L849 HydrophobicContact CZ-CD2 4.3Å
803	T	81.4	Confident	74.2	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	114.3	-177.6	-60.8	0	0	0	0	109.9	C653 Y654 Q844 S846	C653-T803 CarbonylContact C-O 3.51Å; C653-T803 VanDerWaalsContact CA-O 3.31Å; C653-T803 WeakPolarHBondContact CA-O 3.43Å; Y654-T803 PolarHBondContact N-O 2.05Å; Y654-T803 PolarHBondContact O-N 3.2Å; T803-Q844 HydrophobicContact CG2-CG 4.12Å; T803-S846 WeakPolarHBondContact OG1-CB 3.5Å
804	C	82.5	Confident	74	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.4	-179.2	-72.3	0	0	0	0	112.5	F613 E652 C653 F806 Q844 R845	F613-C804 HydrophobicContact CE1-CB 4.22Å; F613-C804 HydrophobicContact CE2-CB 4.41Å; F613-C804 HydrophobicContact CZ-CB 4.06Å; F613-C804 WeakPolarHBondContact CZ-SG 3.3Å; E652-C804 CarbonylContact O-C 3.59Å; E652-C804 WeakPolarHBondContact O-CA 3.44Å; C653-C804 HydrophobicContact CB-CB 4.13Å; C653-C804 WeakPolarHBondContact CB-SG 3.13Å; C653-C804 WeakPolarHBondContact SG-CB 3.36Å; C653-C804 CovalentContact SG-SG 2.04Å; C653-C804 PolarHBondContact SG-SG 2.92Å; C804-F806 HydrophobicContact CB-CD2 4.33Å; C804-F806 HydrophobicContact CB-CE2 3.5Å; C804-F806 HydrophobicContact CB-CZ 3.73Å; C804-Q844 CarbonylContact O-C 3.5Å; C804-Q844 WeakPolarHBondContact O-CA 3.41Å; C804-R845 PolarHBondContact N-O 2.8Å; C804-R845 PolarHBondContact O-N 2.95Å
805	I	81.4	Confident	73.9	Confident	28 Å²	28	39.3 Å²	39.3	14%	0.144	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.3	176.2	-57.1	180	0	0	0	108.5	E651 E652 I842 Q844	E651-I805 HydrophobicContact CB-CG2 4.3Å; E651-I805 PolarHBondContact N-O 3.36Å; E652-I805 HydrophobicContact CB-CB 4.47Å; E652-I805 HydrophobicContact CB-CD1 4.31Å; E652-I805 PolarHBondContact O-N 2.84Å; I805-I842 HydrophobicContact CG2-CG2 3.47Å; I805-I842 VanDerWaalsContact CG2-CG2 3.47Å; I805-Q844 HydrophobicContact CG1-CG 4.04Å
806	F	80.7	Confident	73.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	129	-177.1	-62.5	-89.4	0	0	0	111.3	V611 F613 A636 V648 T649 V650 C804 I842 I843 R845	V611-F806 HydrophobicContact CB-CD2 4.37Å; V611-F806 HydrophobicContact CB-CG 4.38Å; V611-F806 HydrophobicContact CG1-CD1 4Å; V611-F806 HydrophobicContact CG1-CD2 4.02Å; V611-F806 HydrophobicContact CG1-CE1 4.13Å; V611-F806 HydrophobicContact CG1-CE2 4.15Å; V611-F806 HydrophobicContact CG1-CG 3.95Å; V611-F806 HydrophobicContact CG1-CZ 4.21Å; V611-F806 HydrophobicContact CG2-CB 4.16Å; V611-F806 HydrophobicContact CG2-CG 4.34Å; F613-F806 HydrophobicContact CB-CE2 4.47Å; F613-F806 HydrophobicContact CD2-CE2 4.22Å; F613-F806 AromaticContact CD2-CZ 3.62Å; F613-F806 HydrophobicContact CD2-CZ 3.62Å; F613-F806 AromaticContact CE2-CZ 3.97Å; F613-F806 HydrophobicContact CE2-CZ 3.97Å; F613-F806 HydrophobicContact CG-CE2 4.3Å; F613-F806 HydrophobicContact CG-CZ 4.16Å; A636-F806 HydrophobicContact CB-CD1 4.2Å; A636-F806 HydrophobicContact CB-CE1 3.31Å; A636-F806 HydrophobicContact CB-CZ 3.71Å; V648-F806 HydrophobicContact CG2-CB 4.03Å; V648-F806 HydrophobicContact CG2-CD1 3.97Å; V648-F806 HydrophobicContact CG2-CG 4.4Å; T649-F806 CarbonylContact O-C 3.45Å; T649-F806 WeakPolarHBondContact O-CA 3.4Å; V650-F806 HydrophobicContact CG2-CD1 3.67Å; V650-F806 HydrophobicContact CG2-CE1 3.45Å; V650-F806 VanDerWaalsContact CG2-CE1 3.45Å; V650-F806 HydrophobicContact CG2-CZ 4.36Å; C804-F806 HydrophobicContact CB-CD2 4.33Å; C804-F806 HydrophobicContact CB-CE2 3.5Å; C804-F806 HydrophobicContact CB-CZ 3.73Å; F806-I842 CarbonylContact O-C 3.47Å; F806-I842 VanDerWaalsContact O-CA 3.29Å; F806-I842 WeakPolarHBondContact O-CA 3.48Å; F806-I843 WeakPolarHBondContact CB-O 3.26Å; F806-I843 PolarHBondContact N-O 2.77Å; F806-I843 PolarHBondContact O-N 3.27Å; F806-R845 HydrophobicContact CE2-CB 4.16Å
807	R	76.4	Confident	72.3	Confident	15 Å²	15	38.2 Å²	38.2	6%	0.057	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.4	167.9	165.7	-175.6	-70.2	133.6	10.2	109.3	V648 T649 E651 L840	V648-R807 CarbonylContact C-O 3.54Å; V648-R807 WeakPolarHBondContact CA-O 3.36Å; T649-R807 PolarHBondContact N-O 3.38Å; T649-R807 PolarHBondContact O-N 3.18Å; T649-R807 WeakPolarHBondContact OG1-CB 3.27Å; T649-R807 PolarHBondContact OG1-O 3.1Å; T649-R807 VanDerWaalsContact OG1-O 3.06Å; E651-R807 HydrophobicContact CG-CB 3.94Å; E651-R807 IonicContact OE1-CZ 2.68Å; E651-R807 IonicContact OE1-NH1 3.31Å; E651-R807 PolarHBondContact OE1-NH1 2.86Å; E651-R807 IonicContact OE1-NH2 2.65Å; E651-R807 IonicContact OE2-CZ 3.61Å; E651-R807 IonicContact OE2-NH1 2.77Å; E651-R807 PolarHBondContact OE2-NH1 2.91Å; E651-R807 IonicContact OE2-NH2 3.21Å; E651-R807 PolarHBondContact OE2-NH2 2.74Å; R807-L840 HydrophobicContact CG-CD1 3.94Å; R807-L840 HydrophobicContact CG-CD2 4.15Å; R807-L840 HydrophobicContact CG-CG 3.97Å
808	I	79.5	Confident	71.2	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.3	-177.7	-47.2	175.8	0	0	0	109	L609 V611 L638 Y645 A647 V648 L840 R841 I843	L609-I808 HydrophobicContact CD1-CG2 4.49Å; V611-I808 HydrophobicContact CG2-CD1 3.71Å; V611-I808 HydrophobicContact CG2-CG1 4.21Å; L638-I808 HydrophobicContact CD1-CD1 3.93Å; L638-I808 HydrophobicContact CD1-CG1 4.39Å; L638-I808 HydrophobicContact CD1-CG2 3.71Å; L638-I808 HydrophobicContact CD2-CG2 4.19Å; Y645-I808 HydrophobicContact CD1-CB 4.45Å; Y645-I808 HydrophobicContact CD1-CG2 3.69Å; Y645-I808 HydrophobicContact CG-CG2 3.86Å; A647-I808 WeakPolarHBondContact O-CA 3.37Å; A647-I808 WeakPolarHBondContact O-CG2 3.06Å; V648-I808 HydrophobicContact CG2-CG1 4.26Å; I808-L840 WeakPolarHBondContact O-CA 3.21Å; I808-R841 PolarHBondContact N-O 3.25Å; I808-R841 PolarHBondContact O-N 3.25Å; I808-I843 HydrophobicContact CD1-CB 4.07Å; I808-I843 HydrophobicContact CD1-CD1 3.46Å; I808-I843 VanDerWaalsContact CD1-CD1 3.46Å; I808-I843 HydrophobicContact CD1-CG1 3.61Å
809	C	73.8	Confident	70.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	133.8	-169.3	-55.9	0	0	0	0	113.2	K646 A647 Q811 W814 C815	K646-C809 PolarHBondContact N-O 3.05Å; A647-C809 HydrophobicContact CB-CB 4.31Å; A647-C809 PolarHBondContact N-O 3.18Å; A647-C809 PolarHBondContact O-N 2.84Å; C809-Q811 VanDerWaalsContact CB-O 3.27Å; C809-Q811 WeakPolarHBondContact CB-O 3.29Å; C809-Q811 PolarHBondContact O-N 3.5Å; C809-W814 HydrophobicContact CB-CB 4.02Å; C809-C815 HydrophobicContact CB-CB 3.85Å; C809-C815 WeakPolarHBondContact CB-SG 3.37Å; C809-C815 VanDerWaalsContact SG-CA 3.56Å; C809-C815 WeakPolarHBondContact SG-CB 3.36Å; C809-C815 PolarHBondContact SG-N 2.91Å; C809-C815 CovalentContact SG-SG 2.04Å; C809-C815 PolarHBondContact SG-SG 2.92Å
810	K	71.8	Confident	68.7	Low	96 Å²	96	43.6 Å²	43.6	42%	0.417	24%	0.243	S	C	.	.	S	Bend	trans	-65.1	-22.9	175.6	-164.2	173.1	-176.8	170.7	0	113.9	V644 Y645 K646 S839	V644-K810 HydrophobicContact CG1-CD 4.3Å; V644-K810 HydrophobicContact CG1-CG 4.08Å; V644-K810 WeakPolarHBondContact O-CG 3.5Å; Y645-K810 HydrophobicContact CE1-CB 4.5Å; K646-K810 WeakPolarHBondContact CG-O 3.16Å; K810-S839 WeakPolarHBondContact CB-O 3.39Å; K810-S839 PolarHBondContact N-O 2.7Å; K810-S839 VanDerWaalsContact N-O 3.1Å
811	Q	64.9	Low	67.4	Low	109 Å²	109	44.9 Å²	44.9	51%	0.509	25%	0.252	S	S	.	.	S	Bend	trans	-134.6	146.1	173.2	-55.2	168.4	-24.5	0	0	108.4	C809 A813 W814	C809-Q811 VanDerWaalsContact CB-O 3.27Å; C809-Q811 WeakPolarHBondContact CB-O 3.29Å; C809-Q811 PolarHBondContact O-N 3.5Å; Q811-A813 VanDerWaalsContact C-N 3.28Å; Q811-A813 PolarHBondContact O-N 2.68Å; Q811-W814 PolarHBondContact O-N 2.94Å
812	L	65.3	Low	65.5	Low	108 Å²	108	49.9 Å²	49.9	57%	0.565	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-55	-42.1	-176.3	-178.2	56.3	0	0	0	112.4	A647 W814 C815 S816	A647-L812 HydrophobicContact CB-CD1 3.74Å; L812-W814 VanDerWaalsContact C-N 3.3Å; L812-W814 PolarHBondContact O-N 3.21Å; L812-W814 VanDerWaalsContact O-N 3.15Å; L812-C815 CarbonylContact O-C 3.33Å; L812-C815 WeakPolarHBondContact O-CA 3.33Å; L812-C815 PolarHBondContact O-N 3.39Å; L812-S816 PolarHBondContact O-N 3.47Å; L812-S816 PolarHBondContact O-OG 3.14Å
813	A	61.6	Low	63.5	Low	69 Å²	69	52.4 Å²	52.4	57%	0.57	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-52	-38.4	-175.9	0	0	0	0	0	115.1	Q811 C815 S816	Q811-A813 VanDerWaalsContact C-N 3.28Å; Q811-A813 PolarHBondContact O-N 2.68Å; A813-C815 PolarHBondContact O-N 3.38Å; A813-S816 PolarHBondContact O-N 2.9Å; A813-S816 VanDerWaalsContact O-N 3.11Å
814	W	61.1	Low	61.6	Low	89 Å²	89	56.4 Å²	56.4	34%	0.337	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-70.3	-17.7	179.5	-50.3	105	0	0	0	113.5	C809 Q811 L812 P837	C809-W814 HydrophobicContact CB-CB 4.02Å; Q811-W814 PolarHBondContact O-N 2.94Å; L812-W814 VanDerWaalsContact C-N 3.3Å; L812-W814 PolarHBondContact O-N 3.21Å; L812-W814 VanDerWaalsContact O-N 3.15Å; W814-P837 HydrophobicContact CD2-CB 4.33Å; W814-P837 HydrophobicContact CD2-CG 3.51Å; W814-P837 HydrophobicContact CE3-CB 4.24Å; W814-P837 HydrophobicContact CE3-CG 3.58Å; W814-P837 HydrophobicContact CG-CG 3.96Å; W814-P837 HydrophobicContact CH2-CB 3.91Å; W814-P837 HydrophobicContact CH2-CG 4.12Å; W814-P837 HydrophobicContact CZ2-CB 4.02Å; W814-P837 HydrophobicContact CZ2-CG 4.08Å; W814-P837 HydrophobicContact CZ3-CB 4.03Å; W814-P837 HydrophobicContact CZ3-CG 3.88Å
815	C	66.5	Low	59.5	Low	11 Å²	11	62.1 Å²	62.1	7%	0.074	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-7.1	173.6	-83.1	0	0	0	0	111.8	A647 T649 C809 L812 A813 W817	A647-C815 HydrophobicContact CB-CB 3.46Å; A647-C815 VanDerWaalsContact CB-CB 3.46Å; T649-C815 HydrophobicContact CG2-CB 3.72Å; T649-C815 WeakPolarHBondContact CG2-O 3.38Å; T649-C815 PolarHBondContact OG1-SG 3.4Å; C809-C815 HydrophobicContact CB-CB 3.85Å; C809-C815 WeakPolarHBondContact CB-SG 3.37Å; C809-C815 VanDerWaalsContact SG-CA 3.56Å; C809-C815 WeakPolarHBondContact SG-CB 3.36Å; C809-C815 PolarHBondContact SG-N 2.91Å; C809-C815 CovalentContact SG-SG 2.04Å; C809-C815 PolarHBondContact SG-SG 2.92Å; L812-C815 CarbonylContact O-C 3.33Å; L812-C815 WeakPolarHBondContact O-CA 3.33Å; L812-C815 PolarHBondContact O-N 3.39Å; A813-C815 PolarHBondContact O-N 3.38Å; C815-W817 PolarHBondContact O-N 2.94Å
816	S	56.3	Low	57.3	Low	71 Å²	71	65.8 Å²	65.8	50%	0.497	39%	0.385	S	S	.	.			trans	-77.7	53.9	178.4	-60.4	0	0	0	0	112.5	L812 A813	L812-S816 PolarHBondContact O-N 3.47Å; L812-S816 PolarHBondContact O-OG 3.14Å; A813-S816 PolarHBondContact O-N 2.9Å; A813-S816 VanDerWaalsContact O-N 3.11Å
817	W	52.4	Low	55.2	Low	85 Å²	85	70.1 Å²	70.1	32%	0.322	41%	0.412	S	S	.	.			trans	-81.9	129.3	176.4	-99.3	90.2	0	0	0	111.3	C815 S819 R832 I833 T834	C815-W817 PolarHBondContact O-N 2.94Å; W817-S819 PolarHBondContact O-N 2.82Å; W817-R832 HydrophobicContact CE3-CB 4Å; W817-R832 HydrophobicContact CE3-CG 3.93Å; W817-R832 HydrophobicContact CH2-CB 3.7Å; W817-R832 HydrophobicContact CH2-CG 4.2Å; W817-R832 HydrophobicContact CZ2-CB 4.33Å; W817-R832 HydrophobicContact CZ3-CB 3.49Å; W817-R832 VanDerWaalsContact CZ3-CB 3.49Å; W817-R832 HydrophobicContact CZ3-CG 3.5Å; W817-R832 VanDerWaalsContact CZ3-CG 3.5Å; W817-I833 HydrophobicContact CH2-CB 4.12Å; W817-I833 HydrophobicContact CZ2-CB 4.23Å; W817-I833 WeakPolarHBondContact CZ2-O 3.32Å; W817-T834 HydrophobicContact CZ2-CG2 4.43Å
818	P	49.7	Very low	53.3	Low	88 Å²	88	75.3 Å²	75.3	57%	0.571	44%	0.44	S	S	*	.			trans	-66.2	96.8	175.5	25.5	-34.9	0	0	0	110.8	A820 R832	P818-A820 PolarHBondContact O-N 3.26Å; P818-R832 PolarHBondContact O-NH2 3.38Å
819	S	49.9	Very low	51.3	Low	55 Å²	55	80.3 Å²	80.3	39%	0.385	47%	0.467	S	S	.	.			trans	-78.4	46.9	177.7	53.5	0	0	0	0	112.6	W817 C821	W817-S819 PolarHBondContact O-N 2.82Å; S819-C821 PolarHBondContact O-N 2.73Å; S819-C821 PolarHBondContact O-SG 3.32Å; S819-C821 VanDerWaalsContact O-SG 3.4Å
820	A	45	Very low	49.8	Very low	63 Å²	63	87 Å²	87	52%	0.521	50%	0.502	S	S	.	.			trans	-65.3	104.2	170	0	0	0	0	0	109.1	P818 D822 R832	P818-A820 PolarHBondContact O-N 3.26Å; A820-D822 VanDerWaalsContact C-N 3.3Å; A820-D822 PolarHBondContact O-N 3.35Å; A820-R832 PolarHBondContact O-NH2 2.77Å
821	C	49.1	Very low	48.2	Very low	27 Å²	27	84.6 Å²	84.6	18%	0.182	50%	0.497	C	S	.	.			trans	-90.2	67.7	173.5	-48.7	0	0	0	0	108.6	C678 F706 S819	C678-C821 VanDerWaalsContact CA-SG 3.53Å; C678-C821 HydrophobicContact CB-CB 3.89Å; C678-C821 WeakPolarHBondContact CB-SG 3.26Å; C678-C821 VanDerWaalsContact SG-CA 3.52Å; C678-C821 WeakPolarHBondContact SG-CB 3.38Å; C678-C821 CovalentContact SG-SG 2.04Å; C678-C821 PolarHBondContact SG-SG 3.34Å; F706-C821 HydrophobicContact CD2-CB 3.97Å; F706-C821 WeakPolarHBondContact CD2-O 3.41Å; F706-C821 VanDerWaalsContact CE2-O 3.27Å; F706-C821 WeakPolarHBondContact CE2-O 3.44Å; F706-C821 HydrophobicContact CG-CB 4.39Å; S819-C821 PolarHBondContact O-N 2.73Å; S819-C821 PolarHBondContact O-SG 3.32Å; S819-C821 VanDerWaalsContact O-SG 3.4Å
822	D	41.2	Very low	47.1	Very low	125 Å²	125	82.9 Å²	82.9	67%	0.668	49%	0.486	S	S	*	.			trans	-68.5	132.2	-176.6	-117.6	-48.8	0	0	0	111.4	A820 T824	A820-D822 VanDerWaalsContact C-N 3.3Å; A820-D822 PolarHBondContact O-N 3.35Å; D822-T824 PolarHBondContact O-N 3.42Å
823	S	43.4	Very low	45.9	Very low	56 Å²	56	81.3 Å²	81.3	39%	0.392	48%	0.477	S	S	.	.	S	Bend	trans	-74.9	-7	-173.3	52.6	0	0	0	0	114.4	E704 T825	E704-S823 WeakPolarHBondContact OE2-CB 3.06Å; S823-T825 VanDerWaalsContact C-N 3.28Å; S823-T825 PolarHBondContact O-N 2.77Å; S823-T825 PolarHBondContact O-OG1 2.71Å
824	T	42.4	Very low	45.1	Very low	89 Å²	89	78.5 Å²	78.5	55%	0.546	45%	0.453	S	S	.	.			trans	-78.4	71.3	-177.1	49	0	0	0	0	112.5	D822 S826	D822-T824 PolarHBondContact O-N 3.42Å; T824-S826 PolarHBondContact O-N 3.17Å
825	T	37.8	Very low	44	Very low	120 Å²	120	79.9 Å²	79.9	74%	0.736	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	51.2	177.8	42.2	0	0	0	0	114	S823	S823-T825 VanDerWaalsContact C-N 3.28Å; S823-T825 PolarHBondContact O-N 2.77Å; S823-T825 PolarHBondContact O-OG1 2.71Å
826	S	35.7	Very low	43.1	Very low	106 Å²	106	81.1 Å²	81.1	74%	0.741	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.8	-7	178.3	61.1	0	0	0	0	115.4	T824	T824-S826 PolarHBondContact O-N 3.17Å
827	T	36.6	Very low	42.6	Very low	90 Å²	90	78.5 Å²	78.5	55%	0.552	45%	0.448	S	S	*	.			trans	-134	104.8	172.3	53.9	0	0	0	0	112.3	N829	T827-N829 PolarHBondContact O-N 2.72Å
828	L	36.2	Very low	42.3	Very low	124 Å²	124	81.1 Å²	81.1	65%	0.649	48%	0.476	S	S	*	.			trans	-77.7	37	-179.8	-158.6	82.5	0	0	0	113.3	I206	I206-L828 HydrophobicContact CD1-CD2 3.6Å; I206-L828 HydrophobicContact CG1-CD2 3.53Å; I206-L828 HydrophobicContact CG2-CD2 4.44Å
829	N	37.7	Very low	42.8	Very low	105 Å²	105	78.7 Å²	78.7	56%	0.561	46%	0.462	S	S	*	.			trans	-98.8	4.9	-158	-71.8	-8.3	0	0	0	115.5	W275 T827 P831	W275-N829 PolarHBondContact NE1-O 2.7Å; W275-N829 VanDerWaalsContact NE1-O 3.07Å; T827-N829 PolarHBondContact O-N 2.72Å; N829-P831 VanDerWaalsContact C-CD 3.41Å
830	N	41.1	Very low	43.4	Very low	140 Å²	140	77.7 Å²	77.7	75%	0.749	45%	0.451	S	S	*	.			trans	-124.7	49.7	-177.2	-130.3	-1.1	0	0	0	116.6
831	P	39.3	Very low	44.4	Very low	47 Å²	47	78.6 Å²	78.6	31%	0.305	44%	0.442	S	S	.	.			trans	-51	156.6	163.8	-29.6	32.7	0	0	0	115.3	W275 N829	W275-P831 WeakPolarHBondContact CB-O 3.41Å; W275-P831 HydrophobicContact CD2-CB 3.6Å; W275-P831 HydrophobicContact CD2-CG 3.82Å; W275-P831 VanDerWaalsContact CE2-CD 3.46Å; W275-P831 HydrophobicContact CE3-CB 3.57Å; W275-P831 HydrophobicContact CE3-CG 3.81Å; W275-P831 HydrophobicContact CG-CB 4.02Å; W275-P831 HydrophobicContact CH2-CB 4.46Å; W275-P831 HydrophobicContact CH2-CG 3.78Å; W275-P831 HydrophobicContact CZ2-CB 4.45Å; W275-P831 HydrophobicContact CZ2-CG 3.73Å; W275-P831 HydrophobicContact CZ3-CB 4.02Å; W275-P831 HydrophobicContact CZ3-CG 3.79Å; N829-P831 VanDerWaalsContact C-CD 3.41Å
832	R	41.1	Very low	45.5	Very low	73 Å²	73	80.1 Å²	80.1	28%	0.275	45%	0.447	S	S	.	.			trans	-115.2	141.8	-159.3	-66.4	-175.5	173.2	172.6	4.6	112.1	W817 P818 A820 T834	W817-R832 HydrophobicContact CE3-CB 4Å; W817-R832 HydrophobicContact CE3-CG 3.93Å; W817-R832 HydrophobicContact CH2-CB 3.7Å; W817-R832 HydrophobicContact CH2-CG 4.2Å; W817-R832 HydrophobicContact CZ2-CB 4.33Å; W817-R832 HydrophobicContact CZ3-CB 3.49Å; W817-R832 VanDerWaalsContact CZ3-CB 3.49Å; W817-R832 HydrophobicContact CZ3-CG 3.5Å; W817-R832 VanDerWaalsContact CZ3-CG 3.5Å; P818-R832 PolarHBondContact O-NH2 3.38Å; A820-R832 PolarHBondContact O-NH2 2.77Å; R832-T834 VanDerWaalsContact C-N 3.34Å; R832-T834 PolarHBondContact O-N 3.41Å; R832-T834 VanDerWaalsContact O-N 3.16Å
833	I	39.9	Very low	47.1	Very low	75 Å²	75	75.5 Å²	75.5	39%	0.385	42%	0.422	S	S	.	.			trans	-90.7	58.6	-167.1	-55.4	167.2	0	0	0	109.9	W275 K279 W817 F835	W275-I833 HydrophobicContact CB-CG1 4.03Å; K279-I833 HydrophobicContact CD-CB 4.04Å; K279-I833 HydrophobicContact CD-CG1 3.75Å; K279-I833 HydrophobicContact CD-CG2 3.62Å; W817-I833 HydrophobicContact CH2-CB 4.12Å; W817-I833 HydrophobicContact CZ2-CB 4.23Å; W817-I833 WeakPolarHBondContact CZ2-O 3.32Å; I833-F835 VanDerWaalsContact C-N 3.31Å; I833-F835 PolarHBondContact O-N 2.75Å
834	T	44.4	Very low	48.7	Very low	9 Å²	9	73.8 Å²	73.8	6%	0.055	41%	0.408	C	S	.	.			trans	-78.2	73.5	-173.3	12.7	0	0	0	0	113.2	D293 W817 R832 L836	D293-T834 PolarHBondContact OD2-OG1 2.76Å; W817-T834 HydrophobicContact CZ2-CG2 4.43Å; R832-T834 VanDerWaalsContact C-N 3.34Å; R832-T834 PolarHBondContact O-N 3.41Å; R832-T834 VanDerWaalsContact O-N 3.16Å; T834-L836 WeakPolarHBondContact O-CD1 3.09Å; T834-L836 PolarHBondContact O-N 3.23Å
835	F	39.4	Very low	50.6	Low	119 Å²	119	74.3 Å²	74.3	52%	0.522	40%	0.4	S	S	.	.			trans	-67.6	111.5	166.7	-151.5	-88.1	0	0	0	109	T224 I833 P837	T224-F835 HydrophobicContact CG2-CE2 3.99Å; I833-F835 VanDerWaalsContact C-N 3.31Å; I833-F835 PolarHBondContact O-N 2.75Å; F835-P837 WeakPolarHBondContact O-CD 3.18Å
836	L	47.4	Very low	52.7	Low	36 Å²	36	71 Å²	71	19%	0.188	38%	0.381	C	S	.	.			trans	-83.1	116	172.8	-76.6	66	0	0	0	109	M281 L294 T834 L840	M281-L836 HydrophobicContact CE-CB 4.01Å; M281-L836 HydrophobicContact SD-CB 3.63Å; M281-L836 HydrophobicContact SD-CD1 3.99Å; M281-L836 HydrophobicContact SD-CG 4.33Å; M281-L836 PolarHBondContact SD-N 3.38Å; L294-L836 HydrophobicContact CD2-CD1 4.18Å; L294-L836 HydrophobicContact CD2-CD2 4.25Å; T834-L836 WeakPolarHBondContact O-CD1 3.09Å; T834-L836 PolarHBondContact O-N 3.23Å; L836-L840 HydrophobicContact CB-CD1 4.48Å; L836-L840 HydrophobicContact CD2-CD2 4.14Å; L836-L840 HydrophobicContact CG-CD1 4.01Å; L836-L840 HydrophobicContact CG-CD2 4.37Å
837	P	45.6	Very low	55	Low	16 Å²	16	67.2 Å²	67.2	10%	0.104	35%	0.353	C	S	.	.			trans	-76	166	165.1	37.5	-40.3	0	0	0	110.3	W814 F835 S839	W814-P837 HydrophobicContact CD2-CB 4.33Å; W814-P837 HydrophobicContact CD2-CG 3.51Å; W814-P837 HydrophobicContact CE3-CB 4.24Å; W814-P837 HydrophobicContact CE3-CG 3.58Å; W814-P837 HydrophobicContact CG-CG 3.96Å; W814-P837 HydrophobicContact CH2-CB 3.91Å; W814-P837 HydrophobicContact CH2-CG 4.12Å; W814-P837 HydrophobicContact CZ2-CB 4.02Å; W814-P837 HydrophobicContact CZ2-CG 4.08Å; W814-P837 HydrophobicContact CZ3-CB 4.03Å; W814-P837 HydrophobicContact CZ3-CG 3.88Å; F835-P837 WeakPolarHBondContact O-CD 3.18Å; P837-S839 PolarHBondContact O-N 3.37Å
838	P	44.5	Very low	57.2	Low	141 Å²	141	65.8 Å²	65.8	92%	0.916	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	22.7	170.2	30.8	-37.5	0	0	0	114.3
839	S	60.2	Low	59.5	Low	37 Å²	37	59.9 Å²	59.9	26%	0.259	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	29	-174.2	-75.7	0	0	0	0	112.7	K810 P837	K810-S839 WeakPolarHBondContact CB-O 3.39Å; K810-S839 PolarHBondContact N-O 2.7Å; K810-S839 VanDerWaalsContact N-O 3.1Å; P837-S839 PolarHBondContact O-N 3.37Å
840	L	64.3	Low	61.6	Low	33 Å²	33	56.3 Å²	56.3	17%	0.173	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	140.8	-170.9	-173.5	150.7	0	0	0	109.8	R807 I808 L836 I842	R807-L840 HydrophobicContact CG-CD1 3.94Å; R807-L840 HydrophobicContact CG-CD2 4.15Å; R807-L840 HydrophobicContact CG-CG 3.97Å; I808-L840 WeakPolarHBondContact O-CA 3.21Å; L836-L840 HydrophobicContact CB-CD1 4.48Å; L836-L840 HydrophobicContact CD2-CD2 4.14Å; L836-L840 HydrophobicContact CG-CD1 4.01Å; L836-L840 HydrophobicContact CG-CD2 4.37Å; L840-I842 HydrophobicContact CD2-CG1 4.05Å
841	R	65.9	Low	63.4	Low	83 Å²	83	49.7 Å²	49.7	31%	0.313	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155.1	174	-72.7	-175.7	175.8	-163.2	-1.2	110.7	E560 L609 Y645 I808	E560-R841 PolarHBondContact O-NH2 2.78Å; L609-R841 HydrophobicContact CD2-CB 4.5Å; L609-R841 HydrophobicContact CD2-CG 4.5Å; Y645-R841 HydrophobicContact CE1-CG 4.22Å; Y645-R841 WeakPolarHBondContact OH-CD 3.49Å; Y645-R841 PolarHBondContact OH-NE 3.36Å; I808-R841 PolarHBondContact N-O 3.25Å; I808-R841 PolarHBondContact O-N 3.25Å
842	I	71.5	Confident	65.4	Low	58 Å²	58	49.4 Å²	49.4	30%	0.297	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.7	176.3	-58.7	178.2	0	0	0	108.5	I805 F806 L840	I805-I842 HydrophobicContact CG2-CG2 3.47Å; I805-I842 VanDerWaalsContact CG2-CG2 3.47Å; F806-I842 CarbonylContact O-C 3.47Å; F806-I842 VanDerWaalsContact O-CA 3.29Å; F806-I842 WeakPolarHBondContact O-CA 3.48Å; L840-I842 HydrophobicContact CD2-CG1 4.05Å
843	I	74.3	Confident	67.1	Low	29 Å²	29	47.6 Å²	47.6	15%	0.149	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.9	176.4	-65	-168.3	0	0	0	108.9	L609 V611 F806 I808 R845	L609-I843 HydrophobicContact CG-CD1 4.39Å; V611-I843 HydrophobicContact CB-CG2 4.39Å; V611-I843 HydrophobicContact CG2-CB 4.45Å; V611-I843 HydrophobicContact CG2-CG2 4.5Å; F806-I843 WeakPolarHBondContact CB-O 3.26Å; F806-I843 PolarHBondContact N-O 2.77Å; F806-I843 PolarHBondContact O-N 3.27Å; I808-I843 HydrophobicContact CD1-CB 4.07Å; I808-I843 HydrophobicContact CD1-CD1 3.46Å; I808-I843 VanDerWaalsContact CD1-CD1 3.46Å; I808-I843 HydrophobicContact CD1-CG1 3.61Å; I843-R845 HydrophobicContact CG2-CG 4.08Å
844	Q	77.5	Confident	68.5	Low	19 Å²	19	47.3 Å²	47.3	9%	0.089	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.2	-177.4	-176.1	174.4	13.8	0	0	109.2	L312 I313 R314 T803 C804 I805	L312-Q844 HydrophobicContact CD2-CB 4.09Å; L312-Q844 HydrophobicContact CD2-CG 4.05Å; L312-Q844 HydrophobicContact CG-CG 4.11Å; I313-Q844 PolarHBondContact O-NE2 2.82Å; R314-Q844 VanDerWaalsContact NE-OE1 3.08Å; T803-Q844 HydrophobicContact CG2-CG 4.12Å; C804-Q844 CarbonylContact O-C 3.5Å; C804-Q844 WeakPolarHBondContact O-CA 3.41Å; I805-Q844 HydrophobicContact CG1-CG 4.04Å
845	R	81.3	Confident	69.5	Low	100 Å²	100	48.7 Å²	48.7	38%	0.377	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135	-173.7	-72.9	-86.7	163.6	-123.2	15.4	109.8	D610 V611 F613 C804 F806 I843	D610-R845 IonicContact OD1-CZ 2.88Å; D610-R845 IonicContact OD1-NE 2.96Å; D610-R845 PolarHBondContact OD1-NE 2.93Å; D610-R845 IonicContact OD1-NH2 3.11Å; D610-R845 PolarHBondContact OD1-NH2 3.49Å; D610-R845 IonicContact OD2-CZ 3.9Å; D610-R845 IonicContact OD2-NE 2.7Å; D610-R845 IonicContact OD2-NH2 2.72Å; D610-R845 PolarHBondContact OD2-NH2 2.9Å; V611-R845 WeakPolarHBondContact O-CD 3.41Å; V611-R845 VanDerWaalsContact O-CG 3.24Å; V611-R845 WeakPolarHBondContact O-CG 3.14Å; V611-R845 PolarHBondContact O-NE 2.88Å; F613-R845 HydrophobicContact CB-CB 3.83Å; F613-R845 HydrophobicContact CD1-CB 4.33Å; F613-R845 HydrophobicContact CG-CB 4.4Å; C804-R845 PolarHBondContact N-O 2.8Å; C804-R845 PolarHBondContact O-N 2.95Å; F806-R845 HydrophobicContact CE2-CB 4.16Å; I843-R845 HydrophobicContact CG2-CG 4.08Å
846	S	82.5	Confident	70.6	Confident	50 Å²	50	45.8 Å²	45.8	35%	0.35	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.3	179	64.6	0	0	0	0	111.8	K801 F802 T803	K801-S846 WeakPolarHBondContact CE-OG 3.47Å; F802-S846 CarbonylContact O-C 3.34Å; F802-S846 WeakPolarHBondContact O-CA 2.97Å; F802-S846 WeakPolarHBondContact O-CB 3.12Å; T803-S846 WeakPolarHBondContact OG1-CB 3.5Å
847	I	84.4	Confident	70.9	Confident	27 Å²	27	49.5 Å²	49.5	14%	0.138	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	127.9	177.8	-168.9	157.1	0	0	0	110.5	F613 V615 F802	F613-I847 HydrophobicContact CD1-CB 4.2Å; F613-I847 HydrophobicContact CD1-CG2 3.84Å; F613-I847 HydrophobicContact CE1-CB 4.36Å; F613-I847 HydrophobicContact CE1-CG2 3.53Å; F613-I847 HydrophobicContact CZ-CG2 4.39Å; V615-I847 HydrophobicContact CG2-CD1 4.04Å; V615-I847 HydrophobicContact CG2-CG1 4.3Å; V615-I847 HydrophobicContact CG2-CG2 3.67Å; F802-I847 HydrophobicContact CB-CG2 4.04Å; F802-I847 PolarHBondContact N-O 2.93Å; F802-I847 PolarHBondContact O-N 2.95Å
848	P	82.3	Confident	71.4	Confident	61 Å²	61	53.7 Å²	53.7	40%	0.396	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	140.7	170.6	32.2	-33.3	0	0	0	110.4	L800	L800-P848 CarbonylContact O-C 3.6Å; L800-P848 WeakPolarHBondContact O-CA 3.36Å
849	L	84	Confident	71.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	123.8	175.2	-173.8	71.8	0	0	0	108.7	V615 I626 I632 L732 L800 F802	V615-L849 HydrophobicContact CB-CD1 4.46Å; V615-L849 HydrophobicContact CG1-CD1 4.29Å; V615-L849 HydrophobicContact CG1-CD2 4.4Å; V615-L849 HydrophobicContact CG2-CD1 4.47Å; I626-L849 HydrophobicContact CD1-CD2 3.73Å; I626-L849 HydrophobicContact CD1-CG 4.32Å; I626-L849 HydrophobicContact CG1-CD1 4.24Å; I626-L849 HydrophobicContact CG1-CD2 4.07Å; I626-L849 HydrophobicContact CG1-CG 4.09Å; I626-L849 HydrophobicContact CG2-CD1 4.3Å; I632-L849 HydrophobicContact CD1-CD2 3.84Å; L732-L849 HydrophobicContact CD1-CD2 3.94Å; L800-L849 PolarHBondContact N-O 3.01Å; L800-L849 PolarHBondContact O-N 2.82Å; F802-L849 HydrophobicContact CD2-CB 4.07Å; F802-L849 HydrophobicContact CD2-CD2 4.49Å; F802-L849 HydrophobicContact CE2-CB 3.84Å; F802-L849 HydrophobicContact CE2-CD2 3.7Å; F802-L849 HydrophobicContact CE2-CG 4.42Å; F802-L849 HydrophobicContact CZ-CD2 4.3Å
850	Y	82.6	Confident	71.2	Confident	30 Å²	30	54.1 Å²	54.1	12%	0.118	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.1	177	-61.3	-79.1	0	0	0	111	Q624 T625 I626 I782 L797 Y798 E799	Q624-Y850 WeakPolarHBondContact O-CD2 3.06Å; Q624-Y850 PolarHBondContact O-N 2.89Å; T625-Y850 WeakPolarHBondContact CA-O 3.17Å; T625-Y850 HydrophobicContact CG2-CD2 4.15Å; I626-Y850 PolarHBondContact N-O 3.22Å; I782-Y850 HydrophobicContact CD1-CE2 4.05Å; L797-Y850 HydrophobicContact CD2-CD1 4.26Å; L797-Y850 HydrophobicContact CG-CD1 4.42Å; Y798-Y850 VanDerWaalsContact O-CA 3.29Å; Y798-Y850 WeakPolarHBondContact O-CA 3.33Å; E799-Y850 HydrophobicContact CB-CD1 4.07Å; E799-Y850 HydrophobicContact CB-CE1 3.94Å; E799-Y850 HydrophobicContact CG-CD1 4.24Å; E799-Y850 HydrophobicContact CG-CE1 3.73Å
851	L	79.9	Confident	70.4	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.7	178.8	-172.9	68.6	0	0	0	110.2	I626 L732 L734 L797 Y798 L800	I626-L851 HydrophobicContact CD1-CD1 3.75Å; I626-L851 HydrophobicContact CG1-CD1 3.88Å; L732-L851 HydrophobicContact CB-CD1 4.41Å; L734-L851 HydrophobicContact CD1-CD2 4.13Å; L734-L851 HydrophobicContact CD2-CD2 4.41Å; L734-L851 HydrophobicContact CG-CD2 4.08Å; L797-L851 WeakPolarHBondContact CA-O 3.35Å; Y798-L851 PolarHBondContact N-O 3.06Å; Y798-L851 PolarHBondContact O-N 2.04Å; L800-L851 HydrophobicContact CD1-CB 4.35Å; L800-L851 HydrophobicContact CD1-CD2 4.36Å
852	I	80.4	Confident	69.6	Low	41 Å²	41	60.4 Å²	60.4	21%	0.21	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.7	177.6	-59.4	171.3	0	0	0	109.4	I626 L627 E628 Y795 K796 L797	I626-I852 PolarHBondContact O-N 2.7Å; L627-I852 HydrophobicContact CD1-CB 4.21Å; L627-I852 HydrophobicContact CD1-CG2 4Å; L627-I852 WeakPolarHBondContact CD1-O 3.12Å; E628-I852 PolarHBondContact N-O 2.9Å; Y795-I852 HydrophobicContact CD1-CG2 3.6Å; Y795-I852 HydrophobicContact CE1-CG2 4.42Å; Y795-I852 HydrophobicContact CG-CG2 4.16Å; K796-I852 WeakPolarHBondContact O-CA 3.1Å; L797-I852 HydrophobicContact CD1-CD1 4.49Å; L797-I852 HydrophobicContact CD1-CG1 3.7Å
853	E	76	Confident	68.1	Low	35 Å²	35	67.2 Å²	67.2	16%	0.164	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.2	170	179.8	-167.5	175.8	0	0	109.6	L734 Y795 K796 Y798	L734-E853 HydrophobicContact CD1-CB 3.84Å; L734-E853 HydrophobicContact CD1-CG 4.05Å; Y795-E853 CarbonylContact C-O 3.6Å; Y795-E853 VanDerWaalsContact CA-O 3.28Å; Y795-E853 WeakPolarHBondContact CA-O 3.42Å; K796-E853 HydrophobicContact CB-CB 4.34Å; K796-E853 PolarHBondContact N-O 3.19Å; K796-E853 PolarHBondContact O-N 2.89Å; Y798-E853 HydrophobicContact CE2-CB 3.81Å; Y798-E853 WeakPolarHBondContact CE2-OE2 3.13Å; Y798-E853 VanDerWaalsContact CZ-OE2 3.27Å; Y798-E853 PolarHBondContact OH-OE2 2.81Å
854	S	69.6	Low	66.6	Low	70 Å²	70	75 Å²	75	49%	0.49	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	114.2	170.5	62.9	0	0	0	0	111.3
855	I	66.5	Low	64.7	Low	37 Å²	37	84 Å²	84	19%	0.19	45%	0.448	C	S	.	.			trans	-70.7	123.7	-178.7	-54.4	173.5	0	0	0	109.1	G794 K796 Q859 L860	G794-I855 WeakPolarHBondContact O-CB 3.49Å; G794-I855 PolarHBondContact O-N 2.95Å; K796-I855 HydrophobicContact CB-CD1 4.28Å; K796-I855 HydrophobicContact CB-CG1 4.3Å; I855-Q859 HydrophobicContact CG2-CB 3.89Å; I855-L860 HydrophobicContact CB-CD1 4.31Å; I855-L860 HydrophobicContact CG2-CD1 4.09Å; I855-L860 HydrophobicContact CG2-CG 4.37Å
856	P	61.5	Low	62.7	Low	59 Å²	59	85.4 Å²	85.4	38%	0.383	47%	0.467	S	S	.	.			trans	-64.8	144.5	177.7	26.4	-33.7	0	0	0	111.1	S858 Q859	P856-S858 PolarHBondContact O-N 2.02Å; P856-Q859 HydrophobicContact CG-CB 4.38Å; P856-Q859 HydrophobicContact CG-CG 4.16Å; P856-Q859 PolarHBondContact O-N 2.75Å
857	S	55.1	Low	60.8	Low	113 Å²	113	88.5 Å²	88.5	79%	0.79	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-10.8	-171.9	-171.2	0	0	0	0	115.5
858	S	54.6	Low	58.6	Low	105 Å²	105	92.6 Å²	92.6	73%	0.734	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-19.8	173.4	47.5	0	0	0	0	114	P856	P856-S858 PolarHBondContact O-N 2.02Å
859	Q	51.8	Low	56.5	Low	136 Å²	136	100.3 Å²	100.3	64%	0.636	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-13.8	-176.5	-69.1	-175.6	-3.6	0	0	114.2	I855 P856	I855-Q859 HydrophobicContact CG2-CB 3.89Å; P856-Q859 HydrophobicContact CG-CB 4.38Å; P856-Q859 HydrophobicContact CG-CG 4.16Å; P856-Q859 PolarHBondContact O-N 2.75Å
860	L	48.6	Very low	54.5	Low	51 Å²	51	106.7 Å²	106.7	27%	0.267	57%	0.571	S	S	.	*	S	Bend	trans	-56.5	139.4	168.2	-82.4	98.7	0	0	0	109.6	I855 V862	I855-L860 HydrophobicContact CB-CD1 4.31Å; I855-L860 HydrophobicContact CG2-CD1 4.09Å; I855-L860 HydrophobicContact CG2-CG 4.37Å; L860-V862 PolarHBondContact O-N 2.79Å
861	P	47.9	Very low	52.4	Low	115 Å²	115	110.5 Å²	110.5	75%	0.747	60%	0.601	S	S	*	*			trans	-61.5	105	-178.8	24.6	-33.7	0	0	0	109.8	K863	P861-K863 PolarHBondContact O-N 3.21Å
862	V	48.5	Very low	50.7	Low	133 Å²	133	117.7 Å²	117.7	81%	0.806	64%	0.64	S	S	*	*			trans	-51.8	115.8	177.3	177.3	0	0	0	0	107.5	L860 K864	L860-V862 PolarHBondContact O-N 2.79Å; V862-K864 VanDerWaalsContact C-N 3.34Å; V862-K864 PolarHBondContact O-N 3.06Å
863	K	41.6	Very low	49	Very low	201 Å²	201	125.3 Å²	125.3	87%	0.874	67%	0.674	S	S	*	*			trans	-56.4	98.3	-178	-74.7	-173	176.4	-178.2	0	109.1	P861 K865	P861-K863 PolarHBondContact O-N 3.21Å; K863-K865 PolarHBondContact O-N 3.07Å; K863-K865 VanDerWaalsContact O-N 3.16Å
864	K	41.3	Very low	47.3	Very low	192 Å²	192	129.4 Å²	129.4	84%	0.835	70%	0.697	S	S	*	*			trans	-49.7	124.6	172.7	-111	178.3	176.8	175.8	0	106.4	V862 V866	V862-K864 VanDerWaalsContact C-N 3.34Å; V862-K864 PolarHBondContact O-N 3.06Å; K864-V866 VanDerWaalsContact C-N 3.27Å; K864-V866 PolarHBondContact O-N 3.45Å
865	K	37.5	Very low	46.2	Very low	207 Å²	207	134.5 Å²	134.5	90%	0.9	71%	0.706	S	S	*	*			trans	-62.2	94.7	170.6	-77.5	-179.7	174.6	177.5	0	107.2	K863 P867	K863-K865 PolarHBondContact O-N 3.07Å; K863-K865 VanDerWaalsContact O-N 3.16Å; K865-P867 VanDerWaalsContact O-CD 3.25Å; K865-P867 WeakPolarHBondContact O-CD 3.4Å
866	V	41.1	Very low	45.3	Very low	130 Å²	130	139.3 Å²	139.3	79%	0.788	74%	0.742	S	S	*	*			trans	-64.9	115.2	173.2	177.2	0	0	0	0	106.7	K864	K864-V866 VanDerWaalsContact C-N 3.27Å; K864-V866 PolarHBondContact O-N 3.45Å
867	P	41.5	Very low	44.9	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	74%	0.742	S	S	*	*			trans	-68.5	146.4	172.6	31	-33.7	0	0	0	109.1	K865 R869	K865-P867 VanDerWaalsContact O-CD 3.25Å; K865-P867 WeakPolarHBondContact O-CD 3.4Å; P867-R869 PolarHBondContact O-N 2.83Å
868	S	38.2	Very low	44.8	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	74%	0.735	S	S	*	*			trans	-66.8	129.1	-174.1	43.7	0	0	0	0	113.5
869	R	39.1	Very low	44.9	Very low	222 Å²	222	139.1 Å²	139.1	84%	0.838	73%	0.729	S	S	*	*			trans	-169.3	132	133.2	-108.5	173.1	172.4	169.2	-2.7	111.9	P867	P867-R869 PolarHBondContact O-N 2.83Å
870	I	41.7	Very low	45.2	Very low	134 Å²	134	135.5 Å²	135.5	69%	0.687	71%	0.713	S	S	*	*			trans	43.4	98.4	142	-53.2	162.5	0	0	0	114.6
871	C	37.7	Very low	45.8	Very low	110 Å²	110	138.2 Å²	138.2	74%	0.743	72%	0.724	S	S	*	*				76.1	149.7	69	-65.8	0	0	0	0	113.9
872	D	43.6	Very low	46.6	Very low	152 Å²	152	137.5 Å²	137.5	81%	0.813	71%	0.713	S	S	*	*			trans	70.1	125.4	-175.1	-44.6	-28.6	0	0	0	113.1
873	E	45.3	Very low	47.4	Very low	200 Å²	200	136.5 Å²	136.5	94%	0.935	70%	0.703	S	S	*	*	S	Bend	cis	-100.5	-177.1	5	-63.2	-174.2	120.2	0	0	113.9
874	L	40.9	Very low	48.7	Very low	121 Å²	121	131.2 Å²	131.2	63%	0.634	68%	0.684	S	S	*	*			trans	-118.2	163.6	-154.9	-154.3	64.1	0	0	0	114
875	Y	45.4	Very low	50.2	Low	177 Å²	177	126 Å²	126	69%	0.694	66%	0.663	S	S	*	*			trans	79.1	172.6	176.5	-49.4	-75.3	0	0	0	117	S877	Y875-S877 PolarHBondContact O-N 2.85Å
876	C	48.5	Very low	52.1	Low	139 Å²	139	121.2 Å²	121.2	94%	0.939	65%	0.647	S	S	*	*			trans	64.2	27.6	174.6	-65.8	0	0	0	0	120
877	S	52.8	Low	53.7	Low	55 Å²	55	117.9 Å²	117.9	39%	0.385	63%	0.629	S	S	.	*			trans	-107.2	130	157	175.8	0	0	0	0	111.2	Y875 T879 L880 H881	Y875-S877 PolarHBondContact O-N 2.85Å; S877-T879 PolarHBondContact O-N 2.68Å; S877-T879 PolarHBondContact OG-N 2.7Å; S877-T879 PolarHBondContact OG-OG1 3.26Å; S877-L880 CarbonylContact O-C 3.55Å; S877-L880 WeakPolarHBondContact O-CA 3.34Å; S877-L880 VanDerWaalsContact O-CB 3.27Å; S877-L880 WeakPolarHBondContact O-CB 3.12Å; S877-L880 PolarHBondContact O-N 3.44Å; S877-L880 PolarHBondContact OG-N 3.24Å; S877-H881 PolarHBondContact O-N 3.44Å
878	N	52.8	Low	55.6	Low	121 Å²	121	116.4 Å²	116.4	65%	0.647	61%	0.614	S	S	*	*	H	α-helix	trans	-69.1	-18.8	172.6	-81.7	-29.4	0	0	0	113	H881 I882	N878-H881 PolarHBondContact O-N 2.87Å; N878-I882 WeakPolarHBondContact O-CB 3.46Å; N878-I882 VanDerWaalsContact O-CG1 3.28Å; N878-I882 WeakPolarHBondContact O-CG1 3.41Å; N878-I882 PolarHBondContact O-N 2.72Å
879	T	57.2	Low	57.6	Low	96 Å²	96	115.9 Å²	115.9	59%	0.589	60%	0.601	S	S	*	*	H	α-helix	trans	-76	-27.6	164.8	50.8	0	0	0	0	112.6	S877 L883	S877-T879 PolarHBondContact O-N 2.68Å; S877-T879 PolarHBondContact OG-N 2.7Å; S877-T879 PolarHBondContact OG-OG1 3.26Å; T879-L883 WeakPolarHBondContact O-CB 3.22Å; T879-L883 WeakPolarHBondContact O-CD1 3.43Å; T879-L883 VanDerWaalsContact O-CG 3.24Å; T879-L883 WeakPolarHBondContact O-CG 3.28Å; T879-L883 PolarHBondContact O-N 2.85Å
880	L	57.8	Low	59.7	Low	60 Å²	60	106.7 Å²	106.7	31%	0.314	58%	0.576	S	S	.	*	H	α-helix	trans	-67.6	-41.1	164.6	-172.7	77.9	0	0	0	110	S877 I882 L883 L884	S877-L880 CarbonylContact O-C 3.55Å; S877-L880 WeakPolarHBondContact O-CA 3.34Å; S877-L880 VanDerWaalsContact O-CB 3.27Å; S877-L880 WeakPolarHBondContact O-CB 3.12Å; S877-L880 PolarHBondContact O-N 3.44Å; S877-L880 PolarHBondContact OG-N 3.24Å; L880-I882 PolarHBondContact O-N 2.85Å; L880-L883 CarbonylContact O-C 3.58Å; L880-L883 PolarHBondContact O-N 3.39Å; L880-L884 HydrophobicContact CD2-CD1 4.2Å; L880-L884 HydrophobicContact CG-CD1 3.9Å; L880-L884 HydrophobicContact CG-CG 4.25Å; L880-L884 WeakPolarHBondContact O-CA 3.01Å; L880-L884 WeakPolarHBondContact O-CB 3.38Å; L880-L884 WeakPolarHBondContact O-CG 2.95Å; L880-L884 PolarHBondContact O-N 2.98Å
881	H	60.8	Low	61.7	Low	108 Å²	108	104.6 Å²	104.6	50%	0.5	57%	0.565	S	S	.	*	H	α-helix	trans	-70.3	-31.4	178.4	-153.1	-56.7	0	0	0	112.9	S877 N878 M885	S877-H881 PolarHBondContact O-N 3.44Å; N878-H881 PolarHBondContact O-N 2.87Å; H881-M885 VanDerWaalsContact O-CB 3.32Å; H881-M885 WeakPolarHBondContact O-CB 3.09Å; H881-M885 WeakPolarHBondContact O-CG 3.05Å; H881-M885 PolarHBondContact O-N 3.47Å
882	I	64.6	Low	63.9	Low	101 Å²	101	104 Å²	104	52%	0.518	55%	0.554	S	S	.	*	H	α-helix	trans	-77.7	-37.1	172.3	-71.1	168.2	0	0	0	111.1	N878 L880 L884 M885 I886	N878-I882 WeakPolarHBondContact O-CB 3.46Å; N878-I882 VanDerWaalsContact O-CG1 3.28Å; N878-I882 WeakPolarHBondContact O-CG1 3.41Å; N878-I882 PolarHBondContact O-N 2.72Å; L880-I882 PolarHBondContact O-N 2.85Å; I882-L884 VanDerWaalsContact C-N 3.35Å; I882-M885 PolarHBondContact O-N 3.35Å; I882-I886 HydrophobicContact CG2-CD1 3.69Å; I882-I886 HydrophobicContact CG2-CG1 4.3Å; I882-I886 VanDerWaalsContact O-CB 3.27Å; I882-I886 WeakPolarHBondContact O-CB 2.98Å; I882-I886 VanDerWaalsContact O-CG1 3.24Å; I882-I886 WeakPolarHBondContact O-CG1 3.32Å; I882-I886 PolarHBondContact O-N 2.72Å
883	L	66.2	Low	65.8	Low	112 Å²	112	101.1 Å²	101.1	59%	0.586	54%	0.542	S	S	*	.	H	α-helix	trans	-68.8	-32.5	170.4	-77.8	166.2	0	0	0	112	T879 L880 S887	T879-L883 WeakPolarHBondContact O-CB 3.22Å; T879-L883 WeakPolarHBondContact O-CD1 3.43Å; T879-L883 VanDerWaalsContact O-CG 3.24Å; T879-L883 WeakPolarHBondContact O-CG 3.28Å; T879-L883 PolarHBondContact O-N 2.85Å; L880-L883 CarbonylContact O-C 3.58Å; L880-L883 PolarHBondContact O-N 3.39Å; L883-S887 WeakPolarHBondContact O-CA 3.48Å; L883-S887 WeakPolarHBondContact O-CB 3.03Å; L883-S887 PolarHBondContact O-N 2.89Å
884	L	68.9	Low	67.6	Low	90 Å²	90	95.4 Å²	95.4	47%	0.471	52%	0.523	S	S	.	.	H	α-helix	trans	-73.1	-34.9	171.4	-76.7	171.8	0	0	0	111.1	L880 I882 S887 L888	L880-L884 HydrophobicContact CD2-CD1 4.2Å; L880-L884 HydrophobicContact CG-CD1 3.9Å; L880-L884 HydrophobicContact CG-CG 4.25Å; L880-L884 WeakPolarHBondContact O-CA 3.01Å; L880-L884 WeakPolarHBondContact O-CB 3.38Å; L880-L884 WeakPolarHBondContact O-CG 2.95Å; L880-L884 PolarHBondContact O-N 2.98Å; I882-L884 VanDerWaalsContact C-N 3.35Å; L884-S887 CarbonylContact O-C 3.57Å; L884-L888 WeakPolarHBondContact O-CA 3.45Å; L884-L888 WeakPolarHBondContact O-CB 3.44Å; L884-L888 PolarHBondContact O-N 3.04Å
885	M	73.6	Confident	69.6	Low	81 Å²	81	93.8 Å²	93.8	40%	0.399	52%	0.515	S	S	.	.	H	α-helix	trans	-73.1	-38.7	172.1	-74.7	-67.9	108.3	0	0	112.1	H881 I882 L888 I889	H881-M885 VanDerWaalsContact O-CB 3.32Å; H881-M885 WeakPolarHBondContact O-CB 3.09Å; H881-M885 WeakPolarHBondContact O-CG 3.05Å; H881-M885 PolarHBondContact O-N 3.47Å; I882-M885 PolarHBondContact O-N 3.35Å; M885-L888 HydrophobicContact CE-CB 4.43Å; M885-L888 HydrophobicContact CE-CD1 4.25Å; M885-L888 HydrophobicContact CE-CD2 4.42Å; M885-L888 PolarHBondContact O-N 3.25Å; M885-I889 VanDerWaalsContact O-CB 3.22Å; M885-I889 WeakPolarHBondContact O-CB 3.09Å; M885-I889 WeakPolarHBondContact O-CD1 3.29Å; M885-I889 WeakPolarHBondContact O-CG1 3.26Å; M885-I889 PolarHBondContact O-N 2.97Å
886	I	75.7	Confident	71.4	Confident	108 Å²	108	92.1 Å²	92.1	55%	0.554	52%	0.515	S	S	*	.	H	α-helix	trans	-70.5	-35	173.6	-69.5	170.3	0	0	0	110.8	I882 G890	I882-I886 HydrophobicContact CG2-CD1 3.69Å; I882-I886 HydrophobicContact CG2-CG1 4.3Å; I882-I886 VanDerWaalsContact O-CB 3.27Å; I882-I886 WeakPolarHBondContact O-CB 2.98Å; I882-I886 VanDerWaalsContact O-CG1 3.24Å; I882-I886 WeakPolarHBondContact O-CG1 3.32Å; I882-I886 PolarHBondContact O-N 2.72Å; I886-G890 WeakPolarHBondContact O-CA 3.48Å; I886-G890 PolarHBondContact O-N 2.8Å
887	S	75.7	Confident	73.1	Confident	59 Å²	59	87.1 Å²	87.1	41%	0.413	49%	0.487	S	S	.	.	H	α-helix	trans	-78.7	-24.2	173.1	-171	0	0	0	0	112.3	L883 L884 G890 I891	L883-S887 WeakPolarHBondContact O-CA 3.48Å; L883-S887 WeakPolarHBondContact O-CB 3.03Å; L883-S887 PolarHBondContact O-N 2.89Å; L884-S887 CarbonylContact O-C 3.57Å; S887-G890 CarbonylContact O-C 3.56Å; S887-I891 WeakPolarHBondContact O-CA 3.37Å; S887-I891 WeakPolarHBondContact O-CB 3.42Å; S887-I891 VanDerWaalsContact O-CD1 3.31Å; S887-I891 WeakPolarHBondContact O-CD1 3.12Å; S887-I891 WeakPolarHBondContact O-CG1 2.98Å; S887-I891 PolarHBondContact O-N 3.4Å
888	L	80.7	Confident	74.6	Confident	84 Å²	84	87.8 Å²	87.8	44%	0.44	49%	0.489	S	S	.	.	H	α-helix	trans	-84.1	-31.6	173.6	-175.4	146.4	0	0	0	110.7	L884 M885 G890 L892	L884-L888 WeakPolarHBondContact O-CA 3.45Å; L884-L888 WeakPolarHBondContact O-CB 3.44Å; L884-L888 PolarHBondContact O-N 3.04Å; M885-L888 HydrophobicContact CE-CB 4.43Å; M885-L888 HydrophobicContact CE-CD1 4.25Å; M885-L888 HydrophobicContact CE-CD2 4.42Å; M885-L888 PolarHBondContact O-N 3.25Å; L888-G890 VanDerWaalsContact C-N 3.35Å; L888-L892 HydrophobicContact CD2-CD1 3.98Å; L888-L892 HydrophobicContact CG-CD1 4.3Å; L888-L892 VanDerWaalsContact O-CB 3.25Å; L888-L892 WeakPolarHBondContact O-CB 3.17Å; L888-L892 WeakPolarHBondContact O-CD1 3.3Å; L888-L892 PolarHBondContact O-N 3.16Å
889	I	81.8	Confident	75.9	Confident	103 Å²	103	87.1 Å²	87.1	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-68.2	-37.5	162.7	-69.6	163.9	0	0	0	109.7	M885 L892 T893	M885-I889 VanDerWaalsContact O-CB 3.22Å; M885-I889 WeakPolarHBondContact O-CB 3.09Å; M885-I889 WeakPolarHBondContact O-CD1 3.29Å; M885-I889 WeakPolarHBondContact O-CG1 3.26Å; M885-I889 PolarHBondContact O-N 2.97Å; I889-L892 PolarHBondContact O-N 3.18Å; I889-T893 HydrophobicContact CG2-CG2 4.41Å; I889-T893 VanDerWaalsContact O-CB 3.31Å; I889-T893 WeakPolarHBondContact O-CB 3.08Å; I889-T893 VanDerWaalsContact O-CG2 3.31Å; I889-T893 WeakPolarHBondContact O-CG2 3.47Å; I889-T893 PolarHBondContact O-N 3.21Å; I889-T893 PolarHBondContact O-OG1 3.18Å
890	G	82.6	Confident	77.1	Confident	30 Å²	30	84.2 Å²	84.2	31%	0.309	47%	0.472	S	S	.	.	H	α-helix	trans	-65.4	-41.5	173.2	0	0	0	0	0	112.3	I886 S887 L888 T893 C894	I886-G890 WeakPolarHBondContact O-CA 3.48Å; I886-G890 PolarHBondContact O-N 2.8Å; S887-G890 CarbonylContact O-C 3.56Å; L888-G890 VanDerWaalsContact C-N 3.35Å; G890-T893 WeakPolarHBondContact CA-OG1 3.17Å; G890-T893 PolarHBondContact O-OG1 3.17Å; G890-C894 WeakPolarHBondContact O-CB 3.43Å; G890-C894 PolarHBondContact O-N 3.17Å
891	I	84.2	Confident	78.1	Confident	90 Å²	90	87.7 Å²	87.7	46%	0.462	49%	0.488	S	S	.	.	H	α-helix	trans	-74.8	-34.3	174.3	-73.1	161.8	0	0	0	110.5	S887 L895	S887-I891 WeakPolarHBondContact O-CA 3.37Å; S887-I891 WeakPolarHBondContact O-CB 3.42Å; S887-I891 VanDerWaalsContact O-CD1 3.31Å; S887-I891 WeakPolarHBondContact O-CD1 3.12Å; S887-I891 WeakPolarHBondContact O-CG1 2.98Å; S887-I891 PolarHBondContact O-N 3.4Å; I891-L895 HydrophobicContact CG2-CD1 3.67Å; I891-L895 HydrophobicContact CG2-CG 4.1Å; I891-L895 WeakPolarHBondContact O-CA 3.03Å; I891-L895 WeakPolarHBondContact O-CB 3.44Å; I891-L895 WeakPolarHBondContact O-CG 3.48Å; I891-L895 PolarHBondContact O-N 3.34Å
892	L	82.7	Confident	79.1	Confident	96 Å²	96	86.6 Å²	86.6	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-70.3	-39.3	171.8	-107.1	71.1	0	0	0	111.6	L888 I889 L895 M896	L888-L892 HydrophobicContact CD2-CD1 3.98Å; L888-L892 HydrophobicContact CG-CD1 4.3Å; L888-L892 VanDerWaalsContact O-CB 3.25Å; L888-L892 WeakPolarHBondContact O-CB 3.17Å; L888-L892 WeakPolarHBondContact O-CD1 3.3Å; L888-L892 PolarHBondContact O-N 3.16Å; I889-L892 PolarHBondContact O-N 3.18Å; L892-L895 PolarHBondContact O-N 2.95Å; L892-M896 WeakPolarHBondContact O-CA 3.34Å; L892-M896 WeakPolarHBondContact O-CB 3.19Å; L892-M896 WeakPolarHBondContact O-CG 3.46Å; L892-M896 PolarHBondContact O-N 3.41Å
893	T	82.8	Confident	79.7	Confident	93 Å²	93	87.3 Å²	87.3	57%	0.571	49%	0.49	S	S	*	.	H	α-helix	trans	-73.8	-31.3	175.5	50.6	0	0	0	0	111.5	I889 G890 G897	I889-T893 HydrophobicContact CG2-CG2 4.41Å; I889-T893 VanDerWaalsContact O-CB 3.31Å; I889-T893 WeakPolarHBondContact O-CB 3.08Å; I889-T893 VanDerWaalsContact O-CG2 3.31Å; I889-T893 WeakPolarHBondContact O-CG2 3.47Å; I889-T893 PolarHBondContact O-N 3.21Å; I889-T893 PolarHBondContact O-OG1 3.18Å; G890-T893 WeakPolarHBondContact CA-OG1 3.17Å; G890-T893 PolarHBondContact O-OG1 3.17Å; T893-G897 WeakPolarHBondContact O-CA 3.15Å; T893-G897 PolarHBondContact O-N 3.15Å
894	C	83.4	Confident	80.2	Confident	79 Å²	79	83.9 Å²	83.9	53%	0.534	48%	0.477	S	S	.	.	H	α-helix	trans	-72.7	-37.7	169.6	-166.9	0	0	0	0	111.8	G890 G897 V898	G890-C894 WeakPolarHBondContact O-CB 3.43Å; G890-C894 PolarHBondContact O-N 3.17Å; C894-G897 CarbonylContact O-C 3.58Å; C894-G897 PolarHBondContact O-N 3.1Å; C894-V898 VanDerWaalsContact O-CB 3.26Å; C894-V898 WeakPolarHBondContact O-CB 3.49Å; C894-V898 VanDerWaalsContact O-CG2 3.22Å; C894-V898 WeakPolarHBondContact O-CG2 3.47Å; C894-V898 PolarHBondContact O-N 3.1Å
895	L	83.5	Confident	80.5	Confident	88 Å²	88	88.3 Å²	88.3	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-74.6	-35	174.9	-77.1	172	0	0	0	112	I891 L892 G897 V898 M899	I891-L895 HydrophobicContact CG2-CD1 3.67Å; I891-L895 HydrophobicContact CG2-CG 4.1Å; I891-L895 WeakPolarHBondContact O-CA 3.03Å; I891-L895 WeakPolarHBondContact O-CB 3.44Å; I891-L895 WeakPolarHBondContact O-CG 3.48Å; I891-L895 PolarHBondContact O-N 3.34Å; L892-L895 PolarHBondContact O-N 2.95Å; L895-G897 VanDerWaalsContact C-N 3.29Å; L895-V898 PolarHBondContact O-N 2.98Å; L895-M899 WeakPolarHBondContact O-CA 3.41Å; L895-M899 WeakPolarHBondContact O-CB 2.85Å; L895-M899 WeakPolarHBondContact O-CG 3.33Å; L895-M899 PolarHBondContact O-N 3.42Å
896	M	84	Confident	80.5	Confident	142 Å²	142	92 Å²	92	70%	0.7	50%	0.501	S	S	*	.	H	α-helix	trans	-74.8	-23.2	169.4	-68.7	-68.7	-76.8	0	0	111.1	L892 G900	L892-M896 WeakPolarHBondContact O-CA 3.34Å; L892-M896 WeakPolarHBondContact O-CB 3.19Å; L892-M896 WeakPolarHBondContact O-CG 3.46Å; L892-M896 PolarHBondContact O-N 3.41Å; M896-G900 WeakPolarHBondContact O-CA 3.12Å; M896-G900 PolarHBondContact O-N 3.02Å
897	G	83.2	Confident	80.2	Confident	34 Å²	34	95.2 Å²	95.2	35%	0.351	51%	0.508	S	S	.	.	H	α-helix	trans	-76.8	-36.5	168.6	0	0	0	0	0	112.8	T893 C894 L895 G900 M901	T893-G897 WeakPolarHBondContact O-CA 3.15Å; T893-G897 PolarHBondContact O-N 3.15Å; C894-G897 CarbonylContact O-C 3.58Å; C894-G897 PolarHBondContact O-N 3.1Å; L895-G897 VanDerWaalsContact C-N 3.29Å; G897-G900 CarbonylContact O-C 3.46Å; G897-M901 WeakPolarHBondContact O-CB 3.25Å; G897-M901 WeakPolarHBondContact O-CG 3.45Å; G897-M901 PolarHBondContact O-N 3.17Å
898	V	84.2	Confident	79.7	Confident	69 Å²	69	100.2 Å²	100.2	42%	0.418	52%	0.518	S	S	.	.	H	α-helix	trans	-81.2	-45.1	177.6	166	0	0	0	0	110.3	C894 L895 G900 M901 L902	C894-V898 VanDerWaalsContact O-CB 3.26Å; C894-V898 WeakPolarHBondContact O-CB 3.49Å; C894-V898 VanDerWaalsContact O-CG2 3.22Å; C894-V898 WeakPolarHBondContact O-CG2 3.47Å; C894-V898 PolarHBondContact O-N 3.1Å; L895-V898 PolarHBondContact O-N 2.98Å; V898-G900 VanDerWaalsContact C-N 3.28Å; V898-M901 CarbonylContact O-C 3.57Å; V898-M901 WeakPolarHBondContact O-CA 3.19Å; V898-M901 PolarHBondContact O-N 2.93Å; V898-M901 VanDerWaalsContact O-N 3.13Å; V898-L902 HydrophobicContact CG1-CD1 3.83Å; V898-L902 HydrophobicContact CG1-CG 4.28Å; V898-L902 WeakPolarHBondContact O-CA 3.4Å; V898-L902 WeakPolarHBondContact O-CB 3.34Å; V898-L902 WeakPolarHBondContact O-CG 3.45Å; V898-L902 PolarHBondContact O-N 3.43Å
899	M	80.2	Confident	78.8	Confident	107 Å²	107	102.5 Å²	102.5	53%	0.527	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-35.7	165.4	-68.3	-63.7	-172.6	0	0	110.6	L895 M901 L902 L903	L895-M899 WeakPolarHBondContact O-CA 3.41Å; L895-M899 WeakPolarHBondContact O-CB 2.85Å; L895-M899 WeakPolarHBondContact O-CG 3.33Å; L895-M899 PolarHBondContact O-N 3.42Å; M899-M901 VanDerWaalsContact C-N 3.33Å; M899-M901 PolarHBondContact O-N 3.43Å; M899-L902 PolarHBondContact O-N 2.62Å; M899-L902 HydrophobicContact SD-CD1 4.32Å; M899-L903 WeakPolarHBondContact O-CA 3.38Å; M899-L903 WeakPolarHBondContact O-CB 3.25Å; M899-L903 WeakPolarHBondContact O-CG 2.95Å; M899-L903 PolarHBondContact O-N 2.99Å
900	G	82.2	Confident	78	Confident	34 Å²	34	104 Å²	104	35%	0.351	53%	0.531	S	S	.	.	H	α-helix	trans	-63.2	-37.6	169.7	0	0	0	0	0	112.3	M896 G897 V898 A904	M896-G900 WeakPolarHBondContact O-CA 3.12Å; M896-G900 PolarHBondContact O-N 3.02Å; G897-G900 CarbonylContact O-C 3.46Å; V898-G900 VanDerWaalsContact C-N 3.28Å; G900-A904 WeakPolarHBondContact O-CA 3.28Å; G900-A904 WeakPolarHBondContact O-CB 3.47Å; G900-A904 PolarHBondContact O-N 2.89Å
901	M	80	Confident	76.8	Confident	133 Å²	133	106.9 Å²	106.9	66%	0.655	54%	0.538	S	S	*	.	H	α-helix	trans	-83	-15.7	175.5	-77	-84.4	-82	0	0	113.9	G897 V898 M899 R905	G897-M901 WeakPolarHBondContact O-CB 3.25Å; G897-M901 WeakPolarHBondContact O-CG 3.45Å; G897-M901 PolarHBondContact O-N 3.17Å; V898-M901 CarbonylContact O-C 3.57Å; V898-M901 WeakPolarHBondContact O-CA 3.19Å; V898-M901 PolarHBondContact O-N 2.93Å; V898-M901 VanDerWaalsContact O-N 3.13Å; M899-M901 VanDerWaalsContact C-N 3.33Å; M899-M901 PolarHBondContact O-N 3.43Å; M901-R905 WeakPolarHBondContact O-CA 3.42Å; M901-R905 WeakPolarHBondContact O-CB 3.46Å; M901-R905 WeakPolarHBondContact O-CG 3.4Å; M901-R905 PolarHBondContact O-N 3.34Å
902	L	79.9	Confident	75.3	Confident	86 Å²	86	105.6 Å²	105.6	45%	0.45	53%	0.533	S	S	.	.	H	α-helix	trans	-93.8	-37.7	174.9	-76	171.8	0	0	0	110.9	V898 M899 R905 K906	V898-L902 HydrophobicContact CG1-CD1 3.83Å; V898-L902 HydrophobicContact CG1-CG 4.28Å; V898-L902 WeakPolarHBondContact O-CA 3.4Å; V898-L902 WeakPolarHBondContact O-CB 3.34Å; V898-L902 WeakPolarHBondContact O-CG 3.45Å; V898-L902 PolarHBondContact O-N 3.43Å; M899-L902 PolarHBondContact O-N 2.62Å; M899-L902 HydrophobicContact SD-CD1 4.32Å; L902-R905 CarbonylContact O-C 3.56Å; L902-R905 PolarHBondContact O-N 3.07Å; L902-K906 WeakPolarHBondContact O-CB 3.3Å; L902-K906 PolarHBondContact O-N 2.98Å
903	L	78.8	Confident	74	Confident	116 Å²	116	108.2 Å²	108.2	61%	0.607	54%	0.542	S	S	*	.	H	α-helix	trans	-64.2	-48.3	161.6	-70.7	167.8	0	0	0	108.7	M899 R905 K906 Y907	M899-L903 WeakPolarHBondContact O-CA 3.38Å; M899-L903 WeakPolarHBondContact O-CB 3.25Å; M899-L903 WeakPolarHBondContact O-CG 2.95Å; M899-L903 PolarHBondContact O-N 2.99Å; L903-R905 VanDerWaalsContact C-N 3.34Å; L903-R905 PolarHBondContact O-N 3.28Å; L903-K906 PolarHBondContact O-N 3.45Å; L903-K906 VanDerWaalsContact O-N 3.17Å; L903-Y907 WeakPolarHBondContact O-CA 3.43Å; L903-Y907 WeakPolarHBondContact O-CB 3.36Å; L903-Y907 PolarHBondContact O-N 2.96Å
904	A	76.9	Confident	72.7	Confident	39 Å²	39	107.7 Å²	107.7	32%	0.322	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-33.2	171.9	0	0	0	0	0	112.2	G900 R908	G900-A904 WeakPolarHBondContact O-CA 3.28Å; G900-A904 WeakPolarHBondContact O-CB 3.47Å; G900-A904 PolarHBondContact O-N 2.89Å; A904-R908 WeakPolarHBondContact O-CA 3.45Å; A904-R908 WeakPolarHBondContact O-CB 3.45Å; A904-R908 PolarHBondContact O-N 3.04Å
905	R	74.9	Confident	70.9	Confident	184 Å²	184	110.7 Å²	110.7	69%	0.694	54%	0.539	S	S	*	.	H	α-helix	trans	-69.7	-33.9	170.7	-97.7	178.7	159	159.9	-5.9	112.7	M901 L902 L903 R908 H909	M901-R905 WeakPolarHBondContact O-CA 3.42Å; M901-R905 WeakPolarHBondContact O-CB 3.46Å; M901-R905 WeakPolarHBondContact O-CG 3.4Å; M901-R905 PolarHBondContact O-N 3.34Å; L902-R905 CarbonylContact O-C 3.56Å; L902-R905 PolarHBondContact O-N 3.07Å; L903-R905 VanDerWaalsContact C-N 3.34Å; L903-R905 PolarHBondContact O-N 3.28Å; R905-R908 CarbonylContact O-C 3.43Å; R905-H909 WeakPolarHBondContact O-CA 3.4Å; R905-H909 WeakPolarHBondContact O-CB 3.44Å; R905-H909 PolarHBondContact O-N 3.45Å
906	K	73.2	Confident	69.3	Low	157 Å²	157	111.5 Å²	111.5	68%	0.683	54%	0.544	S	S	*	.	H	α-helix	trans	-76.7	-45	179.1	-174.4	175.4	-177.6	179.1	0	110.7	L902 L903 H909 H910	L902-K906 WeakPolarHBondContact O-CB 3.3Å; L902-K906 PolarHBondContact O-N 2.98Å; L903-K906 PolarHBondContact O-N 3.45Å; L903-K906 VanDerWaalsContact O-N 3.17Å; K906-H909 CarbonylContact O-C 3.58Å; K906-H909 WeakPolarHBondContact O-CB 3.48Å; K906-H909 PolarHBondContact O-N 3.21Å; K906-H910 WeakPolarHBondContact O-CB 3.4Å; K906-H910 PolarHBondContact O-N 3.39Å
907	Y	70	Confident	67.8	Low	176 Å²	176	109 Å²	109	69%	0.69	54%	0.54	S	S	*	.	H	α-helix	trans	-68.3	-37.7	173.8	-144.8	-80.4	0	0	0	111.1	L903 H910 L911	L903-Y907 WeakPolarHBondContact O-CA 3.43Å; L903-Y907 WeakPolarHBondContact O-CB 3.36Å; L903-Y907 PolarHBondContact O-N 2.96Å; Y907-H910 PolarHBondContact O-N 2.99Å; Y907-L911 HydrophobicContact CD1-CD1 4.28Å; Y907-L911 HydrophobicContact CE1-CD1 4.23Å; Y907-L911 WeakPolarHBondContact O-CB 3.41Å; Y907-L911 PolarHBondContact O-N 3.34Å
908	R	64.5	Low	66	Low	165 Å²	165	114 Å²	114	62%	0.623	56%	0.558	S	S	*	*	H	α-helix	trans	-77.6	-20.5	169.6	-165.9	-175.7	-70.4	178.1	-3	112.4	A904 R905 N912	A904-R908 WeakPolarHBondContact O-CA 3.45Å; A904-R908 WeakPolarHBondContact O-CB 3.45Å; A904-R908 PolarHBondContact O-N 3.04Å; R905-R908 CarbonylContact O-C 3.43Å; R908-N912 WeakPolarHBondContact O-CA 3.34Å; R908-N912 WeakPolarHBondContact O-CB 3.48Å; R908-N912 PolarHBondContact O-N 2.99Å; R908-N912 PolarHBondContact O-OD1 3.31Å
909	H	62.5	Low	64.2	Low	132 Å²	132	114.9 Å²	114.9	61%	0.611	56%	0.559	S	S	*	*	H	α-helix	trans	-71	-40.1	164.3	-116.1	-89.8	0	0	0	110.1	R905 K906 N912 H913	R905-H909 WeakPolarHBondContact O-CA 3.4Å; R905-H909 WeakPolarHBondContact O-CB 3.44Å; R905-H909 PolarHBondContact O-N 3.45Å; K906-H909 CarbonylContact O-C 3.58Å; K906-H909 WeakPolarHBondContact O-CB 3.48Å; K906-H909 PolarHBondContact O-N 3.21Å; H909-N912 CarbonylContact O-C 3.37Å; H909-N912 PolarHBondContact O-N 3.34Å; H909-H913 WeakPolarHBondContact O-CB 3.44Å; H909-H913 PolarHBondContact O-N 2.95Å
910	H	63.3	Low	62.7	Low	135 Å²	135	118.6 Å²	118.6	63%	0.625	58%	0.575	S	S	*	*	H	α-helix	trans	-68	-43.6	176.3	-146.3	-69.4	0	0	0	110.8	K906 Y907 H913 T914	K906-H910 WeakPolarHBondContact O-CB 3.4Å; K906-H910 PolarHBondContact O-N 3.39Å; Y907-H910 PolarHBondContact O-N 2.99Å; H910-H913 PolarHBondContact O-N 2.95Å; H910-T914 PolarHBondContact O-N 3.35Å; H910-T914 PolarHBondContact O-OG1 3.5Å
911	L	58.5	Low	60.8	Low	89 Å²	89	121 Å²	121	47%	0.466	59%	0.587	S	S	.	*	H	α-helix	trans	-66.9	-36	172.6	-124.3	78	0	0	0	112.1	Y907 T914 R915	Y907-L911 HydrophobicContact CD1-CD1 4.28Å; Y907-L911 HydrophobicContact CE1-CD1 4.23Å; Y907-L911 WeakPolarHBondContact O-CB 3.41Å; Y907-L911 PolarHBondContact O-N 3.34Å; L911-T914 WeakPolarHBondContact CA-OG1 3.45Å; L911-T914 CarbonylContact O-C 3.41Å; L911-T914 PolarHBondContact O-N 3.46Å; L911-T914 PolarHBondContact O-OG1 3.47Å; L911-R915 WeakPolarHBondContact O-CB 3.26Å; L911-R915 PolarHBondContact O-N 3.38Å
912	N	53.5	Low	59	Low	64 Å²	64	123.3 Å²	123.3	34%	0.342	59%	0.593	S	S	.	*	H	α-helix	trans	-76.4	-24.2	173.2	-71.7	2.9	0	0	0	111.5	R908 H909 T914 R915 N916	R908-N912 WeakPolarHBondContact O-CA 3.34Å; R908-N912 WeakPolarHBondContact O-CB 3.48Å; R908-N912 PolarHBondContact O-N 2.99Å; R908-N912 PolarHBondContact O-OD1 3.31Å; H909-N912 CarbonylContact O-C 3.37Å; H909-N912 PolarHBondContact O-N 3.34Å; N912-T914 VanDerWaalsContact C-N 3.31Å; N912-R915 PolarHBondContact O-N 2.98Å; N912-N916 WeakPolarHBondContact O-CA 3.47Å; N912-N916 WeakPolarHBondContact O-CB 3.36Å; N912-N916 PolarHBondContact O-N 2.94Å; N912-N916 PolarHBondContact O-OD1 2.92Å
913	H	55.2	Low	57.1	Low	150 Å²	150	124 Å²	124	69%	0.694	61%	0.605	S	S	*	*	H	α-helix	trans	-70	-32	169	-124.3	-69.1	0	0	0	111.5	H909 H910	H909-H913 WeakPolarHBondContact O-CB 3.44Å; H909-H913 PolarHBondContact O-N 2.95Å; H910-H913 PolarHBondContact O-N 2.95Å
914	T	53.9	Low	54.9	Low	83 Å²	83	126 Å²	126	51%	0.509	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	4.1	172.6	58.5	0	0	0	0	114.5	H910 L911 N912 S917	H910-T914 PolarHBondContact O-N 3.35Å; H910-T914 PolarHBondContact O-OG1 3.5Å; L911-T914 WeakPolarHBondContact CA-OG1 3.45Å; L911-T914 CarbonylContact O-C 3.41Å; L911-T914 PolarHBondContact O-N 3.46Å; L911-T914 PolarHBondContact O-OG1 3.47Å; N912-T914 VanDerWaalsContact C-N 3.31Å; T914-S917 VanDerWaalsContact C-OG 3.23Å; T914-S917 PolarHBondContact O-OG 2.94Å
915	R	46	Very low	53.2	Low	141 Å²	141	131.5 Å²	131.5	53%	0.532	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-124.2	-23.9	177.9	-171.3	174.7	179.4	126.2	2.1	113.6	L911 N912 S917 L918 I919	L911-R915 WeakPolarHBondContact O-CB 3.26Å; L911-R915 PolarHBondContact O-N 3.38Å; N912-R915 PolarHBondContact O-N 2.98Å; R915-S917 PolarHBondContact O-N 3.38Å; R915-L918 CarbonylContact O-C 3.56Å; R915-L918 WeakPolarHBondContact O-CA 3.43Å; R915-L918 WeakPolarHBondContact O-CB 3.43Å; R915-L918 PolarHBondContact O-N 2.9Å; R915-I919 HydrophobicContact CG-CD1 3.77Å; R915-I919 HydrophobicContact CG-CG1 4.08Å; R915-I919 PolarHBondContact O-N 3.48Å
916	N	50.4	Low	51.3	Low	106 Å²	106	130 Å²	130	57%	0.567	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-20.6	166.7	-67.9	0.6	0	0	0	111.2	N912 L918	N912-N916 WeakPolarHBondContact O-CA 3.47Å; N912-N916 WeakPolarHBondContact O-CB 3.36Å; N912-N916 PolarHBondContact O-N 2.94Å; N912-N916 PolarHBondContact O-OD1 2.92Å; N916-L918 PolarHBondContact O-N 3.43Å
917	S	52.1	Low	49.4	Very low	88 Å²	88	131.2 Å²	131.2	62%	0.615	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-3.3	163.6	53.4	0	0	0	0	114	T914 R915	T914-S917 VanDerWaalsContact C-OG 3.23Å; T914-S917 PolarHBondContact O-OG 2.94Å; R915-S917 PolarHBondContact O-N 3.38Å
918	L	45	Very low	47.8	Very low	139 Å²	139	131.3 Å²	131.3	73%	0.728	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.3	-20.1	-174.1	-127	165.5	0	0	0	113	R915 N916	R915-L918 CarbonylContact O-C 3.56Å; R915-L918 WeakPolarHBondContact O-CA 3.43Å; R915-L918 WeakPolarHBondContact O-CB 3.43Å; R915-L918 PolarHBondContact O-N 2.9Å; N916-L918 PolarHBondContact O-N 3.43Å
919	I	47	Very low	46.4	Very low	88 Å²	88	130.2 Å²	130.2	45%	0.451	66%	0.661	S	S	.	*			trans	-120.2	55.9	177.6	-47	-176.2	0	0	0	109.5	R915 S921	R915-I919 HydrophobicContact CG-CD1 3.77Å; R915-I919 HydrophobicContact CG-CG1 4.08Å; R915-I919 PolarHBondContact O-N 3.48Å; I919-S921 PolarHBondContact O-N 2.94Å
920	Q	49	Very low	45.1	Very low	185 Å²	185	133.2 Å²	133.2	86%	0.864	68%	0.675	S	S	*	*			trans	-88.4	22.8	167.6	-156.8	178.4	1.2	0	0	111.6
921	S	43	Very low	43.7	Very low	84 Å²	84	131.5 Å²	131.5	59%	0.587	68%	0.677	S	S	*	*	S	Bend	trans	-146.7	137.1	175.2	69.5	0	0	0	0	111.6	I919	I919-S921 PolarHBondContact O-N 2.94Å
922	K	40.7	Very low	42.9	Very low	182 Å²	182	132.6 Å²	132.6	79%	0.791	69%	0.688	S	S	*	*			trans	69.1	118.2	174.6	-57.4	176	-176.2	176.9	0	114.8
923	S	40.7	Very low	42	Very low	101 Å²	101	138.7 Å²	138.7	71%	0.706	71%	0.714	S	S	*	*			cis	55.5	118.6	7.7	61.6	0	0	0	0	115.1
924	L	33.5	Very low	41.1	Very low	158 Å²	158	135.1 Å²	135.1	83%	0.827	71%	0.706	S	S	*	*			cis	-147.2	-168	18.7	-97.2	137.2	0	0	0	110.3
925	I	41.2	Very low	40.1	Very low	155 Å²	155	137.4 Å²	137.4	80%	0.795	72%	0.715	S	S	*	*			trans	78.2	143.9	172	-50.2	173.2	0	0	0	113.9
926	I	34.9	Very low	39.8	Very low	151 Å²	151	138.4 Å²	138.4	77%	0.774	72%	0.723	S	S	*	*				-168.7	163.5	-50.3	-107.1	162.3	0	0	0	106.5
927	K	32.3	Very low	38.8	Very low	183 Å²	183	139.7 Å²	139.7	80%	0.796	73%	0.73	S	S	*	*			trans	-65.2	141.7	174.8	-55.7	171.5	-177.1	173.8	0	111.8
928	Q	37.1	Very low	38.1	Very low	179 Å²	179	145.2 Å²	145.2	84%	0.836	74%	0.739	S	S	*	*				-167.6	124.8	120.2	-99.5	153.5	-3.2	0	0	107.2
929	N	35.6	Very low	37.6	Very low	142 Å²	142	148.9 Å²	148.9	76%	0.759	74%	0.744	S	S	*	*				47.1	99.1	84.1	-69.9	13.9	0	0	0	112.2
930	H	34.8	Very low	37.4	Very low	194 Å²	194	150.1 Å²	150.1	90%	0.898	75%	0.752	S	S	*	*				-143.6	147.7	127.1	-126.3	-85	0	0	0	111.3
931	C	33.9	Very low	36.6	Very low	100 Å²	100	146.1 Å²	146.1	68%	0.676	74%	0.742	S	S	*	*			trans	-69.5	161.9	174.8	-65.3	0	0	0	0	111.4
932	T	41.3	Very low	36	Very low	112 Å²	112	148.1 Å²	148.1	69%	0.687	75%	0.745	S	S	*	*			trans	45.5	105.5	146.5	54.1	0	0	0	0	117.8
933	Q	35.2	Very low	35.5	Very low	192 Å²	192	148.5 Å²	148.5	90%	0.897	75%	0.746	S	S	*	*				-132.3	125.5	109	-100.6	131.2	49.2	0	0	107.5
934	S	36.1	Very low	35	Very low	74 Å²	74	152.7 Å²	152.7	52%	0.517	76%	0.755	S	S	.	*			cis	54.1	94.4	47.9	-171.3	0	0	0	0	111.2
935	N	33.2	Very low	34.8	Very low	132 Å²	132	150 Å²	150	71%	0.706	75%	0.75	S	S	*	*				-152	146.5	101.6	-85.1	-30.3	0	0	0	107.2
936	K	39.2	Very low	34.7	Very low	161 Å²	161	148.1 Å²	148.1	70%	0.7	75%	0.75	S	S	*	*				58.3	128.6	58.9	-72.8	-174.4	173.5	-178.4	0	112
937	N	28.6	Very low	34.8	Very low	133 Å²	133	152.1 Å²	152.1	71%	0.711	76%	0.755	S	S	*	*			trans	71.7	166.6	158.6	-44.9	-17.5	0	0	0	117.3
938	Y	38.8	Very low	35.2	Very low	205 Å²	205	148.1 Å²	148.1	80%	0.804	75%	0.75	S	S	*	*			trans	59.5	95.6	167.5	-68	-77.6	0	0	0	119.1
939	Y	34.5	Very low	35.3	Very low	216 Å²	216	146.5 Å²	146.5	85%	0.847	74%	0.743	S	S	*	*				178.3	118	117.5	-107.2	-102.2	0	0	0	102.9
940	N	41.4	Very low	35.1	Very low	113 Å²	113	148.6 Å²	148.6	60%	0.604	74%	0.741	S	S	*	*			cis	48	85	30.4	-168.3	36.4	0	0	0	111.3	I942	N940-I942 WeakPolarHBondContact OD1-CD1 3.23Å
941	P	32.7	Very low	35.2	Very low	102 Å²	102	146.5 Å²	146.5	66%	0.662	74%	0.736	S	S	*	*				-128.5	159.4	76.7	12.8	11.9	0	0	0	112.4
942	I	30.5	Very low	35.5	Very low	126 Å²	126	148.3 Å²	148.3	65%	0.646	74%	0.738	S	S	*	*				68.3	93.6	51.2	-58.5	175.3	0	0	0	110.3	N940	N940-I942 WeakPolarHBondContact OD1-CD1 3.23Å
943	K	30.6	Very low	35.1	Very low	189 Å²	189	150.3 Å²	150.3	82%	0.822	74%	0.739	S	S	*	*				53.1	115.7	97.2	-64.7	176.5	176.9	177.7	0	115
944	Q	29.2	Very low	35	Very low	190 Å²	190	149 Å²	149	89%	0.888	73%	0.73	S	S	*	*			trans	-166	139	145.6	-107.1	171.7	16.4	0	0	108.6
945	S	31.1	Very low	35.1	Very low	102 Å²	102	151.1 Å²	151.1	71%	0.713	74%	0.742	S	S	*	*			cis	165.9	119.8	-44.4	51.3	0	0	0	0	107.5
946	S	38.5	Very low	35	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	75%	0.747	S	S	*	*			trans	-158.1	118.6	161.1	-81.2	0	0	0	0	107.8
947	R	36.1	Very low	34.6	Very low	235 Å²	235	151 Å²	151	89%	0.887	75%	0.746	S	S	*	*				92.6	77.8	56.3	-178.4	-174.4	-164.1	159.7	2.8	109.6
948	S	41.8	Very low	34.5	Very low	99 Å²	99	152.7 Å²	152.7	69%	0.692	75%	0.75	S	S	*	*				-154.5	141.2	91.1	32.8	0	0	0	0	111.6
949	Q	39.3	Very low	33.9	Very low	146 Å²	146	149.1 Å²	149.1	68%	0.682	74%	0.744	S	S	*	*				65.8	133.3	81.1	-62	166.8	-62.6	0	0	114.4
950	Y	31.2	Very low	33.4	Very low	185 Å²	185	144.1 Å²	144.1	73%	0.725	73%	0.732	S	S	*	*			cis	-139.6	173.6	17.4	-109	-68.7	0	0	0	114.5
951	L	36	Very low	32.6	Very low	151 Å²	151	146.3 Å²	146.3	79%	0.791	74%	0.739	S	S	*	*			trans	68.8	97.4	179.3	-65.1	137.6	0	0	0	114.6
952	I	39.6	Very low	32.3	Very low	138 Å²	138	149 Å²	149	71%	0.708	74%	0.743	S	S	*	*				78.5	122.5	67.1	-65.8	166	0	0	0	110.7
953	H	33.7	Very low	32	Very low	153 Å²	153	149.7 Å²	149.7	71%	0.708	75%	0.746	S	S	*	*			cis	-147.1	-147.5	14.7	-152.2	41.1	0	0	0	115.8
954	K	32.4	Very low	31.9	Very low	165 Å²	165	146.1 Å²	146.1	72%	0.717	74%	0.736	S	S	*	*			trans	-60.9	175.2	176.5	-81	177.3	-172.8	169.5	0	117
955	P	39.7	Very low	32	Very low	118 Å²	118	143.2 Å²	143.2	77%	0.766	73%	0.726	S	S	*	*			cis	-137.8	-174.7	-29.8	37.7	-19.5	0	0	0	114
956	H	31	Very low	32	Very low	178 Å²	178	144.3 Å²	144.3	82%	0.824	72%	0.724	S	S	*	*			trans	-76.3	147.7	159.1	-145	-72.5	0	0	0	110.4
957	V	29.6	Very low	31.9	Very low	112 Å²	112	146.2 Å²	146.2	68%	0.679	72%	0.724	S	S	*	*			trans	158.8	132	145.5	150.9	0	0	0	0	111.1
958	Q	27.6	Very low	31.8	Very low	169 Å²	169	140.8 Å²	140.8	79%	0.79	71%	0.711	S	S	*	*			trans	63	156.2	162.5	-82.5	162.2	-17.9	0	0	117.5
959	L	25.9	Very low	31.2	Very low	130 Å²	130	144.7 Å²	144.7	68%	0.681	72%	0.716	S	S	*	*			cis	-146.3	161.2	-19.5	-169.5	54.5	0	0	0	108.9
960	D	24.3	Very low	31	Very low	112 Å²	112	142.9 Å²	142.9	60%	0.599	72%	0.719	S	S	*	*			trans	-18.2	172.5	166.7	-46.9	-19.7	0	0	0	122.1
961	Q	24.9	Very low	30.7	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	72%	0.718	S	S	*	*			trans	78.2	139	154.5	-68.6	141.4	46.8	0	0	115.2
962	H	25.3	Very low	30.4	Very low	160 Å²	160	140.4 Å²	140.4	74%	0.741	72%	0.718	S	S	*	*				62.5	128.6	59.1	-123.6	-65.9	0	0	0	111.1
963	I	24.6	Very low	30	Very low	139 Å²	139	139 Å²	139	71%	0.713	72%	0.716	S	S	*	*			trans	68.3	134.6	162.4	-71.2	155.1	0	0	0	112.5
964	D	27.8	Very low	29.8	Very low	114 Å²	114	137.3 Å²	137.3	61%	0.61	72%	0.716	S	S	*	*			cis	-172.6	170.9	1.6	-122	21.7	0	0	0	108.4
965	N	31.9	Very low	29.6	Very low	129 Å²	129	136 Å²	136	69%	0.69	72%	0.716	S	S	*	*			trans	54.1	-177.6	148.3	-54.1	-28.6	0	0	0	116.4
966	D	31.4	Very low	29	Very low	126 Å²	126	134.2 Å²	134.2	67%	0.674	71%	0.707	S	S	*	*			cis	-116.9	160	-11.7	-110.2	-65	0	0	0	107.3	I968	D966-I968 PolarHBondContact OD1-N 3.37Å
967	I	35.2	Very low	29.1	Very low	153 Å²	153	133.1 Å²	133.1	79%	0.785	70%	0.702	S	S	*	*	S	Bend		-145.1	115.4	60.6	-80.5	173.3	0	0	0	111.1
968	I	34.7	Very low	29	Very low	121 Å²	121	133.8 Å²	133.8	62%	0.621	70%	0.701	S	S	*	*			trans	60.3	109.2	134.2	-58	-177.8	0	0	0	118.8	D966	D966-I968 PolarHBondContact OD1-N 3.37Å
969	K	29.2	Very low	29	Very low	182 Å²	182	132.1 Å²	132.1	79%	0.791	70%	0.697	S	S	*	*				38.6	140.8	127.9	-67.1	164.1	172.9	166.4	0	119.7
970	S	34.4	Very low	29	Very low	107 Å²	107	131 Å²	131	75%	0.748	70%	0.696	S	S	*	*			cis	-151.8	136.5	15.8	27.2	0	0	0	0	110.9
971	L	26.5	Very low	29.2	Very low	136 Å²	136	132.2 Å²	132.2	71%	0.712	70%	0.702	S	S	*	*				74.2	128.1	65.5	-104.2	169.1	0	0	0	113.5
972	L	29.4	Very low	29.4	Very low	148 Å²	148	129.4 Å²	129.4	78%	0.775	70%	0.696	S	S	*	*			trans	71.8	144	170.7	-49.5	172.6	0	0	0	114.2
973	T	31	Very low	29.5	Very low	109 Å²	109	127.7 Å²	127.7	67%	0.669	69%	0.692	S	S	*	*			cis	-156.5	130.1	-3.4	9.7	0	0	0	0	106.6
974	V	28.6	Very low	29.7	Very low	117 Å²	117	128.5 Å²	128.5	71%	0.709	69%	0.693	S	S	*	*				75.8	140.7	88	170.8	0	0	0	0	113.9
975	D	29.1	Very low	30	Very low	137 Å²	137	129.6 Å²	129.6	73%	0.733	70%	0.697	S	S	*	*			trans	64.9	126	176	-67.7	-40.4	0	0	0	117.8
976	S	27.7	Very low	29.9	Very low	81 Å²	81	127.9 Å²	127.9	57%	0.566	69%	0.692	S	S	*	*			cis	101.9	177.6	26.9	88.8	0	0	0	0	113.7
977	H	32.3	Very low	29.8	Very low	155 Å²	155	128.6 Å²	128.6	72%	0.718	70%	0.695	S	S	*	*			trans	69.9	121.6	-163.8	-58.1	-83.4	0	0	0	115.4
978	I	27.3	Very low	29.7	Very low	127 Å²	127	127.8 Å²	127.8	65%	0.651	69%	0.692	S	S	*	*			cis	91.5	134.6	32.7	-62.3	164.8	0	0	0	112.7
979	N	27.5	Very low	29.6	Very low	133 Å²	133	128.2 Å²	128.2	71%	0.711	70%	0.696	S	S	*	*			trans	71	106	170.6	-73.3	-2.6	0	0	0	115.9
980	T	26.4	Very low	29.9	Very low	107 Å²	107	125 Å²	125	66%	0.656	69%	0.691	S	S	*	*				80.8	162.1	67.7	64.6	0	0	0	0	113.2
981	N	28.1	Very low	29.7	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	69%	0.692	S	S	*	*			trans	77.3	136.8	172.2	-57.2	-10.8	0	0	0	116.2
982	T	28.2	Very low	30	Very low	98 Å²	98	123 Å²	123	60%	0.601	69%	0.688	S	S	*	*			cis	-178	141.1	-28.1	24.1	0	0	0	0	106.9
983	N	28.5	Very low	29.9	Very low	125 Å²	125	121 Å²	121	67%	0.668	69%	0.687	S	S	*	*			trans	61.5	167	147.5	-53.6	-7.7	0	0	0	119.5
984	H	29.1	Very low	30	Very low	155 Å²	155	120.7 Å²	120.7	72%	0.718	69%	0.689	S	S	*	*			trans	73.4	147.6	156.6	-58.6	-51.6	0	0	0	117.2
985	I	33.6	Very low	29.9	Very low	138 Å²	138	120.9 Å²	120.9	71%	0.708	69%	0.691	S	S	*	*			cis	-140.2	116.4	-0.9	-127.1	156.2	0	0	0	111.4
986	T	30.4	Very low	29.9	Very low	93 Å²	93	119.6 Å²	119.6	57%	0.571	69%	0.693	S	S	*	*				34.8	133.4	128.5	67.6	0	0	0	0	122.6
987	N	28.3	Very low	29.8	Very low	140 Å²	140	120.3 Å²	120.3	75%	0.749	70%	0.698	S	S	*	*			trans	76.5	166.5	133.2	-62.4	2	0	0	0	120.5
988	N	33.8	Very low	29.7	Very low	136 Å²	136	118.6 Å²	118.6	73%	0.727	70%	0.703	S	S	*	*			trans	81.1	134.7	172.4	-51.4	-17.4	0	0	0	114.9
989	N	33.3	Very low	30	Very low	131 Å²	131	116.4 Å²	116.4	70%	0.701	70%	0.699	S	S	*	*			cis	-158.1	129.8	-5.2	-110.7	-3.9	0	0	0	108.7
990	V	33.6	Very low	30.3	Very low	114 Å²	114	117 Å²	117	69%	0.691	70%	0.702	S	S	*	*				90.8	124.2	90.7	161.8	0	0	0	0	115.1
991	S	31.3	Very low	30.7	Very low	110 Å²	110	116.6 Å²	116.6	77%	0.769	70%	0.704	S	S	*	*			trans	61.3	164.7	164.7	67.7	0	0	0	0	116.8
992	S	33.2	Very low	31	Very low	90 Å²	90	116.3 Å²	116.3	63%	0.629	70%	0.702	S	S	*	*			cis	-150.4	143	-1.4	20.8	0	0	0	0	106.3
993	S	27.7	Very low	31.2	Very low	106 Å²	106	118.5 Å²	118.5	74%	0.741	71%	0.71	S	S	*	*				55	149.2	67.3	78.6	0	0	0	0	115
994	S	32.1	Very low	31.4	Very low	103 Å²	103	116.9 Å²	116.9	72%	0.72	71%	0.709	S	S	*	*			trans	66.7	121.5	-164.8	70.8	0	0	0	0	114.3
995	T	26.3	Very low	31.5	Very low	122 Å²	122	116.7 Å²	116.7	75%	0.748	71%	0.713	S	S	*	*			cis	73.8	135.2	41.8	72.1	0	0	0	0	115.1
996	S	28.3	Very low	31.5	Very low	110 Å²	110	114.8 Å²	114.8	77%	0.769	71%	0.712	S	S	*	*			trans	68.2	157	163.9	83	0	0	0	0	115.6
997	S	27.4	Very low	31.3	Very low	96 Å²	96	115.1 Å²	115.1	67%	0.671	72%	0.718	S	S	*	*			cis	-174.3	165.7	-27.5	54	0	0	0	0	108.5
998	S	29.2	Very low	31.3	Very low	118 Å²	118	112.9 Å²	112.9	83%	0.825	71%	0.713	S	S	*	*			trans	66.9	168.4	166.4	82.6	0	0	0	0	114.6
999	S	34.1	Very low	31	Very low	81 Å²	81	112.9 Å²	112.9	57%	0.566	71%	0.713	S	S	*	*			cis	-150.7	142.5	13.1	61.7	0	0	0	0	114
1000	N	33.9	Very low	30.9	Very low	146 Å²	146	113 Å²	113	78%	0.781	71%	0.714	S	S	*	*			trans	69.1	150	151.5	-53.6	-14.2	0	0	0	116.1
1001	S	34.2	Very low	30.5	Very low	98 Å²	98	114.9 Å²	114.9	69%	0.685	72%	0.715	S	S	*	*			cis	-170.2	155.1	-2.8	31.8	0	0	0	0	107.2
1002	N	34.1	Very low	30.5	Very low	132 Å²	132	115.1 Å²	115.1	71%	0.706	71%	0.714	S	S	*	*			cis	-160.3	154.5	1.7	-104.6	-6.9	0	0	0	108.7
1003	N	32.8	Very low	30.2	Very low	145 Å²	145	120.7 Å²	120.7	78%	0.775	72%	0.723	S	S	*	*			trans	58.9	142.3	146.9	-63	-4.3	0	0	0	120.1
1004	S	33.7	Very low	30.1	Very low	90 Å²	90	120.7 Å²	120.7	63%	0.629	72%	0.719	S	S	*	*			cis	-170.9	156.3	-7.5	46.3	0	0	0	0	110.5
1005	N	31.1	Very low	29.8	Very low	151 Å²	151	123 Å²	123	81%	0.807	72%	0.721	S	S	*	*			trans	41.2	137.6	135.7	-59.5	3.5	0	0	0	120.4
1006	S	31.9	Very low	29.8	Very low	98 Å²	98	123.7 Å²	123.7	69%	0.685	72%	0.72	S	S	*	*			cis	-173	145.2	2.3	41.6	0	0	0	0	112.1
1007	S	27.8	Very low	29.6	Very low	101 Å²	101	124.3 Å²	124.3	71%	0.706	72%	0.719	S	S	*	*			trans	32.9	138.2	142.6	67.4	0	0	0	0	122.9
1008	S	27.8	Very low	29.6	Very low	92 Å²	92	128.8 Å²	128.8	64%	0.643	73%	0.727	S	S	*	*				90.7	123.7	127	68.9	0	0	0	0	122
1009	N	28.1	Very low	29.7	Very low	136 Å²	136	130.4 Å²	130.4	73%	0.727	73%	0.726	S	S	*	*			trans	81.2	126.6	132	-64.3	3.4	0	0	0	121.8
1010	N	29.5	Very low	29.2	Very low	133 Å²	133	132.3 Å²	132.3	71%	0.711	74%	0.738	S	S	*	*			trans	68.9	160	143.8	-57.4	-2.1	0	0	0	117.2
1011	Q	27.2	Very low	28.9	Very low	155 Å²	155	131.1 Å²	131.1	72%	0.724	74%	0.74	S	S	*	*			cis	-159.1	165.3	-26.6	-110.4	-178.9	-53.1	0	0	107.2
1012	P	30.4	Very low	28.5	Very low	114 Å²	114	135.1 Å²	135.1	74%	0.74	75%	0.745	S	S	*	*			trans	-89.3	121.8	-177.2	33.5	-32.4	0	0	0	114.5
1013	Y	27.8	Very low	28.2	Very low	207 Å²	207	137.7 Å²	137.7	81%	0.812	75%	0.746	S	S	*	*			trans	-145.8	133.7	162.1	-82.6	-99.1	0	0	0	105.6
1014	T	25	Very low	27.8	Very low	107 Å²	107	142.6 Å²	142.6	66%	0.656	75%	0.754	S	S	*	*			cis	79.6	125.8	40.1	72.8	0	0	0	0	116.6
1015	I	24.9	Very low	27.6	Very low	150 Å²	150	144.8 Å²	144.8	77%	0.769	76%	0.758	S	S	*	*			trans	91.6	142.1	150.3	-68	159.5	0	0	0	120.2
1016	D	26.2	Very low	27.5	Very low	137 Å²	137	145.5 Å²	145.5	73%	0.733	76%	0.762	S	S	*	*			trans	64.4	100.1	163.1	-74.4	-18.6	0	0	0	124.3
1017	V	25.5	Very low	27.3	Very low	124 Å²	124	147.8 Å²	147.8	75%	0.752	76%	0.761	S	S	*	*				34.5	107.2	105.1	-174.6	0	0	0	0	117.7
1018	K	26.9	Very low	27.2	Very low	190 Å²	190	150.4 Å²	150.4	83%	0.826	76%	0.762	S	S	*	*			trans	-166.1	170.2	132.6	-114.3	158.6	-171.3	164.5	0	114.8
1019	D	30.5	Very low	27.3	Very low	152 Å²	152	151.4 Å²	151.4	81%	0.813	77%	0.769	S	S	*	*			trans	67.6	79.7	164.2	-59.3	-3.6	0	0	0	118.1
1020	C	24.8	Very low	27.4	Very low	121 Å²	121	154.7 Å²	154.7	82%	0.818	77%	0.773	S	S	*	*			trans	-68.1	171.2	158.7	-168.8	0	0	0	0	112.1
1021	C	25.9	Very low	27.3	Very low	121 Å²	121	152.7 Å²	152.7	82%	0.818	78%	0.775	S	S	*	*			trans	68.1	92.4	171.5	-65.3	0	0	0	0	117.7
1022	K	26.3	Very low	27.3	Very low	182 Å²	182	152.3 Å²	152.3	79%	0.791	78%	0.778	S	S	*	*			trans	-138.8	129.7	146.7	-120.1	-175	-178.6	179.6	0	112.5
1023	Y	28.5	Very low	27.4	Very low	185 Å²	185	152.7 Å²	152.7	73%	0.725	78%	0.78	S	S	*	*			trans	61.2	66.9	167.6	-62.4	-67.1	0	0	0	119.5	L1025	Y1023-L1025 VanDerWaalsContact C-N 3.31Å; Y1023-L1025 PolarHBondContact O-N 3.25Å; Y1023-L1025 VanDerWaalsContact O-N 3.1Å
1024	W	25	Very low	27.3	Very low	249 Å²	249	150 Å²	150	94%	0.943	78%	0.779	S	S	*	*			trans	-65.7	86.7	143.2	178.6	64.3	0	0	0	109.7
1025	L	28.4	Very low	27.4	Very low	136 Å²	136	152.5 Å²	152.5	71%	0.712	79%	0.787	S	S	*	*			trans	-166.1	78.5	175.2	-118.3	171.7	0	0	0	113	Y1023	Y1023-L1025 VanDerWaalsContact C-N 3.31Å; Y1023-L1025 PolarHBondContact O-N 3.25Å; Y1023-L1025 VanDerWaalsContact O-N 3.1Å
1026	N	29.1	Very low	27.7	Very low	166 Å²	166	151.9 Å²	151.9	89%	0.888	79%	0.785	S	S	*	*			trans	175.1	66.7	148.9	-94.6	-8.6	0	0	0	110.8
1027	E	26.8	Very low	27.8	Very low	145 Å²	145	152.8 Å²	152.8	68%	0.678	79%	0.785	S	S	*	*			trans	-95.9	163.1	155.1	-77.9	-140.1	134.7	0	0	110.2
1028	H	26.8	Very low	27.9	Very low	157 Å²	157	157.6 Å²	157.6	73%	0.727	79%	0.79	S	S	*	*			trans	69.6	94.2	174.5	-47.4	-35.1	0	0	0	116.5
1029	S	30.3	Very low	28.1	Very low	113 Å²	113	154.4 Å²	154.4	79%	0.79	79%	0.791	S	S	*	*			trans	-141.7	111	135	-83.2	0	0	0	0	111.4
1030	Y	29.7	Very low	28	Very low	204 Å²	204	155.2 Å²	155.2	80%	0.8	80%	0.795	S	S	*	*			trans	13	123.7	144.1	-49.3	-78.3	0	0	0	117.1
1031	A	27.4	Very low	28.4	Very low	91 Å²	91	154.5 Å²	154.5	75%	0.752	79%	0.788	S	S	*	*			cis	66.9	104.5	41.4	0	0	0	0	0	114.5
1032	N	26.9	Very low	28.7	Very low	148 Å²	148	156.6 Å²	156.6	79%	0.791	79%	0.786	S	S	*	*			trans	67.6	155.2	179.2	-104	-23.8	0	0	0	114.5
1033	P	31.8	Very low	29	Very low	122 Å²	122	154.6 Å²	154.6	79%	0.792	78%	0.784	S	S	*	*			cis	-136.5	159.2	44.3	41.2	-24.5	0	0	0	118.2
1034	L	26.6	Very low	29	Very low	151 Å²	151	153.7 Å²	153.7	79%	0.791	79%	0.79	S	S	*	*			trans	-83.2	161.3	150.2	-91.2	165.9	0	0	0	110.7
1035	L	27.8	Very low	29.4	Very low	158 Å²	158	146.9 Å²	146.9	83%	0.827	78%	0.778	S	S	*	*			trans	88.5	146.4	165	-64.3	166.4	0	0	0	120.1
1036	L	30.9	Very low	29.5	Very low	138 Å²	138	148.7 Å²	148.7	72%	0.723	79%	0.788	S	S	*	*			trans	83.2	84.9	157.7	-68.8	159.7	0	0	0	121.2
1037	Q	28.5	Very low	29.2	Very low	156 Å²	156	146.5 Å²	146.5	73%	0.729	78%	0.784	S	S	*	*				62.8	126	119.2	-71.1	-177.4	-3.9	0	0	122.5
1038	R	26.6	Very low	29.5	Very low	225 Å²	225	147.4 Å²	147.4	85%	0.849	79%	0.788	S	S	*	*			trans	51.9	110.5	138.4	-70.4	177.2	162.2	171.7	-6.4	119
1039	S	31	Very low	29.8	Very low	123 Å²	123	146.9 Å²	146.9	86%	0.86	79%	0.786	S	S	*	*				-167.7	177.5	99.1	30.3	0	0	0	0	111.3
1040	L	28.9	Very low	30	Very low	169 Å²	169	148.2 Å²	148.2	89%	0.885	78%	0.78	S	S	*	*			trans	-95	172.9	-171.6	-112.6	70	0	0	0	112.2
1041	P	34	Very low	30.2	Very low	105 Å²	105	145 Å²	145	68%	0.682	77%	0.772	S	S	*	*			trans	-89.7	174.4	-158.7	38.4	-40.5	0	0	0	114.5
1042	H	32	Very low	30.5	Very low	165 Å²	165	148.5 Å²	148.5	76%	0.764	77%	0.767	S	S	*	*			trans	-162.8	138.6	136.7	-100.9	-69.4	0	0	0	113
1043	D	32.4	Very low	30.8	Very low	141 Å²	141	151.3 Å²	151.3	75%	0.754	77%	0.768	S	S	*	*			trans	62.9	145.1	139.8	-51.6	-11.4	0	0	0	125.3
1044	L	27.8	Very low	30.9	Very low	165 Å²	165	150.8 Å²	150.8	86%	0.864	76%	0.758	S	S	*	*			trans	-73.6	-179.8	167.7	-91.9	69	0	0	0	112.2
1045	P	34.4	Very low	31.3	Very low	106 Å²	106	149.4 Å²	149.4	69%	0.688	75%	0.748	S	S	*	*			cis	-133.4	-177.2	-43.7	39.1	-23.8	0	0	0	111.2
1046	L	29	Very low	31.5	Very low	174 Å²	174	151 Å²	151	91%	0.911	74%	0.743	S	S	*	*			trans	179	163.6	143	-101.7	156.4	0	0	0	113.3
1047	C	24.3	Very low	31.7	Very low	121 Å²	121	151.3 Å²	151.3	82%	0.818	74%	0.74	S	S	*	*			trans	-126.4	147.3	178.8	-66.4	0	0	0	0	111.6
1048	Q	33	Very low	32	Very low	163 Å²	163	151 Å²	151	76%	0.762	74%	0.739	S	S	*	*			trans	-147.9	122	162	-96.6	174.1	-2.9	0	0	108.6
1049	Q	32.7	Very low	32.4	Very low	146 Å²	146	147.8 Å²	147.8	68%	0.682	73%	0.733	S	S	*	*				75.3	137.9	106.1	-72.2	177.2	-21.2	0	0	114.4
1050	H	33.6	Very low	32.7	Very low	141 Å²	141	148.6 Å²	148.6	65%	0.653	72%	0.722	S	S	*	*			cis	-136.9	175.1	1.4	-77	-85.9	0	0	0	107.3
1051	H	33.8	Very low	33	Very low	136 Å²	136	146.8 Å²	146.8	63%	0.63	71%	0.709	S	S	*	*			cis	-166.2	-174.6	-8.5	-114	-42.9	0	0	0	105.2
1052	Y	33.7	Very low	33.2	Very low	165 Å²	165	148.6 Å²	148.6	65%	0.647	71%	0.708	S	S	*	*			cis	-142.6	173.1	-10.1	-116.4	-80.5	0	0	0	102.5
1053	Y	35.1	Very low	33.4	Very low	207 Å²	207	146.5 Å²	146.5	81%	0.812	70%	0.699	S	S	*	*			cis	-143.9	164.2	22.6	-128.3	-82.2	0	0	0	111.8
1054	N	32.5	Very low	33.5	Very low	112 Å²	112	146.7 Å²	146.7	60%	0.599	70%	0.695	S	S	*	*			trans	-61.9	162.8	-178.1	-81	-53.3	0	0	0	115.1
1055	H	35.5	Very low	33.8	Very low	122 Å²	122	145.4 Å²	145.4	57%	0.565	69%	0.685	S	S	*	*			cis	-162.5	-178	16.1	-110	-16.8	0	0	0	108.1
1056	R	32.6	Very low	33.8	Very low	191 Å²	191	147 Å²	147	72%	0.721	68%	0.683	S	S	*	*			cis	-158.6	144	-2.3	-112.3	162.8	-163.5	-159.4	8.8	106.6
1057	H	34.9	Very low	33.8	Very low	144 Å²	144	146.3 Å²	146.3	67%	0.667	68%	0.675	S	S	*	*				51.4	135.3	87	-61.8	-63.4	0	0	0	116.9
1058	H	33.5	Very low	34.2	Very low	151 Å²	151	148.9 Å²	148.9	70%	0.699	68%	0.675	S	S	*	*			cis	-167.3	-168.5	-4.9	-126	-16.1	0	0	0	113.3
1059	H	35.7	Very low	34.1	Very low	157 Å²	157	149.6 Å²	149.6	73%	0.727	68%	0.679	S	S	*	*			trans	80	145	165	-65.7	-60.5	0	0	0	118.8
1060	H	36.8	Very low	33.9	Very low	139 Å²	139	150.9 Å²	150.9	64%	0.644	69%	0.685	S	S	*	*			cis	-168.8	164.4	-23.5	-138.3	3	0	0	0	111.6
1061	H	36.7	Very low	33.9	Very low	132 Å²	132	149.7 Å²	149.7	61%	0.611	69%	0.689	S	S	*	*			trans	63.5	161.1	164.1	-59.2	-57.7	0	0	0	117.2
1062	H	37.1	Very low	33.8	Very low	142 Å²	142	153.6 Å²	153.6	66%	0.657	70%	0.7	S	S	*	*			cis	-176.3	170.8	-22.7	-97.8	-11.9	0	0	0	108.8
1063	Q	35.7	Very low	33.4	Very low	122 Å²	122	153.9 Å²	153.9	57%	0.57	71%	0.707	S	S	*	*			cis	-164	156.2	-6.5	-122.5	177.7	39.3	0	0	110.2
1064	Q	35.4	Very low	33.3	Very low	144 Å²	144	152.5 Å²	152.5	67%	0.673	71%	0.708	S	S	*	*			trans	65.2	159.7	153.4	-62.6	178.4	24.8	0	0	117.6
1065	Q	34.7	Very low	33	Very low	138 Å²	138	155 Å²	155	65%	0.645	72%	0.716	S	S	*	*			cis	-161.4	173.1	-16.3	-105.5	-178	98.9	0	0	105.8
1066	Q	33.6	Very low	33	Very low	141 Å²	141	158.5 Å²	158.5	66%	0.659	73%	0.733	S	S	*	*			cis	-155.8	133.4	3.1	-125.7	-179.9	15.7	0	0	107
1067	Q	29.7	Very low	32.7	Very low	159 Å²	159	155.8 Å²	155.8	74%	0.743	73%	0.731	S	S	*	*				75.1	153	103	-74.4	-170.2	-7.9	0	0	120.4
1068	Q	32.6	Very low	32.5	Very low	175 Å²	175	160.5 Å²	160.5	82%	0.818	75%	0.745	S	S	*	*			trans	72.3	114.9	177.2	-53	-178.6	12.1	0	0	114.9
1069	Q	29.4	Very low	32.3	Very low	178 Å²	178	160 Å²	160	83%	0.832	74%	0.743	S	S	*	*			cis	79.5	100.4	34.8	-60.8	-173.2	-31.1	0	0	116.2
1070	Q	30.5	Very low	32.2	Very low	173 Å²	173	158.1 Å²	158.1	81%	0.808	75%	0.748	S	S	*	*				174.2	152	109.7	-93.1	179.2	4.4	0	0	112
1071	P	33.4	Very low	31.8	Very low	115 Å²	115	157.2 Å²	157.2	75%	0.747	74%	0.743	S	S	*	*			trans	-99.1	158.7	174.1	38.3	-33	0	0	0	112.7
1072	Y	30.7	Very low	31.6	Very low	218 Å²	218	157.4 Å²	157.4	86%	0.855	76%	0.758	S	S	*	*			trans	-150.9	138.3	164.7	-111.5	-80.8	0	0	0	112.8
1073	E	26.4	Very low	31.3	Very low	171 Å²	171	157 Å²	157	80%	0.799	76%	0.757	S	S	*	*			trans	-93.3	141.5	167.1	-63	177.3	96.3	0	0	110.9
1074	Q	31.9	Very low	31.1	Very low	179 Å²	179	157.6 Å²	157.6	84%	0.836	76%	0.76	S	S	*	*			trans	-172.9	111.1	143.2	-103.3	162.3	20.1	0	0	108.1
1075	H	27.4	Very low	31	Very low	163 Å²	163	159.1 Å²	159.1	76%	0.755	77%	0.766	S	S	*	*				59	108.3	94.8	-86.9	55.5	0	0	0	115.3
1076	Q	33.6	Very low	30.8	Very low	197 Å²	197	160 Å²	160	92%	0.921	77%	0.771	S	S	*	*				-157.8	146.8	121.6	-110.6	168.6	34.1	0	0	111.9
1077	L	28	Very low	30.6	Very low	133 Å²	133	162.6 Å²	162.6	70%	0.696	78%	0.783	S	S	*	*			trans	-81.9	152.1	177.6	-80.1	65.7	0	0	0	110.5
1078	Y	29.6	Very low	30.5	Very low	243 Å²	243	160.8 Å²	160.8	95%	0.953	79%	0.785	S	S	*	*			trans	-132	129.2	134.1	-110.2	-87.4	0	0	0	109.3
1079	H	29.9	Very low	30.4	Very low	141 Å²	141	157.9 Å²	157.9	65%	0.653	78%	0.783	S	S	*	*			trans	-148.2	123.2	-174.9	-164.8	48.3	0	0	0	109.4	Q1081	H1079-Q1081 PolarHBondContact NE2-NE2 3.02Å
1080	S	33.7	Very low	30.2	Very low	118 Å²	118	158.1 Å²	158.1	83%	0.825	78%	0.784	S	S	*	*			trans	-142.7	128.3	166	48.4	0	0	0	0	108.8
1081	Q	29	Very low	30.1	Very low	119 Å²	119	160.1 Å²	160.1	56%	0.556	79%	0.786	S	S	*	*			trans	-103.2	147.9	177.5	-60.3	177.9	3	0	0	109.2	H1079	H1079-Q1081 PolarHBondContact NE2-NE2 3.02Å
1082	C	30.8	Very low	29.8	Very low	137 Å²	137	162.6 Å²	162.6	93%	0.926	79%	0.788	S	S	*	*			trans	-119.3	114.8	146.7	-80.6	0	0	0	0	108.5
1083	Q	31.2	Very low	29.5	Very low	134 Å²	134	160.1 Å²	160.1	63%	0.626	79%	0.789	S	S	*	*			trans	-79.5	173.3	163.1	-46.6	174.1	2.5	0	0	107.2
1084	Q	31.8	Very low	29.5	Very low	134 Å²	134	160.5 Å²	160.5	63%	0.626	79%	0.79	S	S	*	*			cis	-143.9	160.8	17.1	-112.2	135.4	50.5	0	0	106.6
1085	H	33.1	Very low	29.2	Very low	176 Å²	176	160.5 Å²	160.5	82%	0.815	79%	0.79	S	S	*	*				-157.9	154.4	72	-113	-75.3	0	0	0	112.8
1086	Q	29.8	Very low	29.2	Very low	157 Å²	157	163.1 Å²	163.1	73%	0.734	80%	0.795	S	S	*	*			trans	-95.9	147.6	179.3	-55.3	147.7	-57.8	0	0	111.3
1087	Q	30.1	Very low	28.7	Very low	195 Å²	195	162.6 Å²	162.6	91%	0.911	79%	0.792	S	S	*	*			trans	-158.9	105.9	134.5	-118.4	179.9	13.8	0	0	112
1088	P	28.1	Very low	28.9	Very low	121 Å²	121	163.4 Å²	163.4	79%	0.786	80%	0.796	S	S	*	*			trans	-99.6	138.5	162.1	34.9	-27.8	0	0	0	110.4
1089	S	30.2	Very low	28.8	Very low	113 Å²	113	156.9 Å²	156.9	79%	0.79	79%	0.786	S	S	*	*			trans	-144.9	131.3	161.6	53.3	0	0	0	0	110.6
1090	Q	24.9	Very low	29	Very low	183 Å²	183	156.1 Å²	156.1	86%	0.855	79%	0.793	S	S	*	*			trans	-81.2	141.4	172	-58	163	-82.2	0	0	108.3
1091	Y	28.9	Very low	28.9	Very low	216 Å²	216	156 Å²	156	85%	0.847	79%	0.792	S	S	*	*			trans	-134.1	156.4	149.6	-95.7	-75.3	0	0	0	110.5
1092	Q	26.6	Very low	29.1	Very low	166 Å²	166	155.2 Å²	155.2	78%	0.776	80%	0.8	S	S	*	*			trans	-89.5	166.2	-154.4	-66.1	154.8	-97.7	0	0	113.3	Q1094	Q1092-Q1094 PolarHBondContact O-N 3.41Å
1093	L	24.2	Very low	29.1	Very low	167 Å²	167	155.1 Å²	155.1	87%	0.874	80%	0.796	S	S	*	*			trans	-58.6	127.9	155.8	-68.6	90.7	0	0	0	109.2
1094	Q	27.1	Very low	28.8	Very low	179 Å²	179	157.3 Å²	157.3	84%	0.836	81%	0.808	S	S	*	*			trans	-145.9	135.4	154.9	-111.5	172.5	-2.5	0	0	108.7	Q1092	Q1092-Q1094 PolarHBondContact O-N 3.41Å
1095	H	24.3	Very low	28.7	Very low	178 Å²	178	155.1 Å²	155.1	82%	0.824	81%	0.813	S	S	*	*			trans	-72.2	144	173.8	-57.9	-39.1	0	0	0	110
1096	Y	28.1	Very low	28.4	Very low	219 Å²	219	153 Å²	153	86%	0.859	81%	0.812	S	S	*	*			trans	-144.9	116.8	149.9	-115	-77.5	0	0	0	110.3
1097	E	24.2	Very low	28.6	Very low	185 Å²	185	150.3 Å²	150.3	86%	0.864	81%	0.809	S	S	*	*			trans	-84.5	126.5	169	-60	172.1	108.7	0	0	108.8
1098	I	30.9	Very low	28.6	Very low	150 Å²	150	147.9 Å²	147.9	77%	0.769	80%	0.802	S	S	*	*			trans	-133.5	79	156.4	-56.5	-175.2	0	0	0	108.6
1099	S	27	Very low	28.4	Very low	107 Å²	107	150 Å²	150	75%	0.748	80%	0.801	S	S	*	*			trans	38.3	151.5	139.4	49.5	0	0	0	0	123.7
1100	P	34.4	Very low	28.2	Very low	124 Å²	124	149.7 Å²	149.7	81%	0.805	80%	0.798	S	S	*	*			trans	-127.9	174.6	-163	42.8	-26.3	0	0	0	116.2
1101	S	31.8	Very low	28.3	Very low	116 Å²	116	146 Å²	146	81%	0.811	79%	0.792	S	S	*	*			trans	-165.2	148.9	153	49.4	0	0	0	0	108.4
1102	S	33.3	Very low	28.1	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	78%	0.783	S	S	*	*			cis	-169.7	148.4	-7.7	47.7	0	0	0	0	107
1103	T	31.3	Very low	28.2	Very low	136 Å²	136	138.6 Å²	138.6	83%	0.834	78%	0.778	S	S	*	*			cis	-156.5	169.1	1.4	1.8	0	0	0	0	111
1104	M	25.6	Very low	28.4	Very low	179 Å²	179	135.6 Å²	135.6	88%	0.882	76%	0.763	S	S	*	*			trans	-61	173.8	172	-52.7	174.1	70.7	0	0	112.3
1105	A	29.3	Very low	28.4	Very low	89 Å²	89	133.5 Å²	133.5	74%	0.736	75%	0.753	S	S	*	*			cis	-157.2	165.4	23.2	0	0	0	0	0	115.6
1106	T	26.5	Very low	28.7	Very low	131 Å²	131	129.9 Å²	129.9	80%	0.804	74%	0.744	S	S	*	*			trans	-106.3	177.4	155.1	57.4	0	0	0	0	108.8
1107	P	34.6	Very low	28.6	Very low	101 Å²	101	124.7 Å²	124.7	66%	0.656	73%	0.73	S	S	*	*			cis	-118.2	-178.6	-19.5	36.6	-21.1	0	0	0	111.7
1108	N	28.4	Very low	28.8	Very low	143 Å²	143	121.9 Å²	121.9	77%	0.765	72%	0.716	S	S	*	*			trans	160.9	146	131.7	-82.2	-27.7	0	0	0	114
1109	H	25.8	Very low	28.7	Very low	167 Å²	167	119.6 Å²	119.6	77%	0.773	71%	0.709	S	S	*	*			trans	9	130.7	153	-73.1	-89.5	0	0	0	122.6
1110	C	25.4	Very low	28.9	Very low	106 Å²	106	121.3 Å²	121.3	72%	0.716	71%	0.71	S	S	*	*			trans	74.9	121.3	135.6	-64	0	0	0	0	122.3
1111	S	26	Very low	28.7	Very low	106 Å²	106	123.1 Å²	123.1	74%	0.741	71%	0.712	S	S	*	*			trans	75.5	123.3	142.6	-51.6	0	0	0	0	118.3
1112	C	25.6	Very low	28.5	Very low	98 Å²	98	126.2 Å²	126.2	66%	0.662	71%	0.711	S	S	*	*				62.5	134.6	89.6	-53.8	0	0	0	0	113.5
1113	L	27.8	Very low	28.2	Very low	127 Å²	127	128 Å²	128	67%	0.665	71%	0.711	S	S	*	*			cis	-125.7	171.6	11.2	-75.2	91.4	0	0	0	110.2
1114	N	28.1	Very low	27.9	Very low	104 Å²	104	128.1 Å²	128.1	56%	0.556	71%	0.706	S	S	*	*				57	136	55	-93.1	44	0	0	0	114.2
1115	E	28.8	Very low	28.1	Very low	135 Å²	135	128.8 Å²	128.8	63%	0.631	71%	0.706	S	S	*	*			cis	-161.2	-176	-5.7	-145.7	162.8	-151.8	0	0	111.4
1116	T	29.5	Very low	27.9	Very low	103 Å²	103	131.3 Å²	131.3	63%	0.632	71%	0.707	S	S	*	*			trans	-0.9	146.5	159.2	49.8	0	0	0	0	120.4
1117	L	25.7	Very low	28	Very low	110 Å²	110	132.7 Å²	132.7	58%	0.576	71%	0.709	S	S	*	*				-164.9	163.3	53.6	-107.3	113.6	0	0	0	112.6	D405	D405-L1117 WeakPolarHBondContact OD2-CB 3.35Å; D405-L1117 WeakPolarHBondContact OD2-CD2 3.39Å
1118	F	29.8	Very low	27.6	Very low	126 Å²	126	131.7 Å²	131.7	55%	0.553	70%	0.704	S	S	*	*				177.3	151.1	109.5	-116.8	-69.6	0	0	0	112.9	D405	D405-F1118 HydrophobicContact CB-CE2 3.78Å; D405-F1118 HydrophobicContact CB-CZ 4.07Å; D405-F1118 WeakPolarHBondContact OD2-CD2 3.49Å; D405-F1118 WeakPolarHBondContact OD2-CE2 3.41Å; D405-F1118 WeakPolarHBondContact OD2-CZ 3.32Å
1119	T	28.7	Very low	27.5	Very low	101 Å²	101	131 Å²	131	62%	0.62	70%	0.701	S	S	*	*			trans	-106.8	160.8	177.7	48.3	0	0	0	0	113.7
1120	D	29.5	Very low	27.6	Very low	144 Å²	144	132.2 Å²	132.2	77%	0.77	70%	0.7	S	S	*	*			trans	53.6	124.3	154.9	-72.4	2.3	0	0	0	120.8
1121	N	31.9	Very low	28	Very low	162 Å²	162	137.7 Å²	137.7	87%	0.866	71%	0.707	S	S	*	*				-146.1	160.6	127.2	-123	-59.6	0	0	0	113.1
1122	K	26.4	Very low	27.9	Very low	180 Å²	180	137.8 Å²	137.8	78%	0.783	70%	0.704	S	S	*	*			trans	-126	-174.3	-159.9	-146.5	170.9	-166.2	164	0	110.1
1123	I	26.5	Very low	28	Very low	139 Å²	139	140.6 Å²	140.6	71%	0.713	71%	0.711	S	S	*	*			trans	81.9	107	155.3	-68.7	160.8	0	0	0	118.6
1124	I	25.4	Very low	28	Very low	140 Å²	140	141.8 Å²	141.8	72%	0.718	71%	0.711	S	S	*	*			trans	54.4	117.8	132.3	-53.8	176.1	0	0	0	119.7
1125	Q	31.3	Very low	27.8	Very low	193 Å²	193	141.3 Å²	141.3	90%	0.902	72%	0.716	S	S	*	*				-154.5	151.5	118.9	-112.5	170.9	42.7	0	0	113.7
1126	N	24.4	Very low	28	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	72%	0.722	S	S	*	*			trans	-91.1	165.7	178.5	-74.6	-49.4	0	0	0	111.8
1127	L	29.1	Very low	27.8	Very low	161 Å²	161	144.3 Å²	144.3	84%	0.843	72%	0.723	S	S	*	*			trans	125.2	142.2	155.2	-87.9	72.7	0	0	0	111.3
1128	S	25.9	Very low	27.9	Very low	79 Å²	79	144.7 Å²	144.7	55%	0.552	73%	0.73	S	S	*	*			cis	164.1	131.2	-28.5	50.7	0	0	0	0	106.7
1129	N	25.9	Very low	27.8	Very low	130 Å²	130	145.9 Å²	145.9	70%	0.695	74%	0.741	S	S	*	*			trans	74.2	149.3	154.8	-51.3	-23.3	0	0	0	120.4
1130	Y	28.2	Very low	28	Very low	191 Å²	191	146.5 Å²	146.5	75%	0.749	75%	0.747	S	S	*	*			trans	68	135	172.5	-50.2	-75.5	0	0	0	116
1131	Y	32.7	Very low	28	Very low	221 Å²	221	146.7 Å²	146.7	87%	0.867	75%	0.746	S	S	*	*			cis	-117.7	148.5	15.2	-89.1	-98.2	0	0	0	115.3
1132	T	25.1	Very low	27.9	Very low	109 Å²	109	145.1 Å²	145.1	67%	0.669	74%	0.743	S	S	*	*			trans	-96.6	175.5	167.9	51.8	0	0	0	0	111.6
1133	L	26.5	Very low	28.1	Very low	156 Å²	156	141.8 Å²	141.8	82%	0.817	74%	0.738	S	S	*	*			trans	85.2	143.7	175.7	-54.3	142.7	0	0	0	113.5
1134	K	28.2	Very low	28.3	Very low	152 Å²	152	141 Å²	141	66%	0.661	74%	0.74	S	S	*	*			cis	-140.4	128.8	14.7	-152.6	171.2	-175.5	-174.9	0	112.5	Y1136	K1134-Y1136 HydrophobicContact CD-CE2 3.98Å; K1134-Y1136 HydrophobicContact CG-CE2 4.29Å
1135	S	24.3	Very low	28.4	Very low	94 Å²	94	141.6 Å²	141.6	66%	0.657	74%	0.743	S	S	*	*			trans	-73.8	139.1	168	52.3	0	0	0	0	111.4
1136	Y	32.4	Very low	28.1	Very low	195 Å²	195	137.8 Å²	137.8	77%	0.765	73%	0.733	S	S	*	*			trans	-126.8	94.7	153.9	-89.5	-77.7	0	0	0	110.5	K1134	K1134-Y1136 HydrophobicContact CD-CE2 3.98Å; K1134-Y1136 HydrophobicContact CG-CE2 4.29Å
1137	T	26.4	Very low	28.3	Very low	107 Å²	107	137.6 Å²	137.6	66%	0.656	74%	0.737	S	S	*	*			trans	-72.1	-178.1	159.5	46.5	0	0	0	0	110.7
1138	T	28.3	Very low	28.2	Very low	118 Å²	118	134.3 Å²	134.3	72%	0.724	73%	0.728	S	S	*	*			trans	80.4	142.4	169.9	79.6	0	0	0	0	116
1139	L	26.4	Very low	28.3	Very low	151 Å²	151	136.8 Å²	136.8	79%	0.791	74%	0.735	S	S	*	*			cis	-153	165.7	-18	-133.7	89.3	0	0	0	107.2
1140	P	33	Very low	28.6	Very low	113 Å²	113	136.7 Å²	136.7	73%	0.734	74%	0.739	S	S	*	*			trans	-87	157.8	-179.4	36.2	-31.9	0	0	0	112.4
1141	I	30.5	Very low	28.6	Very low	148 Å²	148	135.4 Å²	135.4	76%	0.759	74%	0.737	S	S	*	*			trans	-132.8	112.9	165.9	-59.1	-178.3	0	0	0	110.1	T1143	I1141-T1143 HydrophobicContact CG2-CG2 4.17Å
1142	T	29.9	Very low	28.5	Very low	130 Å²	130	130.8 Å²	130.8	80%	0.798	73%	0.733	S	S	*	*			trans	-97.5	111.9	163.4	46.9	0	0	0	0	109.8
1143	T	29.1	Very low	28.6	Very low	110 Å²	110	129.9 Å²	129.9	68%	0.675	73%	0.73	S	S	*	*			trans	-148	116.6	166	48.2	0	0	0	0	106.5	I1141	I1141-T1143 HydrophobicContact CG2-CG2 4.17Å
1144	T	31	Very low	28.9	Very low	123 Å²	123	133 Å²	133	76%	0.755	74%	0.738	S	S	*	*			cis	50.5	95.4	41.9	72.8	0	0	0	0	114.2
1145	I	27.5	Very low	29	Very low	152 Å²	152	135.5 Å²	135.5	78%	0.779	75%	0.749	S	S	*	*			trans	169.6	91.8	157.3	-92.3	152.1	0	0	0	104.2
1146	T	24.6	Very low	29.4	Very low	113 Å²	113	136.1 Å²	136.1	69%	0.693	75%	0.753	S	S	*	*				72.3	144.3	83.4	59.7	0	0	0	0	114.8
1147	T	29.5	Very low	29.3	Very low	136 Å²	136	133.3 Å²	133.3	83%	0.834	75%	0.751	S	S	*	*			trans	77.5	140.8	-175	73.8	0	0	0	0	115.8
1148	S	27.7	Very low	29.5	Very low	93 Å²	93	135.4 Å²	135.4	65%	0.65	75%	0.753	S	S	*	*			cis	-176.1	148.4	-31.7	45	0	0	0	0	109.2
1149	N	27.3	Very low	29.5	Very low	131 Å²	131	136.6 Å²	136.6	70%	0.701	76%	0.755	S	S	*	*			trans	32.8	132.6	149.8	-51.3	-18.1	0	0	0	119.4
1150	T	32.8	Very low	29.5	Very low	128 Å²	128	133.6 Å²	133.6	79%	0.785	75%	0.747	S	S	*	*				-142.8	153.3	53	50.7	0	0	0	0	112.1
1151	F	27.2	Very low	29.3	Very low	163 Å²	163	139.5 Å²	139.5	72%	0.715	75%	0.754	S	S	*	*				57.2	140.6	58.7	-77.3	-80.9	0	0	0	112.8
1152	T	30	Very low	29.1	Very low	125 Å²	125	140.7 Å²	140.7	77%	0.767	76%	0.757	S	S	*	*			cis	-135.6	178.7	6.2	32.6	0	0	0	0	110.5
1153	S	29.1	Very low	29.1	Very low	89 Å²	89	140.5 Å²	140.5	62%	0.622	75%	0.751	S	S	*	*				176.6	140.5	-54.6	57.5	0	0	0	0	110.2
1154	F	31.5	Very low	29	Very low	221 Å²	221	143 Å²	143	97%	0.969	76%	0.76	S	S	*	*			trans	-124.9	125.2	162.1	-106.5	-76.7	0	0	0	110.7
1155	K	29.7	Very low	29	Very low	205 Å²	205	143.6 Å²	143.6	89%	0.891	76%	0.758	S	S	*	*			trans	-157.8	118.2	-178.3	-175.4	-174.7	179.8	-172.6	0	110.6
1156	S	34	Very low	29.3	Very low	108 Å²	108	146.5 Å²	146.5	76%	0.755	76%	0.761	S	S	*	*			trans	-177.1	134.9	173.4	-173.3	0	0	0	0	107.3
1157	L	30.8	Very low	29.7	Very low	136 Å²	136	146.2 Å²	146.2	71%	0.712	76%	0.761	S	S	*	*			cis	-144.4	125.3	-3.6	-155	70	0	0	0	110.9
1158	E	28.9	Very low	29.5	Very low	151 Å²	151	146.1 Å²	146.1	71%	0.706	76%	0.755	S	S	*	*			trans	34	149.5	141.3	-51.3	-176.8	132.7	0	0	125.5
1159	N	29.1	Very low	29.3	Very low	143 Å²	143	148.5 Å²	148.5	77%	0.765	76%	0.758	S	S	*	*			trans	79.2	139.4	152.3	-62.4	-37.4	0	0	0	120.2
1160	S	26.8	Very low	29.2	Very low	88 Å²	88	147.7 Å²	147.7	62%	0.615	75%	0.753	S	S	*	*			cis	-170.5	149.3	-18.2	57.4	0	0	0	0	111.3
1161	R	28.8	Very low	28.8	Very low	236 Å²	236	152 Å²	152	89%	0.891	76%	0.755	S	S	*	*			trans	68.9	114	171.9	-57.7	173.9	-179.8	163.8	0.3	114.1
1162	Q	27.1	Very low	28.7	Very low	174 Å²	174	149.3 Å²	149.3	81%	0.813	75%	0.752	S	S	*	*			cis	71.5	99.6	22.9	-155.6	-179.7	2	0	0	114.1
1163	N	29.8	Very low	28.4	Very low	125 Å²	125	148.8 Å²	148.8	67%	0.668	75%	0.749	S	S	*	*				-175.6	88.2	126.5	-106.7	50.3	0	0	0	109.8	D1165	N1163-D1165 PolarHBondContact ND2-OD2 2.98Å
1164	D	26.1	Very low	28.2	Very low	164 Å²	164	151 Å²	151	88%	0.877	76%	0.759	S	S	*	*			trans	-92	98.5	165.5	-69	-66.6	0	0	0	108.5
1165	D	31.7	Very low	27.9	Very low	134 Å²	134	145.2 Å²	145.2	72%	0.717	75%	0.752	S	S	*	*			trans	-100.4	117.5	179.8	-81	-57.6	0	0	0	111.9	N1163	N1163-D1165 PolarHBondContact ND2-OD2 2.98Å
1166	Y	32.2	Very low	27.6	Very low	214 Å²	214	145.2 Å²	145.2	84%	0.839	75%	0.752	S	S	*	*			trans	-47	158.5	157.4	-87	-94.5	0	0	0	111
1167	P	33.3	Very low	27.2	Very low	106 Å²	106	147.3 Å²	147.3	69%	0.688	75%	0.753	S	S	*	*				-165	173.9	60.9	46.9	-24.7	0	0	0	122
1168	L	25	Very low	26.9	Very low	134 Å²	134	147.9 Å²	147.9	70%	0.702	76%	0.757	S	S	*	*			trans	68.5	114.1	137	-101	64.9	0	0	0	123.1
1169	M	24.2	Very low	26.8	Very low	144 Å²	144	149.1 Å²	149.1	71%	0.709	76%	0.762	S	S	*	*				83	136.6	115.2	-96.3	-179.9	-176.2	0	0	123.6
1170	N	25.5	Very low	26.9	Very low	113 Å²	113	147.1 Å²	147.1	60%	0.604	76%	0.757	S	S	*	*			trans	83.8	118.6	132.7	-76.9	-23.4	0	0	0	121.7
1171	R	23.8	Very low	26.9	Very low	218 Å²	218	147.1 Å²	147.1	82%	0.823	76%	0.757	S	S	*	*				71.8	151.3	129.4	-66.3	-176.9	167.1	-178.4	-6	117.4
1172	T	24.6	Very low	26.8	Very low	107 Å²	107	144.4 Å²	144.4	66%	0.656	75%	0.754	S	S	*	*			cis	-163.8	161.7	-10.5	21.8	0	0	0	0	110.2
1173	T	24.5	Very low	26.8	Very low	114 Å²	114	142.7 Å²	142.7	70%	0.699	76%	0.756	S	S	*	*			trans	47.2	113.4	145.2	57.8	0	0	0	0	121.1
1174	T	24.7	Very low	26.7	Very low	135 Å²	135	144.5 Å²	144.5	83%	0.828	77%	0.765	S	S	*	*				27.3	120.2	124.7	59.3	0	0	0	0	120.4
1175	A	25.4	Very low	26.6	Very low	101 Å²	101	145.2 Å²	145.2	84%	0.835	77%	0.767	S	S	*	*			trans	-161.5	162.2	138.4	0	0	0	0	0	111.6
1176	F	22.7	Very low	26.4	Very low	205 Å²	205	143.2 Å²	143.2	90%	0.899	76%	0.763	S	S	*	*			trans	-94.7	-177.9	178	-76.4	-109.3	0	0	0	112.1
1177	I	25.4	Very low	26.1	Very low	151 Å²	151	138.1 Å²	138.1	77%	0.774	76%	0.759	S	S	*	*			trans	100.4	101.1	154.7	-51.8	179.1	0	0	0	117.1
1178	L	25.9	Very low	25.8	Very low	149 Å²	149	137.8 Å²	137.8	78%	0.78	76%	0.759	S	S	*	*			trans	25.4	127.7	131.7	-64.6	153.8	0	0	0	120.8
1179	E	26.1	Very low	25.9	Very low	177 Å²	177	137.9 Å²	137.9	83%	0.827	76%	0.76	S	S	*	*				39.8	162.8	126.6	-85.7	-159.1	140.5	0	0	123.1
1180	P	31.7	Very low	26.2	Very low	100 Å²	100	137.8 Å²	137.8	65%	0.649	76%	0.763	S	S	*	*			cis	-136.6	-173.6	5.1	39.5	-20.4	0	0	0	116.4
1181	S	26.7	Very low	26.4	Very low	89 Å²	89	137.5 Å²	137.5	62%	0.622	77%	0.769	S	S	*	*			trans	92.3	125.7	136.2	77.9	0	0	0	0	122.5
1182	H	26.8	Very low	26.8	Very low	178 Å²	178	131.5 Å²	131.5	82%	0.824	76%	0.761	S	S	*	*			trans	60.3	138	155.7	-54.8	-52.2	0	0	0	119.5
1183	T	27.5	Very low	27.1	Very low	139 Å²	139	133.1 Å²	133.1	85%	0.853	77%	0.765	S	S	*	*				-161.1	148.3	87.3	21.3	0	0	0	0	114.1
1184	L	26.4	Very low	27.3	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	77%	0.766	S	S	*	*			trans	-77.1	135.8	166	-74.7	148.6	0	0	0	110	S1186	L1184-S1186 PolarHBondContact O-N 3.39Å
1185	I	25	Very low	27.6	Very low	180 Å²	180	133.4 Å²	133.4	92%	0.923	76%	0.76	S	S	*	*			trans	-83.2	96.2	164.3	-60.7	179	0	0	0	108.7
1186	S	27.1	Very low	27.8	Very low	91 Å²	91	133.9 Å²	133.9	64%	0.636	75%	0.753	S	S	*	*			trans	-139.4	92.9	166.1	63.7	0	0	0	0	111.6	L1184	L1184-S1186 PolarHBondContact O-N 3.39Å
1187	S	26	Very low	28.1	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	74%	0.744	S	S	*	*			trans	45.6	127.5	142.9	61.9	0	0	0	0	121.1
1188	S	26.9	Very low	28.3	Very low	99 Å²	99	128 Å²	128	69%	0.692	74%	0.742	S	S	*	*			trans	101.1	129.8	140.8	82.7	0	0	0	0	120.1
1189	N	27.9	Very low	28.6	Very low	136 Å²	136	126.4 Å²	126.4	73%	0.727	74%	0.738	S	S	*	*			trans	67.1	110.6	142.7	-58.2	-8.4	0	0	0	121.7
1190	N	28.6	Very low	28.9	Very low	142 Å²	142	123.5 Å²	123.5	76%	0.759	73%	0.732	S	S	*	*				79.6	131.1	129.9	-62.1	-8.1	0	0	0	122
1191	S	30.5	Very low	29	Very low	106 Å²	106	125.5 Å²	125.5	74%	0.741	74%	0.738	S	S	*	*			trans	68.6	112.2	139.6	56.7	0	0	0	0	121.4
1192	S	32.4	Very low	29.2	Very low	93 Å²	93	125.9 Å²	125.9	65%	0.65	74%	0.741	S	S	*	*			trans	70.6	115.4	130.2	63.3	0	0	0	0	121.9
1193	N	31.3	Very low	29.6	Very low	140 Å²	140	125 Å²	125	75%	0.749	74%	0.742	S	S	*	*				80.6	115.2	124.7	-63.1	6.5	0	0	0	121.6
1194	T	29	Very low	29.8	Very low	115 Å²	115	124.2 Å²	124.2	71%	0.706	74%	0.737	S	S	*	*				76.6	124.4	126.5	57.5	0	0	0	0	123.2
1195	I	30.3	Very low	30	Very low	140 Å²	140	122.2 Å²	122.2	72%	0.718	73%	0.732	S	S	*	*				90.6	96.9	126.9	-70.4	170.9	0	0	0	120.2
1196	T	28.7	Very low	30.3	Very low	112 Å²	112	119.3 Å²	119.3	69%	0.687	72%	0.722	S	S	*	*			trans	70.8	138.8	130.5	65.8	0	0	0	0	125.8
1197	T	29.6	Very low	30.6	Very low	114 Å²	114	121.5 Å²	121.5	70%	0.699	73%	0.732	S	S	*	*			trans	88.8	119.1	133	43.7	0	0	0	0	124.9
1198	T	30.4	Very low	30.8	Very low	118 Å²	118	125 Å²	125	72%	0.724	74%	0.739	S	S	*	*				86.3	128.4	129	50.7	0	0	0	0	126
1199	T	31.7	Very low	31	Very low	115 Å²	115	127.3 Å²	127.3	71%	0.706	74%	0.742	S	S	*	*			trans	87.5	118.1	131.9	48.1	0	0	0	0	125.8
1200	T	32	Very low	31.2	Very low	116 Å²	116	126 Å²	126	71%	0.712	74%	0.739	S	S	*	*				83.4	133.6	128.6	53.3	0	0	0	0	126.2
1201	N	33.5	Very low	31.3	Very low	143 Å²	143	125 Å²	125	77%	0.765	74%	0.739	S	S	*	*			trans	97.6	111.7	136.4	-71.5	0.5	0	0	0	125.1
1202	S	32.4	Very low	31.5	Very low	97 Å²	97	127.3 Å²	127.3	68%	0.678	74%	0.741	S	S	*	*				51.6	133.3	129.4	66.6	0	0	0	0	125
1203	N	34.5	Very low	31.5	Very low	159 Å²	159	129.4 Å²	129.4	85%	0.85	75%	0.745	S	S	*	*				-174	170.8	126.2	-96.8	-23.4	0	0	0	114.1
1204	T	31.2	Very low	31.8	Very low	123 Å²	123	129.8 Å²	129.8	76%	0.755	75%	0.747	S	S	*	*			trans	-152.5	168.2	-165.4	50.9	0	0	0	0	116.8
1205	T	31.2	Very low	32.1	Very low	119 Å²	119	131 Å²	131	73%	0.73	75%	0.749	S	S	*	*			trans	85.7	137.2	145.4	36.4	0	0	0	0	126.5
1206	T	32.1	Very low	32.3	Very low	119 Å²	119	130.9 Å²	130.9	73%	0.73	75%	0.75	S	S	*	*			trans	73.7	134	140.5	50.4	0	0	0	0	124.7
1207	T	32.4	Very low	32.5	Very low	138 Å²	138	130.7 Å²	130.7	85%	0.847	75%	0.748	S	S	*	*				179.6	155.9	103	29.5	0	0	0	0	113.8
1208	M	29.3	Very low	32.8	Very low	181 Å²	181	133.1 Å²	133.1	89%	0.892	75%	0.751	S	S	*	*			trans	-166.6	122.6	177	-140.4	-75	-153.1	0	0	110.8
1209	I	32.4	Very low	33	Very low	147 Å²	147	132.9 Å²	132.9	75%	0.754	75%	0.746	S	S	*	*			trans	-145.9	108.8	-175.5	-66.2	-172.3	0	0	0	114.6
1210	T	31.4	Very low	33.1	Very low	110 Å²	110	136 Å²	136	68%	0.675	75%	0.746	S	S	*	*			trans	43.9	118.6	142.8	70.1	0	0	0	0	126.3
1211	T	30.9	Very low	33.2	Very low	121 Å²	121	136.4 Å²	136.4	74%	0.742	74%	0.744	S	S	*	*				61.4	137.6	126.3	63.5	0	0	0	0	124.6
1212	I	34	Very low	33.2	Very low	153 Å²	153	135.3 Å²	135.3	79%	0.785	74%	0.738	S	S	*	*				177.5	129.3	113.7	-90.4	161.8	0	0	0	114.3
1213	N	34.1	Very low	33.2	Very low	138 Å²	138	136.7 Å²	136.7	74%	0.738	74%	0.738	S	S	*	*			trans	37.2	143.9	150	-61.1	13	0	0	0	127.8
1214	N	36.3	Very low	33.1	Very low	148 Å²	148	136 Å²	136	79%	0.791	73%	0.734	S	S	*	*			trans	125.3	135.8	130.1	-83.9	-2.3	0	0	0	120
1215	N	35	Very low	32.9	Very low	139 Å²	139	137.9 Å²	137.9	74%	0.743	74%	0.739	S	S	*	*			trans	-80.8	162.3	-163.8	-50.1	-23	0	0	0	116.1
1216	D	34.8	Very low	32.8	Very low	139 Å²	139	140.3 Å²	140.3	74%	0.743	75%	0.745	S	S	*	*				168.4	96.6	114.8	-85.4	-7.9	0	0	0	110
1217	T	32.9	Very low	32.6	Very low	107 Å²	107	139.3 Å²	139.3	66%	0.656	74%	0.742	S	S	*	*				78.8	137.4	93	55.5	0	0	0	0	117.6
1218	H	37.1	Very low	32.3	Very low	165 Å²	165	140.3 Å²	140.3	76%	0.764	74%	0.741	S	S	*	*			trans	76.8	141.7	166.9	-65.1	-55.8	0	0	0	119.2
1219	N	34	Very low	32.2	Very low	113 Å²	113	135.9 Å²	135.9	60%	0.604	73%	0.728	S	S	*	*			cis	-166.4	165.7	-25.8	-140.7	-5.5	0	0	0	112.5
1220	Y	34.4	Very low	31.9	Very low	181 Å²	181	134.6 Å²	134.6	71%	0.71	73%	0.727	S	S	*	*			trans	65.3	114.4	157.7	-77	-63.3	0	0	0	121.6
1221	D	33.8	Very low	31.7	Very low	124 Å²	124	138.1 Å²	138.1	66%	0.663	74%	0.738	S	S	*	*				56	144.1	116.1	-75.9	45.6	0	0	0	123
1222	N	33.8	Very low	31.5	Very low	121 Å²	121	138.6 Å²	138.6	65%	0.647	74%	0.736	S	S	*	*			cis	-165.4	177.1	-16	-134.9	-38.1	0	0	0	110.8
1223	N	32.7	Very low	31.2	Very low	126 Å²	126	137.9 Å²	137.9	67%	0.674	73%	0.734	S	S	*	*			trans	74.3	99.9	162.9	-58.2	-38.5	0	0	0	120.4
1224	N	30.4	Very low	30.9	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	73%	0.729	S	S	*	*				58.8	85.9	123.2	-55.2	-12	0	0	0	120.2
1225	N	28.9	Very low	30.6	Very low	163 Å²	163	138 Å²	138	87%	0.872	73%	0.727	S	S	*	*			trans	-148.2	103.7	140.1	-99.2	-36.5	0	0	0	109.1	S1227	N1225-S1227 PolarHBondContact O-N 3.44Å
1226	M	28.5	Very low	30.3	Very low	171 Å²	171	138.1 Å²	138.1	84%	0.842	72%	0.723	S	S	*	*			trans	-92.3	71.5	-171.8	-109.7	-80.1	-79.9	0	0	112.1	I1228	M1226-I1228 HydrophobicContact CE-CD1 4.29Å; M1226-I1228 HydrophobicContact CE-CG1 4.28Å
1227	S	27.1	Very low	29.9	Very low	98 Å²	98	138.8 Å²	138.8	69%	0.685	73%	0.726	S	S	*	*			trans	-75.2	116.6	165.2	55.7	0	0	0	0	110.2	N1225 S1229	N1225-S1227 PolarHBondContact O-N 3.44Å; S1227-S1229 PolarHBondContact O-N 2.89Å
1228	I	27.5	Very low	29.5	Very low	159 Å²	159	141.5 Å²	141.5	82%	0.815	74%	0.735	S	S	*	*			trans	-87.6	106.8	172.5	-62.7	-178.5	0	0	0	109.1	M1226	M1226-I1228 HydrophobicContact CE-CD1 4.29Å; M1226-I1228 HydrophobicContact CE-CG1 4.28Å
1229	S	25.9	Very low	29	Very low	88 Å²	88	137.9 Å²	137.9	62%	0.615	73%	0.734	S	S	*	*			trans	-122.4	136.6	173.7	50.2	0	0	0	0	111.8	S1227	S1227-S1229 PolarHBondContact O-N 2.89Å
1230	T	25.8	Very low	28.6	Very low	120 Å²	120	137.3 Å²	137.3	74%	0.736	74%	0.738	S	S	*	*			trans	46.1	103.6	151.8	56.5	0	0	0	0	120.5
1231	M	27.5	Very low	28.3	Very low	184 Å²	184	132.6 Å²	132.6	91%	0.906	73%	0.732	S	S	*	*				-134.5	123.1	129.2	-79.9	-169.4	163.2	0	0	106.9
1232	N	26.3	Very low	28	Very low	130 Å²	130	133.7 Å²	133.7	70%	0.695	73%	0.728	S	S	*	*				58.9	98.5	56.6	-71.5	-4.7	0	0	0	114.1
1233	N	29.4	Very low	27.9	Very low	138 Å²	138	133.7 Å²	133.7	74%	0.738	73%	0.734	S	S	*	*				175.2	132	105.1	-87.8	-25	0	0	0	116.2
1234	I	27.3	Very low	27.6	Very low	124 Å²	124	134.9 Å²	134.9	64%	0.636	74%	0.74	S	S	*	*			trans	60.9	108.5	132.7	-53.5	166.3	0	0	0	120.9
1235	H	28.9	Very low	27.5	Very low	164 Å²	164	134.9 Å²	134.9	76%	0.759	75%	0.745	S	S	*	*				-179.8	108.8	119.5	-99.4	-67.1	0	0	0	107.7
1236	E	28.6	Very low	27.3	Very low	142 Å²	142	134.1 Å²	134.1	66%	0.664	74%	0.741	S	S	*	*				62	105.3	82.3	-64.4	-162.9	126.9	0	0	113.7
1237	L	26.2	Very low	27.3	Very low	154 Å²	154	134.4 Å²	134.4	81%	0.806	74%	0.744	S	S	*	*				74.1	150	90	-67.9	168	0	0	0	112.6
1238	I	26	Very low	27.2	Very low	164 Å²	164	134 Å²	134	84%	0.841	74%	0.741	S	S	*	*			cis	-143.8	-179.8	29.7	-56.1	158.8	0	0	0	110.2
1239	A	26	Very low	27.3	Very low	89 Å²	89	132.9 Å²	132.9	74%	0.736	74%	0.736	S	S	*	*			trans	-124.2	-163.2	176.2	0	0	0	0	0	111.6
1240	S	26.3	Very low	27.3	Very low	100 Å²	100	134.5 Å²	134.5	70%	0.699	74%	0.743	S	S	*	*			cis	-167.1	145.4	11.1	50.7	0	0	0	0	113.6
1241	S	27.7	Very low	27.5	Very low	83 Å²	83	135.5 Å²	135.5	58%	0.58	75%	0.749	S	S	*	*			trans	66.5	149.1	137.2	71.6	0	0	0	0	124.7
1242	Y	28.4	Very low	27.5	Very low	146 Å²	146	132.3 Å²	132.3	57%	0.573	74%	0.74	S	S	*	*			trans	77.1	160.1	146.8	-64.4	-39.2	0	0	0	121.8
1243	P	30.3	Very low	27.5	Very low	121 Å²	121	132 Å²	132	79%	0.786	74%	0.743	S	S	*	*			cis	-136.7	-170.1	-28.3	34.6	-14.2	0	0	0	115.6
1244	I	26.6	Very low	27.4	Very low	152 Å²	152	130.9 Å²	130.9	78%	0.779	74%	0.741	S	S	*	*			trans	-88.1	160.2	-174.3	-60.1	153.9	0	0	0	113.6
1245	T	27.6	Very low	27.3	Very low	142 Å²	142	130.6 Å²	130.6	87%	0.871	75%	0.746	S	S	*	*			trans	-126	132.4	159.3	55	0	0	0	0	113.2
1246	N	25.2	Very low	27.2	Very low	148 Å²	148	128.1 Å²	128.1	79%	0.791	74%	0.742	S	S	*	*			trans	-94.5	159	179.4	-68.5	-28.7	0	0	0	113.4
1247	I	28.1	Very low	27.1	Very low	176 Å²	176	128.1 Å²	128.1	90%	0.903	75%	0.747	S	S	*	*			trans	-132.6	150.7	150.1	-63.6	-174.4	0	0	0	108.6
1248	S	26.7	Very low	27.3	Very low	89 Å²	89	126.4 Å²	126.4	62%	0.622	74%	0.743	S	S	*	*			trans	-120.5	172.3	-161.9	57.9	0	0	0	0	114.9
1249	N	29.3	Very low	27.3	Very low	136 Å²	136	124.3 Å²	124.3	73%	0.727	74%	0.738	S	S	*	*			trans	155.7	104.1	131.3	-74.3	-9.5	0	0	0	110.3
1250	T	25.7	Very low	27.6	Very low	122 Å²	122	127 Å²	127	75%	0.748	74%	0.74	S	S	*	*				68.9	110.5	74.7	64.2	0	0	0	0	116.6
1251	T	29.8	Very low	27.6	Very low	141 Å²	141	128 Å²	128	87%	0.865	74%	0.738	S	S	*	*			trans	-162.5	174.8	153	1.5	0	0	0	0	109.6
1252	T	26.5	Very low	27.7	Very low	118 Å²	118	130 Å²	130	72%	0.724	74%	0.741	S	S	*	*			trans	-150.8	157.2	-151	50.8	0	0	0	0	116.5
1253	T	26.3	Very low	27.7	Very low	123 Å²	123	130 Å²	130	76%	0.755	75%	0.751	S	S	*	*			trans	69.2	155.7	149.2	47.6	0	0	0	0	118.1
1254	T	27.1	Very low	27.6	Very low	115 Å²	115	129.4 Å²	129.4	71%	0.706	75%	0.75	S	S	*	*			cis	-158.9	158.7	9.5	-5.3	0	0	0	0	113
1255	T	26.3	Very low	27.6	Very low	118 Å²	118	127 Å²	127	72%	0.724	75%	0.747	S	S	*	*			trans	-5.9	164.7	149.2	60.9	0	0	0	0	121.8
1256	T	27.2	Very low	27.5	Very low	112 Å²	112	125.3 Å²	125.3	69%	0.687	74%	0.741	S	S	*	*			cis	-163	160.5	37.4	39.3	0	0	0	0	114.3
1257	N	25.7	Very low	27.5	Very low	142 Å²	142	125.2 Å²	125.2	76%	0.759	74%	0.74	S	S	*	*			trans	24.9	150.6	137.3	-47	-3.6	0	0	0	121.2
1258	T	30.3	Very low	27.4	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.724	74%	0.738	S	S	*	*				-163	128.7	54.1	41.8	0	0	0	0	111.8
1259	T	26.7	Very low	27.4	Very low	119 Å²	119	129.1 Å²	129.1	73%	0.73	75%	0.747	S	S	*	*				52.5	123.1	96.3	63.5	0	0	0	0	119.2
1260	D	31	Very low	27.2	Very low	145 Å²	145	128.9 Å²	128.9	78%	0.775	75%	0.754	S	S	*	*			trans	140.9	152.8	144.6	-81	-26.6	0	0	0	114.2
1261	N	27	Very low	27.3	Very low	123 Å²	123	128.2 Å²	128.2	66%	0.658	75%	0.75	S	S	*	*			cis	-167.6	166.5	-40.6	-132.6	-45.3	0	0	0	111.7
1262	N	30.4	Very low	27.3	Very low	124 Å²	124	129.9 Å²	129.9	66%	0.663	75%	0.752	S	S	*	*			trans	68	120	161.1	-62.2	-48.1	0	0	0	123.1
1263	N	27	Very low	27.1	Very low	145 Å²	145	132.5 Å²	132.5	78%	0.775	75%	0.753	S	S	*	*				36.9	141.1	119.6	-48.4	-33	0	0	0	120.4
1264	S	29.1	Very low	27.1	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	75%	0.75	S	S	*	*			cis	-168.9	154	44.3	52.6	0	0	0	0	116.4
1265	S	26	Very low	27	Very low	103 Å²	103	134.6 Å²	134.6	72%	0.72	76%	0.755	S	S	*	*			trans	9.6	135.7	153.2	60.8	0	0	0	0	124.5
1266	S	26.7	Very low	26.9	Very low	105 Å²	105	136.3 Å²	136.3	73%	0.734	76%	0.755	S	S	*	*				120.6	129.4	125.2	76.4	0	0	0	0	119.9
1267	N	25.3	Very low	26.8	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	76%	0.76	S	S	*	*			trans	34.4	114.9	148.3	-53.1	-11.9	0	0	0	120.7
1268	Q	26.1	Very low	26.8	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	76%	0.763	S	S	*	*				177.6	149.8	110.8	-96.1	167.9	11.3	0	0	115.2
1269	M	25.2	Very low	26.6	Very low	162 Å²	162	142 Å²	142	80%	0.798	77%	0.767	S	S	*	*			trans	29.4	114	158.2	-65	-170.5	171.8	0	0	121.1	T1271	M1269-T1271 HydrophobicContact CB-CG2 4.5Å; M1269-T1271 PolarHBondContact O-N 3.48Å; M1269-T1271 VanDerWaalsContact O-N 3.17Å
1270	C	26.2	Very low	26.7	Very low	131 Å²	131	143.5 Å²	143.5	89%	0.885	77%	0.771	S	S	*	*			trans	-65.8	108.7	156.4	-59.3	0	0	0	0	110.5
1271	T	27.1	Very low	26.7	Very low	108 Å²	108	142.4 Å²	142.4	66%	0.663	77%	0.77	S	S	*	*			trans	-112.6	126.7	168.2	49.6	0	0	0	0	109.6	M1269 K1273	M1269-T1271 HydrophobicContact CB-CG2 4.5Å; M1269-T1271 PolarHBondContact O-N 3.48Å; M1269-T1271 VanDerWaalsContact O-N 3.17Å; T1271-K1273 PolarHBondContact O-N 3.36Å
1272	I	29.3	Very low	26.9	Very low	177 Å²	177	141.8 Å²	141.8	91%	0.908	77%	0.772	S	S	*	*			trans	-76.7	109.4	178.9	-58.7	174.3	0	0	0	108.3
1273	K	23	Very low	26.9	Very low	172 Å²	172	143.1 Å²	143.1	75%	0.748	78%	0.779	S	S	*	*			trans	-137.4	151.1	168.4	-76.8	-169.7	174.7	-179.7	0	110.6	T1271	T1271-K1273 PolarHBondContact O-N 3.36Å
1274	N	27.1	Very low	27	Very low	130 Å²	130	145.3 Å²	145.3	70%	0.695	78%	0.778	S	S	*	*			trans	70.3	84.6	175.1	-56.8	-4	0	0	0	116	Q1276	N1274-Q1276 HydrophobicContact CB-CG 4.39Å
1275	L	24.3	Very low	26.8	Very low	153 Å²	153	146.6 Å²	146.6	80%	0.801	78%	0.776	S	S	*	*			trans	-62.2	126.9	132.5	-90.6	73.1	0	0	0	107.2	F1277	L1275-F1277 HydrophobicContact CD2-CE2 4.31Å
1276	Q	24.7	Very low	26.8	Very low	153 Å²	153	148 Å²	148	72%	0.715	77%	0.774	S	S	*	*			trans	-115.1	106.8	166.8	-85.3	-174.9	-33.4	0	0	109.9	N1274 L1278	N1274-Q1276 HydrophobicContact CB-CG 4.39Å; Q1276-L1278 HydrophobicContact CB-CD1 4.44Å; Q1276-L1278 PolarHBondContact O-N 3.14Å
1277	F	24.3	Very low	26.8	Very low	184 Å²	184	149.9 Å²	149.9	81%	0.807	78%	0.775	S	S	*	*			trans	-72.1	113.5	159.6	-70.4	-95.8	0	0	0	108.1	L1275	L1275-F1277 HydrophobicContact CD2-CE2 4.31Å
1278	L	26	Very low	26.8	Very low	157 Å²	157	151.4 Å²	151.4	82%	0.822	78%	0.778	S	S	*	*			trans	-92	102.6	161.8	-104.8	76.6	0	0	0	108.6	Q1276	Q1276-L1278 HydrophobicContact CB-CD1 4.44Å; Q1276-L1278 PolarHBondContact O-N 3.14Å
1279	N	25.6	Very low	26.8	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	77%	0.772	S	S	*	*			trans	-127.9	110.4	172.7	-155	7.6	0	0	0	107.8
1280	N	29.4	Very low	26.9	Very low	152 Å²	152	147.6 Å²	147.6	81%	0.813	77%	0.767	S	S	*	*			trans	-169.2	129.8	-177.2	-99	-30.1	0	0	0	107.6
1281	T	30.9	Very low	26.9	Very low	122 Å²	122	152.7 Å²	152.7	75%	0.748	77%	0.77	S	S	*	*			cis	-138	157.6	1.2	44.6	0	0	0	0	111.2
1282	P	30.6	Very low	26.8	Very low	110 Å²	110	157.2 Å²	157.2	71%	0.714	78%	0.78	S	S	*	*			trans	-97.2	158.4	-178.9	37.5	-34.9	0	0	0	113.8
1283	N	31.5	Very low	26.6	Very low	151 Å²	151	156.8 Å²	156.8	81%	0.807	77%	0.772	S	S	*	*			trans	-164.1	111.6	141.6	-105.2	-28	0	0	0	114.1
1284	Y	28.5	Very low	26.8	Very low	191 Å²	191	156.5 Å²	156.5	75%	0.749	78%	0.777	S	S	*	*			trans	35.1	109.6	136.2	-79.1	-99.8	0	0	0	119.5
1285	L	25.7	Very low	26.9	Very low	136 Å²	136	155.7 Å²	155.7	71%	0.712	78%	0.782	S	S	*	*				102.2	147.8	82.7	-125.5	77.6	0	0	0	110.6
1286	L	25.2	Very low	27	Very low	132 Å²	132	154.6 Å²	154.6	69%	0.691	78%	0.782	S	S	*	*			cis	-152.3	-177.2	5.9	-172.2	58.9	0	0	0	109.3
1287	L	27.7	Very low	27.2	Very low	145 Å²	145	156 Å²	156	76%	0.759	79%	0.786	S	S	*	*			trans	90.3	66.7	159.7	-65.8	166.2	0	0	0	119.1
1288	Q	24.6	Very low	27.4	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	79%	0.788	S	S	*	*			trans	3.1	121.5	131.1	-63.1	165.1	-49.6	0	0	118.2
1289	S	25.8	Very low	27.5	Very low	105 Å²	105	155.1 Å²	155.1	73%	0.734	79%	0.79	S	S	*	*				-174.5	161.4	117.8	54.3	0	0	0	0	112.1
1290	K	27.1	Very low	27.7	Very low	163 Å²	163	152.8 Å²	152.8	71%	0.709	78%	0.782	S	S	*	*			trans	62.7	75.7	168.9	-60.5	-178.2	178.7	178.1	0	118.4
1291	Y	26.3	Very low	27.6	Very low	238 Å²	238	152.3 Å²	152.3	93%	0.933	78%	0.778	S	S	*	*			trans	-136.9	115.5	145.4	-85.1	-82.2	0	0	0	109.7
1292	K	25.1	Very low	27.5	Very low	203 Å²	203	156.1 Å²	156.1	88%	0.883	78%	0.78	S	S	*	*			trans	-157.7	60.3	172.5	-161.6	-178.4	177.9	179.1	0	113.4
1293	K	25.4	Very low	27.3	Very low	168 Å²	168	159.8 Å²	159.8	73%	0.73	79%	0.785	S	S	*	*			trans	-171.9	103.4	150.9	-111.2	-178.4	178.5	-174.9	0	108.1
1294	L	27.5	Very low	27.2	Very low	165 Å²	165	156.5 Å²	156.5	86%	0.864	79%	0.787	S	S	*	*			trans	-130.8	131.2	160.2	-145.6	75.6	0	0	0	105.7
1295	S	29.6	Very low	27.2	Very low	114 Å²	114	153.4 Å²	153.4	80%	0.797	78%	0.782	S	S	*	*			trans	-73.6	127.8	-175.3	46	0	0	0	0	111	F1297	S1295-F1297 PolarHBondContact O-N 3.33Å
1296	T	26.5	Very low	27.4	Very low	130 Å²	130	154.1 Å²	154.1	80%	0.798	79%	0.786	S	S	*	*			trans	-82.3	98.8	-176.1	51.1	0	0	0	0	112.4
1297	F	27	Very low	27.8	Very low	183 Å²	183	156.9 Å²	156.9	80%	0.803	79%	0.789	S	S	*	*			trans	-146.7	157.5	154.9	-82.7	-72.4	0	0	0	108.7	S1295	S1295-F1297 PolarHBondContact O-N 3.33Å
1298	D	30.1	Very low	28	Very low	157 Å²	157	158.6 Å²	158.6	84%	0.84	79%	0.793	S	S	*	*			trans	82.9	47.7	179.9	-58.4	-3.1	0	0	0	118.9
1299	D	27.8	Very low	28.5	Very low	164 Å²	164	154.1 Å²	154.1	88%	0.877	77%	0.774	S	S	*	*			trans	-100.4	84.5	158.4	-90.9	-45.1	0	0	0	111.3
1300	T	30.4	Very low	29	Very low	101 Å²	101	155.2 Å²	155.2	62%	0.62	78%	0.779	S	S	*	*			trans	-129.2	104.3	168.6	59.4	0	0	0	0	111.9	Y1302	T1300-Y1302 HydrophobicContact CG2-CE2 4.39Å
1301	I	26	Very low	29.5	Very low	143 Å²	143	154.2 Å²	154.2	73%	0.733	78%	0.781	S	S	*	*			trans	-87.1	118.6	177.2	-58.1	172.3	0	0	0	109.2	F1303	I1301-F1303 HydrophobicContact CG2-CE2 4.3Å; I1301-F1303 HydrophobicContact CG2-CZ 4.46Å
1302	Y	29.9	Very low	29.7	Very low	201 Å²	201	147.6 Å²	147.6	79%	0.788	77%	0.769	S	S	*	*			trans	-120.4	133.9	175.8	-71.5	-70	0	0	0	112.1	T1300	T1300-Y1302 HydrophobicContact CG2-CE2 4.39Å
1303	F	24.9	Very low	29.9	Very low	188 Å²	188	145.6 Å²	145.6	83%	0.825	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-94.1	120.4	178	-64.6	-90.3	0	0	0	110.7	I1301	I1301-F1303 HydrophobicContact CG2-CE2 4.3Å; I1301-F1303 HydrophobicContact CG2-CZ 4.46Å
1304	G	30.3	Very low	30.2	Very low	82 Å²	82	145.7 Å²	145.7	85%	0.845	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-91.9	119.3	171.9	0	0	0	0	0	111.8
1305	I	29.4	Very low	30.3	Very low	125 Å²	125	145.1 Å²	145.1	64%	0.641	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-95.6	120.4	173.9	-59.8	177.1	0	0	0	109	Y1307	I1305-Y1307 HydrophobicContact CB-CE2 4Å; I1305-Y1307 HydrophobicContact CG2-CD2 4.07Å; I1305-Y1307 HydrophobicContact CG2-CE2 3.63Å; I1305-Y1307 WeakPolarHBondContact O-CD2 3.42Å
1306	N	30.2	Very low	30.3	Very low	151 Å²	151	145.3 Å²	145.3	81%	0.807	77%	0.773	S	S	*	*			trans	-82.5	114.3	177.7	-110.5	-2.9	0	0	0	111
1307	Y	32.9	Very low	30.5	Very low	190 Å²	190	145.7 Å²	145.7	75%	0.745	78%	0.775	S	S	*	*			trans	-96.2	104.4	176.2	-75.7	-91	0	0	0	111.4	I1305	I1305-Y1307 HydrophobicContact CB-CE2 4Å; I1305-Y1307 HydrophobicContact CG2-CD2 4.07Å; I1305-Y1307 HydrophobicContact CG2-CE2 3.63Å; I1305-Y1307 WeakPolarHBondContact O-CD2 3.42Å
1308	H	32.3	Very low	30.6	Very low	182 Å²	182	144.3 Å²	144.3	84%	0.843	77%	0.774	S	S	*	*			trans	-120.7	45.1	174.7	-96.7	-51.1	0	0	0	112.6
1309	N	33.4	Very low	30.6	Very low	83 Å²	83	144.4 Å²	144.4	44%	0.444	78%	0.775	S	S	.	*			trans	-157.7	120	163.8	-162.4	-25.4	0	0	0	111.3	N1311	N1309-N1311 PolarHBondContact O-N 2.88Å; N1309-N1311 PolarHBondContact OD1-N 3.07Å; N1309-N1311 VanDerWaalsContact OD1-N 3.12Å
1310	P	37.5	Very low	30.5	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-8.9	178.8	29.5	-35.4	0	0	0	114.5
1311	N	36.4	Very low	30.5	Very low	143 Å²	143	144.6 Å²	144.6	77%	0.765	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	15.6	-170.7	-69	-23	0	0	0	115.3	N1309	N1309-N1311 PolarHBondContact O-N 2.88Å; N1309-N1311 PolarHBondContact OD1-N 3.07Å; N1309-N1311 VanDerWaalsContact OD1-N 3.12Å
1312	C	30.3	Very low	30.5	Very low	99 Å²	99	146.5 Å²	146.5	67%	0.669	78%	0.781	S	S	*	*			trans	-109	109.8	178.8	-77.3	0	0	0	0	112.6
1313	I	31.2	Very low	30.5	Very low	161 Å²	161	145 Å²	145	83%	0.826	78%	0.783	S	S	*	*			trans	-102	132.2	170.7	-56.6	173.3	0	0	0	108.7
1314	L	31.8	Very low	30.7	Very low	170 Å²	170	143.1 Å²	143.1	89%	0.89	78%	0.782	S	S	*	*			trans	-143.2	126.2	174.2	-107.7	162.5	0	0	0	110
1315	N	27.9	Very low	30.9	Very low	152 Å²	152	145.7 Å²	145.7	81%	0.813	78%	0.781	S	S	*	*			trans	-72.5	139.7	-178.6	-76.4	-16.2	0	0	0	111.7
1316	S	30.5	Very low	30.9	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	79%	0.792	S	S	*	*			trans	-90.7	106.9	172.5	57.4	0	0	0	0	111.6
1317	T	30.4	Very low	31	Very low	138 Å²	138	143.5 Å²	143.5	85%	0.847	79%	0.787	S	S	*	*			trans	-103.5	131.9	155.6	46.2	0	0	0	0	109
1318	I	28.6	Very low	30.7	Very low	153 Å²	153	140 Å²	140	79%	0.785	79%	0.791	S	S	*	*			trans	-69.6	142.6	-178.1	-62.6	157.3	0	0	0	109.8
1319	D	30.2	Very low	30.6	Very low	159 Å²	159	144.2 Å²	144.2	85%	0.85	81%	0.81	S	S	*	*			trans	-152.6	147.5	141	-116.6	-31.9	0	0	0	112.3
1320	T	26.4	Very low	30.4	Very low	119 Å²	119	147.3 Å²	147.3	73%	0.73	83%	0.829	S	S	*	*			trans	-99.1	135.8	-173.8	52.1	0	0	0	0	112.2
1321	I	29.2	Very low	30.1	Very low	150 Å²	150	148.3 Å²	148.3	77%	0.769	83%	0.829	S	S	*	*			trans	-116.5	108.9	171.2	-59.4	-179.6	0	0	0	109.7	M1323	I1321-M1323 HydrophobicContact CG2-CE 4.3Å; I1321-M1323 HydrophobicContact CG2-CG 4.27Å
1322	Q	26	Very low	29.7	Very low	184 Å²	184	148.6 Å²	148.6	86%	0.86	83%	0.832	S	S	*	*			trans	-76.5	146	161.4	-62.5	177.3	-66.6	0	0	109.4
1323	M	31.8	Very low	29.7	Very low	168 Å²	168	151.5 Å²	151.5	83%	0.828	84%	0.842	S	S	*	*			trans	-127.6	116.3	161.3	-73.6	-162.4	172.1	0	0	110.6	I1321	I1321-M1323 HydrophobicContact CG2-CE 4.3Å; I1321-M1323 HydrophobicContact CG2-CG 4.27Å
1324	N	27.3	Very low	29.6	Very low	150 Å²	150	150.9 Å²	150.9	80%	0.802	84%	0.843	S	S	*	*			trans	-73.6	135.3	168.2	-84.5	-35.9	0	0	0	109.9
1325	T	35.3	Very low	29.4	Very low	136 Å²	136	149.6 Å²	149.6	83%	0.834	84%	0.84	S	S	*	*			trans	-129.6	79.1	164.1	47.1	0	0	0	0	110.3
1326	N	28.5	Very low	29.5	Very low	161 Å²	161	149.4 Å²	149.4	86%	0.861	84%	0.842	S	S	*	*			trans	-74.6	138.4	159.7	-78.6	-23.4	0	0	0	109.2
1327	G	32.4	Very low	29.5	Very low	68 Å²	68	151.8 Å²	151.8	70%	0.701	84%	0.842	S	S	*	*			trans	124	92.1	158.5	0	0	0	0	0	116.8
1328	S	28.2	Very low	29.4	Very low	118 Å²	118	152.9 Å²	152.9	83%	0.825	84%	0.842	S	S	*	*			trans	41.4	104.6	145	61.3	0	0	0	0	119.9
1329	Q	28.8	Very low	29.4	Very low	269 Å²	269	152.9 Å²	152.9	100%	1.257	85%	0.847	S	S	*	*				-153.7	0	93.4	-111.9	-177	-7.3	0	0	111.8

Retrieved 1,329 of 1,329 residues in 2076.2 ms (Link to these results)

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