A0A087WX60_HUMAN Loading...

Myopalladin

AlphaFold DB , UniProt , Accession A0A087WX60, Species HUMAN (Homo sapiens, Human), Gene MYPN, Length 1,026 aa.

						>A0A087WX60_HUMAN|A0A087WX60|MYPN
MFPLSFWWYCEGKELENSPDIHIVQAGNLHSLTIAEAFEEDTGRYSCFASNIYGTDSTSAEIYIEGVSSSDSEGDPNKEEMNRIQKPNEVSSPPTTSAVIPPAVPQAQHLVAQPRVATIQQCQSPTNYLQGLDGKPIIAAPVFTKMLQNLSASEGQLVVFECRVKGAPSPKVEWYREGTLIEDSPDFRILQKKPRSMAEPEEICTLVIAEVFAEDSGCFTCTASNKYGTVSSIAQLHVRGNEDLSNNGSLHSANSTTNLAAIEPQPSPPHSEPPSVEQPPKPKLEGVLVNHNEPRSSSRIGLRVHFNLPEDDKGSEASSEAGVVTTRQTRPDSFQERFNGQATKTPEPSSPVKEPPPVLAKPKLDSTQLQQLHNQVLLEQHQLQNPPPSSPKEFPFSMTVLNSNAPPAVTTSSKQVKAPSSQTFSLARPKYFFPSTNTTAATVAPSSSPVFTLSSTPQTIQRTVSKESLLVSHPSVQTKSPGGLSIQNEPLPPGPTEPTPPPFTFSIPSGNQFQPRCVSPIPVSPTSRIQNPVAFLSSVLPSLPAIPPTNAMGLPRSAPSMPSQGLAKKNTKSPQPVNDDNIRETKNAVIRDLGKKITFSDVRPNQQEYKISSFEQRLMNEIEFRLERTPVDESDDEIQHDEIPTGKCIAPIFDKRLKHFRVTEGSPVTFTCKIVGIPVPKVYWFKDGKQISKRNEHCKMRREGDGTCSLHIESTTSDDDGNYTIMAANPQGRISCSGHLMVQSLPIRSRLTSAGQSHRGRSRVQERDKEPLQERFFRPHFLQAPGDMVAHEGRLCRLDCKVSGLPPPELTWLLNGQPVLPDASHKMLVRETGVHSLLIDPLTQRDAGTYKCIATNKTGQNSFSLELSVVAKEVKKAPVILEKLQNCGVPEGHPVRLECRVIGMPPPVFYWKKDNETIPCTRERISMHQDTTGYACLLIQPAKKSDAGWYTLSAKNEAGIVSCTARLDIYAQWHHQIPPPMSVRPSGSRYGSLTSKGLDIFSAFSSMESTMVYSCSSRSVVESDEL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.7	Very low	65.6	Low	222 Å²	222	90.5 Å²	90.5	100%	1.094	45%	0.446	S	S	*	.				0	122.4	0	-176.1	173.5	-80.8	0	0	105.7
2	F	42.5	Very low	65.4	Low	115 Å²	115	88.4 Å²	88.4	50%	0.504	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-78.6	144.5	179.1	-63	-85.6	0	0	0	109	I52 Y53	F2-I52 HydrophobicContact CD1-CD1 3.66Å; F2-I52 HydrophobicContact CD1-CG1 4.47Å; F2-I52 HydrophobicContact CD2-CD1 4.02Å; F2-I52 HydrophobicContact CE1-CD1 3.67Å; F2-I52 HydrophobicContact CE2-CD1 4.03Å; F2-I52 HydrophobicContact CG-CD1 3.84Å; F2-I52 HydrophobicContact CG-CG1 4.29Å; F2-I52 HydrophobicContact CZ-CD1 3.86Å; F2-Y53 AromaticContact CD2-CE2 3.72Å; F2-Y53 HydrophobicContact CD2-CE2 3.72Å; F2-Y53 AromaticContact CE2-CE2 3.94Å; F2-Y53 HydrophobicContact CE2-CE2 3.94Å; F2-Y53 WeakPolarHBondContact CE2-OH 3.25Å
3	P	54.3	Low	65.7	Low	108 Å²	108	94.2 Å²	94.2	70%	0.701	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-64.4	143.6	176.8	28	-34	0	0	0	110.4
4	L	59.2	Low	66.6	Low	80 Å²	80	94.9 Å²	94.9	42%	0.419	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-95.7	129.2	164.8	-82.3	150	0	0	0	107.7	F6 S50 N51	L4-F6 HydrophobicContact CB-CD2 4.16Å; L4-F6 HydrophobicContact CB-CE2 3.46Å; L4-F6 VanDerWaalsContact CB-CE2 3.46Å; L4-F6 HydrophobicContact CB-CZ 4.07Å; L4-F6 HydrophobicContact CD1-CZ 4.46Å; L4-F6 HydrophobicContact CG-CE2 4.5Å; L4-S50 WeakPolarHBondContact CA-O 3.39Å; L4-N51 HydrophobicContact CD2-CB 4.07Å; L4-N51 VanDerWaalsContact CD2-ND2 3.27Å; L4-N51 WeakPolarHBondContact CD2-ND2 3.22Å; L4-N51 HydrophobicContact CG-CB 4.38Å
5	S	63.9	Low	67.3	Low	59 Å²	59	90.7 Å²	90.7	41%	0.413	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	143.4	168.7	-63.6	0	0	0	0	109.3	A49 S50	S5-A49 CarbonylContact O-C 3.49Å; S5-A49 WeakPolarHBondContact O-CA 3.49Å; S5-S50 PolarHBondContact N-O 3.14Å; S5-S50 PolarHBondContact O-N 2.96Å
6	F	75.4	Confident	67.4	Low	58 Å²	58	95.1 Å²	95.1	25%	0.254	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	142.2	-178	-68.3	-101.8	0	0	0	111.2	L4 H30 F48 A49	L4-F6 HydrophobicContact CB-CD2 4.16Å; L4-F6 HydrophobicContact CB-CE2 3.46Å; L4-F6 VanDerWaalsContact CB-CE2 3.46Å; L4-F6 HydrophobicContact CB-CZ 4.07Å; L4-F6 HydrophobicContact CD1-CZ 4.46Å; L4-F6 HydrophobicContact CG-CE2 4.5Å; F6-H30 AromaticContact CD2-CD2 3.6Å; F6-H30 AromaticContact CD2-CE1 3.42Å; F6-H30 VanDerWaalsContact CD2-CE1 3.42Å; F6-H30 WeakPolarHBondContact CD2-CE1 3.45Å; F6-H30 AromaticContact CD2-NE2 3.1Å; F6-H30 WeakPolarHBondContact CD2-NE2 3.42Å; F6-H30 AromaticContact CE2-CD2 3.65Å; F6-H30 AromaticContact CE2-NE2 3.4Å; F6-H30 WeakPolarHBondContact CE2-NE2 3.37Å; F6-H30 AromaticContact CG-CD2 3.77Å; F6-H30 AromaticContact CG-CE1 3.59Å; F6-H30 AromaticContact CG-CG 3.89Å; F6-H30 AromaticContact CG-ND1 3.79Å; F6-H30 AromaticContact CG-NE2 3.61Å; F6-H30 AromaticContact CZ-CD2 3.9Å; F6-F48 VanDerWaalsContact CA-O 3.23Å; F6-F48 WeakPolarHBondContact CA-O 3.07Å; F6-A49 HydrophobicContact CD1-CB 3.59Å; F6-A49 HydrophobicContact CE1-CB 3.39Å; F6-A49 HydrophobicContact CG-CB 4.4Å; F6-A49 HydrophobicContact CZ-CB 4.06Å
7	W	74.7	Confident	67.6	Low	102 Å²	102	96 Å²	96	39%	0.386	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146.6	178.5	-56.6	-92.1	0	0	0	110.2	Y9 E14 C47 F48	W7-Y9 HydrophobicContact CB-CE2 3.72Å; W7-E14 VanDerWaalsContact CD1-OE1 3.24Å; W7-C47 WeakPolarHBondContact O-CA 3.47Å; W7-F48 PolarHBondContact N-O 2.63Å; W7-F48 PolarHBondContact O-N 3.24Å
8	W	77.9	Confident	67.6	Low	45 Å²	45	93.2 Å²	93.2	17%	0.17	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	147.2	177.9	-70.8	81.9	0	0	0	110.5	E14 L15 I23 H30 L32 S46 C47	W8-E14 CarbonylContact O-C 3.6Å; W8-E14 WeakPolarHBondContact O-CA 3.47Å; W8-L15 HydrophobicContact CB-CB 4.27Å; W8-L15 PolarHBondContact O-N 3.33Å; W8-I23 HydrophobicContact CB-CD1 3.97Å; W8-I23 HydrophobicContact CG-CD1 4.24Å; W8-I23 HydrophobicContact CG-CG2 4.46Å; W8-H30 HydrophobicContact CZ2-CB 4.48Å; W8-L32 HydrophobicContact CB-CD1 4Å; W8-L32 HydrophobicContact CD2-CB 3.84Å; W8-L32 HydrophobicContact CD2-CD1 3.95Å; W8-L32 HydrophobicContact CE3-CB 3.72Å; W8-L32 HydrophobicContact CE3-CD1 3.75Å; W8-L32 HydrophobicContact CE3-CG 4.36Å; W8-L32 HydrophobicContact CG-CD1 4.08Å; W8-L32 HydrophobicContact CH2-CB 4.01Å; W8-L32 HydrophobicContact CZ2-CB 4.12Å; W8-L32 HydrophobicContact CZ3-CB 3.8Å; W8-S46 CarbonylContact C-O 3.52Å; W8-S46 VanDerWaalsContact CA-O 3.3Å; W8-S46 WeakPolarHBondContact CA-O 3.46Å; W8-C47 HydrophobicContact CD2-CB 3.83Å; W8-C47 VanDerWaalsContact CE2-SG 3.52Å; W8-C47 HydrophobicContact CE3-CB 3.76Å; W8-C47 HydrophobicContact CH2-CB 3.87Å; W8-C47 HydrophobicContact CZ2-CB 3.93Å; W8-C47 HydrophobicContact CZ3-CB 3.78Å
9	Y	70	Confident	67.1	Low	53 Å²	53	93.5 Å²	93.5	21%	0.208	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	152.2	-180	-62.9	-100.5	0	0	0	110.5	W7 K13 E14 Y45 S46 F48	W7-Y9 HydrophobicContact CB-CE2 3.72Å; Y9-K13 CarbonylContact C-O 3.52Å; Y9-K13 WeakPolarHBondContact CA-O 3.45Å; Y9-K13 WeakPolarHBondContact CB-O 3.15Å; Y9-K13 VanDerWaalsContact CD1-C 3.46Å; Y9-E14 VanDerWaalsContact CD1-CA 3.42Å; Y9-E14 HydrophobicContact CD1-CB 3.85Å; Y9-E14 HydrophobicContact CD1-CG 4.23Å; Y9-E14 VanDerWaalsContact CD1-N 3.33Å; Y9-E14 HydrophobicContact CE1-CB 3.47Å; Y9-E14 VanDerWaalsContact CE1-CB 3.47Å; Y9-E14 HydrophobicContact CE1-CG 3.66Å; Y9-E14 HydrophobicContact CE2-CG 4.33Å; Y9-E14 VanDerWaalsContact OH-CD 3.24Å; Y9-E14 PolarHBondContact OH-OE2 3.18Å; Y9-Y45 CarbonylContact O-C 3.54Å; Y9-Y45 VanDerWaalsContact O-CA 3.25Å; Y9-Y45 WeakPolarHBondContact O-CA 3.48Å; Y9-S46 PolarHBondContact N-O 3.36Å; Y9-S46 PolarHBondContact O-N 3.32Å; Y9-F48 AromaticContact CD2-CD2 3.65Å; Y9-F48 HydrophobicContact CD2-CD2 3.65Å; Y9-F48 AromaticContact CD2-CE2 3.92Å; Y9-F48 HydrophobicContact CD2-CE2 3.92Å; Y9-F48 AromaticContact CE2-CD2 3.81Å; Y9-F48 HydrophobicContact CE2-CD2 3.81Å; Y9-F48 HydrophobicContact CE2-CE2 4.31Å
10	C	82	Confident	66.4	Low	19 Å²	19	93 Å²	93	13%	0.128	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.4	159.9	-179.4	0	0	0	0	108.8	G12 K13 L15 R44 Y45	C10-G12 PolarHBondContact O-N 3.24Å; C10-K13 PolarHBondContact N-O 3.23Å; C10-K13 PolarHBondContact O-N 3.01Å; C10-L15 HydrophobicContact CB-CD1 3.91Å; C10-L15 HydrophobicContact CB-CD2 4.07Å; C10-L15 HydrophobicContact CB-CG 4.29Å; C10-R44 WeakPolarHBondContact CA-O 3.49Å; C10-Y45 HydrophobicContact CB-CD1 3.87Å; C10-Y45 HydrophobicContact CB-CD2 4.45Å; C10-Y45 HydrophobicContact CB-CE1 3.66Å; C10-Y45 HydrophobicContact CB-CE2 4.24Å; C10-Y45 HydrophobicContact CB-CG 4.26Å; C10-Y45 WeakPolarHBondContact SG-CE2 3.42Å; C10-Y45 VanDerWaalsContact SG-CZ 3.51Å
11	E	73.8	Confident	66.4	Low	134 Å²	134	89.5 Å²	89.5	63%	0.626	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	33.9	-177.9	-68.3	-57.4	122.7	0	0	113.4	K13 G43 R44	E11-K13 VanDerWaalsContact C-N 3.29Å; E11-K13 PolarHBondContact O-N 3.17Å; E11-G43 WeakPolarHBondContact OE1-CA 3.31Å; E11-R44 PolarHBondContact N-O 3.14Å; E11-R44 VanDerWaalsContact N-O 3.15Å; E11-R44 WeakPolarHBondContact OE1-CB 3.43Å; E11-R44 PolarHBondContact OE1-N 3.44Å
12	G	63.5	Low	67.1	Low	66 Å²	66	83 Å²	83	68%	0.68	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	-0.5	-178	0	0	0	0	0	116.3	C10	C10-G12 PolarHBondContact O-N 3.24Å
13	K	68.8	Low	68.6	Low	164 Å²	164	79 Å²	79	71%	0.713	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.8	168.1	-69	177.8	-178.7	169.4	0	110.6	Y9 C10 E11	Y9-K13 CarbonylContact C-O 3.52Å; Y9-K13 WeakPolarHBondContact CA-O 3.45Å; Y9-K13 WeakPolarHBondContact CB-O 3.15Å; Y9-K13 VanDerWaalsContact CD1-C 3.46Å; C10-K13 PolarHBondContact N-O 3.23Å; C10-K13 PolarHBondContact O-N 3.01Å; E11-K13 VanDerWaalsContact C-N 3.29Å; E11-K13 PolarHBondContact O-N 3.17Å
14	E	78.8	Confident	69	Low	104 Å²	104	77.4 Å²	77.4	49%	0.486	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	143.2	176.6	-156.1	162.9	147.1	0	0	111.1	W7 W8 Y9	W7-E14 VanDerWaalsContact CD1-OE1 3.24Å; W8-E14 CarbonylContact O-C 3.6Å; W8-E14 WeakPolarHBondContact O-CA 3.47Å; Y9-E14 VanDerWaalsContact CD1-CA 3.42Å; Y9-E14 HydrophobicContact CD1-CB 3.85Å; Y9-E14 HydrophobicContact CD1-CG 4.23Å; Y9-E14 VanDerWaalsContact CD1-N 3.33Å; Y9-E14 HydrophobicContact CE1-CB 3.47Å; Y9-E14 VanDerWaalsContact CE1-CB 3.47Å; Y9-E14 HydrophobicContact CE1-CG 3.66Å; Y9-E14 HydrophobicContact CE2-CG 4.33Å; Y9-E14 VanDerWaalsContact OH-CD 3.24Å; Y9-E14 PolarHBondContact OH-OE2 3.18Å
15	L	76.5	Confident	68.7	Low	31 Å²	31	79.7 Å²	79.7	16%	0.162	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.5	-177.1	-61.2	176.8	0	0	0	110.5	W8 C10 I21 I23 L32 Y45	W8-L15 HydrophobicContact CB-CB 4.27Å; W8-L15 PolarHBondContact O-N 3.33Å; C10-L15 HydrophobicContact CB-CD1 3.91Å; C10-L15 HydrophobicContact CB-CD2 4.07Å; C10-L15 HydrophobicContact CB-CG 4.29Å; L15-I21 HydrophobicContact CD2-CD1 4.13Å; L15-I23 HydrophobicContact CB-CD1 4.03Å; L15-I23 WeakPolarHBondContact O-CD1 3.14Å; L15-L32 HydrophobicContact CD1-CD1 3.59Å; L15-Y45 HydrophobicContact CD1-CD1 3.68Å; L15-Y45 HydrophobicContact CD1-CE1 3.73Å
16	E	70.1	Confident	68	Low	162 Å²	162	79.9 Å²	79.9	76%	0.757	42%	0.419	S	S	*	.			trans	-109.7	173.3	171.8	-62.2	-169.7	163.4	0	0	110.7	S18	E16-S18 PolarHBondContact O-N 3.04Å
17	N	69.5	Low	67.3	Low	110 Å²	110	79.7 Å²	79.7	59%	0.588	43%	0.434	S	S	*	.			trans	-69.9	118.7	176.1	-91.6	-43.1	0	0	0	111.5	H22 I23	N17-H22 WeakPolarHBondContact OD1-CA 3.29Å; N17-I23 PolarHBondContact ND2-O 3.05Å; N17-I23 PolarHBondContact OD1-N 3.49Å; N17-I23 PolarHBondContact OD1-O 3.45Å
18	S	67.4	Low	66.3	Low	45 Å²	45	81.7 Å²	81.7	32%	0.315	45%	0.452	S	S	.	.			trans	-120.2	178.3	172.6	81.9	0	0	0	0	110.6	E16 D20 I21 H22	E16-S18 PolarHBondContact O-N 3.04Å; S18-D20 PolarHBondContact O-N 3.3Å; S18-D20 PolarHBondContact OG-N 2.95Å; S18-I21 PolarHBondContact N-O 3.49Å; S18-I21 VanDerWaalsContact O-O 3.11Å; S18-I21 PolarHBondContact OG-N 3.5Å; S18-H22 PolarHBondContact O-CE1 3.07Å; S18-H22 PolarHBondContact O-ND1 3.36Å
19	P	58.4	Low	64.9	Low	99 Å²	99	85 Å²	85	64%	0.643	47%	0.472	S	S	*	.	S	Bend	trans	-59.6	-32.5	170.5	-22.6	35.4	0	0	0	112.8	H22	P19-H22 PolarHBondContact O-CE1 3.12Å
20	D	53.6	Low	64.2	Low	83 Å²	83	83.9 Å²	83.9	44%	0.444	47%	0.469	S	S	.	.	S	Bend	trans	-100.5	-25.9	-170.5	-39.6	-73.2	0	0	0	111.9	S18 I34 A35	S18-D20 PolarHBondContact O-N 3.3Å; S18-D20 PolarHBondContact OG-N 2.95Å; D20-I34 CarbonylContact O-C 3.5Å; D20-I34 VanDerWaalsContact O-CA 3.29Å; D20-I34 WeakPolarHBondContact O-CA 3.39Å; D20-A35 PolarHBondContact O-N 3.1Å
21	I	67	Low	63.3	Low	21 Å²	21	85.1 Å²	85.1	11%	0.108	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	112.1	177.3	-59.9	-178.4	0	0	0	109.7	L15 S18 I23 L32	L15-I21 HydrophobicContact CD2-CD1 4.13Å; S18-I21 PolarHBondContact N-O 3.49Å; S18-I21 VanDerWaalsContact O-O 3.11Å; S18-I21 PolarHBondContact OG-N 3.5Å; I21-I23 HydrophobicContact CG2-CG1 4.24Å; I21-L32 HydrophobicContact CG2-CD1 3.91Å; I21-L32 HydrophobicContact CG2-CD2 4.22Å; I21-L32 HydrophobicContact CG2-CG 3.93Å
22	H	62.8	Low	63.1	Low	86 Å²	86	80.2 Å²	80.2	40%	0.398	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	104	-178.6	-70.4	-4.4	0	0	0	111.6	N17 S18 P19 L32 T33	N17-H22 WeakPolarHBondContact OD1-CA 3.29Å; S18-H22 PolarHBondContact O-CE1 3.07Å; S18-H22 PolarHBondContact O-ND1 3.36Å; P19-H22 PolarHBondContact O-CE1 3.12Å; H22-L32 CarbonylContact O-C 3.59Å; H22-L32 WeakPolarHBondContact O-CA 3.3Å; H22-T33 PolarHBondContact N-O 3.2Å; H22-T33 PolarHBondContact O-N 3.4Å
23	I	72.1	Confident	63.4	Low	29 Å²	29	80.8 Å²	80.8	15%	0.149	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.3	173.9	-56.1	169.2	0	0	0	109.2	W8 L15 N17 I21 S31 L32	W8-I23 HydrophobicContact CB-CD1 3.97Å; W8-I23 HydrophobicContact CG-CD1 4.24Å; W8-I23 HydrophobicContact CG-CG2 4.46Å; L15-I23 HydrophobicContact CB-CD1 4.03Å; L15-I23 WeakPolarHBondContact O-CD1 3.14Å; N17-I23 PolarHBondContact ND2-O 3.05Å; N17-I23 PolarHBondContact OD1-N 3.49Å; N17-I23 PolarHBondContact OD1-O 3.45Å; I21-I23 HydrophobicContact CG2-CG1 4.24Å; I23-S31 WeakPolarHBondContact CA-O 3.38Å; I23-L32 HydrophobicContact CD1-CD1 4.15Å; I23-L32 HydrophobicContact CG1-CB 4.24Å; I23-L32 HydrophobicContact CG1-CD1 3.88Å; I23-L32 HydrophobicContact CG1-CG 3.97Å
24	V	62.9	Low	63.7	Low	76 Å²	76	74.5 Å²	74.5	46%	0.461	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.8	-178.3	-178.1	0	0	0	0	110.7	H30 S31	V24-H30 WeakPolarHBondContact O-CA 3.36Å; V24-S31 PolarHBondContact N-O 3.26Å; V24-S31 PolarHBondContact O-N 3.35Å
25	Q	54.2	Low	62.7	Low	127 Å²	127	72.4 Å²	72.4	59%	0.593	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.5	169.7	175.6	170.4	26.4	0	0	110.2	H30	Q25-H30 VanDerWaalsContact CD-NE2 3.3Å; Q25-H30 WeakPolarHBondContact CG-CE1 3.49Å; Q25-H30 VanDerWaalsContact CG-NE2 3.35Å; Q25-H30 WeakPolarHBondContact CG-NE2 3.5Å; Q25-H30 PolarHBondContact NE2-CE1 3.43Å; Q25-H30 VanDerWaalsContact NE2-CE1 3.31Å; Q25-H30 PolarHBondContact NE2-NE2 3.39Å
26	A	48.8	Very low	61.9	Low	63 Å²	63	77.4 Å²	77.4	52%	0.521	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	80.3	178.5	0	0	0	0	0	110.5	N28 L29	A26-N28 PolarHBondContact O-N 3.2Å; A26-L29 PolarHBondContact N-O 3.18Å; A26-L29 PolarHBondContact O-N 3.39Å
27	G	59.8	Low	61.3	Low	55 Å²	55	72.6 Å²	72.6	57%	0.567	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	-114.1	-173.9	0	0	0	0	0	110.9
28	N	53.6	Low	61.3	Low	144 Å²	144	72.5 Å²	72.5	77%	0.77	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-3.1	178.1	-65.8	18.8	0	0	0	113.3	A26	A26-N28 PolarHBondContact O-N 3.2Å
29	L	48.7	Very low	61.1	Low	113 Å²	113	76.9 Å²	76.9	59%	0.592	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.7	177.4	-177.9	62.4	0	0	0	109.7	A26	A26-L29 PolarHBondContact N-O 3.18Å; A26-L29 PolarHBondContact O-N 3.39Å
30	H	56.2	Low	61.5	Low	30 Å²	30	80.9 Å²	80.9	14%	0.139	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.2	168	-74.4	-110.6	0	0	0	108.7	F6 W8 V24 Q25	F6-H30 AromaticContact CD2-CD2 3.6Å; F6-H30 AromaticContact CD2-CE1 3.42Å; F6-H30 VanDerWaalsContact CD2-CE1 3.42Å; F6-H30 WeakPolarHBondContact CD2-CE1 3.45Å; F6-H30 AromaticContact CD2-NE2 3.1Å; F6-H30 WeakPolarHBondContact CD2-NE2 3.42Å; F6-H30 AromaticContact CE2-CD2 3.65Å; F6-H30 AromaticContact CE2-NE2 3.4Å; F6-H30 WeakPolarHBondContact CE2-NE2 3.37Å; F6-H30 AromaticContact CG-CD2 3.77Å; F6-H30 AromaticContact CG-CE1 3.59Å; F6-H30 AromaticContact CG-CG 3.89Å; F6-H30 AromaticContact CG-ND1 3.79Å; F6-H30 AromaticContact CG-NE2 3.61Å; F6-H30 AromaticContact CZ-CD2 3.9Å; W8-H30 HydrophobicContact CZ2-CB 4.48Å; V24-H30 WeakPolarHBondContact O-CA 3.36Å; Q25-H30 VanDerWaalsContact CD-NE2 3.3Å; Q25-H30 WeakPolarHBondContact CG-CE1 3.49Å; Q25-H30 VanDerWaalsContact CG-NE2 3.35Å; Q25-H30 WeakPolarHBondContact CG-NE2 3.5Å; Q25-H30 PolarHBondContact NE2-CE1 3.43Å; Q25-H30 VanDerWaalsContact NE2-CE1 3.31Å; Q25-H30 PolarHBondContact NE2-NE2 3.39Å
31	S	63.1	Low	62.6	Low	46 Å²	46	78 Å²	78	32%	0.322	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	125.4	179.6	54.8	0	0	0	0	110.6	I23 V24	I23-S31 WeakPolarHBondContact CA-O 3.38Å; V24-S31 PolarHBondContact N-O 3.26Å; V24-S31 PolarHBondContact O-N 3.35Å
32	L	68.6	Low	63	Low	31 Å²	31	79.2 Å²	79.2	16%	0.162	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	137.5	164.7	-175	153.1	0	0	0	108.6	W8 L15 I21 H22 I23 I34 Y45	W8-L32 HydrophobicContact CB-CD1 4Å; W8-L32 HydrophobicContact CD2-CB 3.84Å; W8-L32 HydrophobicContact CD2-CD1 3.95Å; W8-L32 HydrophobicContact CE3-CB 3.72Å; W8-L32 HydrophobicContact CE3-CD1 3.75Å; W8-L32 HydrophobicContact CE3-CG 4.36Å; W8-L32 HydrophobicContact CG-CD1 4.08Å; W8-L32 HydrophobicContact CH2-CB 4.01Å; W8-L32 HydrophobicContact CZ2-CB 4.12Å; W8-L32 HydrophobicContact CZ3-CB 3.8Å; L15-L32 HydrophobicContact CD1-CD1 3.59Å; I21-L32 HydrophobicContact CG2-CD1 3.91Å; I21-L32 HydrophobicContact CG2-CD2 4.22Å; I21-L32 HydrophobicContact CG2-CG 3.93Å; H22-L32 CarbonylContact O-C 3.59Å; H22-L32 WeakPolarHBondContact O-CA 3.3Å; I23-L32 HydrophobicContact CD1-CD1 4.15Å; I23-L32 HydrophobicContact CG1-CB 4.24Å; I23-L32 HydrophobicContact CG1-CD1 3.88Å; I23-L32 HydrophobicContact CG1-CG 3.97Å; L32-I34 HydrophobicContact CD2-CG1 3.87Å; L32-Y45 HydrophobicContact CD1-CD1 4.31Å; L32-Y45 HydrophobicContact CD2-CD1 4.3Å; L32-Y45 HydrophobicContact CD2-CE1 4.49Å
33	T	71.3	Confident	63.2	Low	77 Å²	77	75.5 Å²	75.5	47%	0.472	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	129.2	175.4	-59.6	0	0	0	0	108.4	H22	H22-T33 PolarHBondContact N-O 3.2Å; H22-T33 PolarHBondContact O-N 3.4Å
34	I	74.1	Confident	62.9	Low	33 Å²	33	79.5 Å²	79.5	17%	0.169	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126.1	169.2	-51.7	178.6	0	0	0	106.6	D20 L32 E36 A37 D41 Y45 I62	D20-I34 CarbonylContact O-C 3.5Å; D20-I34 VanDerWaalsContact O-CA 3.29Å; D20-I34 WeakPolarHBondContact O-CA 3.39Å; L32-I34 HydrophobicContact CD2-CG1 3.87Å; I34-E36 WeakPolarHBondContact CG2-O 3.39Å; I34-A37 HydrophobicContact CG2-CB 4.27Å; I34-D41 HydrophobicContact CD1-CB 4.33Å; I34-Y45 HydrophobicContact CD1-CE1 3.91Å; I34-Y45 HydrophobicContact CD1-CE2 4.31Å; I34-I62 HydrophobicContact CD1-CD1 4.32Å
35	A	57.6	Low	63.6	Low	60 Å²	60	76.7 Å²	76.7	50%	0.496	42%	0.423	S	S	.	.	S	Bend	trans	-78.5	-47.5	-167.9	0	0	0	0	0	112.7	D20	D20-A35 PolarHBondContact O-N 3.1Å
36	E	60.1	Low	64.1	Low	136 Å²	136	71.5 Å²	71.5	64%	0.636	40%	0.401	S	S	*	.	S	Bend	trans	-130.4	135.5	166.2	-63.8	-170.1	173.4	0	0	106.6	I34 F38	I34-E36 WeakPolarHBondContact CG2-O 3.39Å; E36-F38 HydrophobicContact CB-CE2 3.74Å; E36-F38 HydrophobicContact CB-CZ 3.88Å
37	A	58.2	Low	65.4	Low	60 Å²	60	69.1 Å²	69.1	50%	0.496	38%	0.381	S	S	.	.			trans	-116.7	117.2	-167.1	0	0	0	0	0	110.9	I34 I64	I34-A37 HydrophobicContact CG2-CB 4.27Å; A37-I64 HydrophobicContact CB-CD1 3.86Å
38	F	68.1	Low	65.5	Low	109 Å²	109	70.1 Å²	70.1	48%	0.478	37%	0.369	S	S	.	.			trans	-109.1	169.9	-174.7	-58.4	-82.4	0	0	0	111.5	E36 E40 D41 I64	E36-F38 HydrophobicContact CB-CE2 3.74Å; E36-F38 HydrophobicContact CB-CZ 3.88Å; F38-E40 HydrophobicContact CB-CG 4.09Å; F38-E40 PolarHBondContact O-N 3.14Å; F38-E40 VanDerWaalsContact O-N 3.14Å; F38-D41 PolarHBondContact N-OD2 3.35Å; F38-D41 WeakPolarHBondContact O-CB 3.3Å; F38-D41 PolarHBondContact O-N 3.32Å; F38-I64 WeakPolarHBondContact O-CD1 3.48Å
39	E	64.7	Low	66.2	Low	136 Å²	136	64.3 Å²	64.3	64%	0.636	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-58	-29.7	179.4	-169.5	170	177.3	0	0	112	T42	E39-T42 WeakPolarHBondContact O-CB 3.43Å; E39-T42 PolarHBondContact O-N 3.49Å; E39-T42 PolarHBondContact O-OG1 3.38Å
40	E	66.8	Low	66.6	Low	183 Å²	183	60.2 Å²	60.2	86%	0.855	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-75.6	-12.3	175.1	59	-174.2	-120.9	0	0	115.6	F38	F38-E40 HydrophobicContact CB-CG 4.09Å; F38-E40 PolarHBondContact O-N 3.14Å; F38-E40 VanDerWaalsContact O-N 3.14Å
41	D	75.9	Confident	67	Low	22 Å²	22	61.2 Å²	61.2	12%	0.118	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-83.6	4.8	167.6	-63.3	-70.2	0	0	0	112.5	I34 F38 G43 Y45 I64	I34-D41 HydrophobicContact CD1-CB 4.33Å; F38-D41 PolarHBondContact N-OD2 3.35Å; F38-D41 WeakPolarHBondContact O-CB 3.3Å; F38-D41 PolarHBondContact O-N 3.32Å; D41-G43 PolarHBondContact O-N 3.42Å; D41-Y45 WeakPolarHBondContact O-CE2 3.39Å; D41-Y45 PolarHBondContact O-OH 2.92Å; D41-I64 HydrophobicContact CB-CD1 3.68Å
42	T	76.8	Confident	66.3	Low	47 Å²	47	64.8 Å²	64.8	29%	0.288	34%	0.343	S	S	.	.			trans	-69.7	123.4	172.6	-67	0	0	0	0	110.4	E39 I62 Y63 I64	E39-T42 WeakPolarHBondContact O-CB 3.43Å; E39-T42 PolarHBondContact O-N 3.49Å; E39-T42 PolarHBondContact O-OG1 3.38Å; T42-I62 CarbonylContact C-O 3.48Å; T42-I62 WeakPolarHBondContact CA-O 3.33Å; T42-Y63 HydrophobicContact CG2-CD2 3.49Å; T42-Y63 VanDerWaalsContact CG2-CD2 3.49Å; T42-Y63 HydrophobicContact CG2-CE2 4.02Å; T42-Y63 HydrophobicContact CG2-CG 4.3Å; T42-I64 PolarHBondContact OG1-N 3.24Å; T42-I64 VanDerWaalsContact OG1-N 3.1Å
43	G	65.6	Low	65.5	Low	8 Å²	8	71.9 Å²	71.9	8%	0.082	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.5	178.8	178.2	0	0	0	0	0	114.6	E11 D41 Y45 I62	E11-G43 WeakPolarHBondContact OE1-CA 3.31Å; D41-G43 PolarHBondContact O-N 3.42Å; G43-Y45 WeakPolarHBondContact O-CD2 3.39Å; G43-I62 PolarHBondContact N-O 3.02Å; G43-I62 PolarHBondContact O-N 2.86Å
44	R	65.9	Low	64	Low	114 Å²	114	70.2 Å²	70.2	43%	0.43	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	103.4	178	-174.8	170	176.8	161.9	-5.6	111.8	C10 E11 S59 E61	C10-R44 WeakPolarHBondContact CA-O 3.49Å; E11-R44 PolarHBondContact N-O 3.14Å; E11-R44 VanDerWaalsContact N-O 3.15Å; E11-R44 WeakPolarHBondContact OE1-CB 3.43Å; E11-R44 PolarHBondContact OE1-N 3.44Å; R44-S59 PolarHBondContact NE-OG 2.94Å; R44-S59 VanDerWaalsContact NE-OG 3.16Å; R44-S59 PolarHBondContact NH2-OG 3.04Å; R44-E61 HydrophobicContact CB-CG 3.73Å; R44-E61 WeakPolarHBondContact CD-OE1 3.32Å; R44-E61 HydrophobicContact CG-CG 3.79Å; R44-E61 IonicContact NE-OE1 2.84Å; R44-E61 IonicContact NH1-OE1 3.08Å
45	Y	77.8	Confident	62.7	Low	16 Å²	16	73 Å²	73	6%	0.063	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.3	174.7	-69.1	-102.3	0	0	0	110.3	Y9 C10 L15 L32 I34 D41 G43 S59 A60 I62	Y9-Y45 CarbonylContact O-C 3.54Å; Y9-Y45 VanDerWaalsContact O-CA 3.25Å; Y9-Y45 WeakPolarHBondContact O-CA 3.48Å; C10-Y45 HydrophobicContact CB-CD1 3.87Å; C10-Y45 HydrophobicContact CB-CD2 4.45Å; C10-Y45 HydrophobicContact CB-CE1 3.66Å; C10-Y45 HydrophobicContact CB-CE2 4.24Å; C10-Y45 HydrophobicContact CB-CG 4.26Å; C10-Y45 WeakPolarHBondContact SG-CE2 3.42Å; C10-Y45 VanDerWaalsContact SG-CZ 3.51Å; L15-Y45 HydrophobicContact CD1-CD1 3.68Å; L15-Y45 HydrophobicContact CD1-CE1 3.73Å; L32-Y45 HydrophobicContact CD1-CD1 4.31Å; L32-Y45 HydrophobicContact CD2-CD1 4.3Å; L32-Y45 HydrophobicContact CD2-CE1 4.49Å; I34-Y45 HydrophobicContact CD1-CE1 3.91Å; I34-Y45 HydrophobicContact CD1-CE2 4.31Å; D41-Y45 WeakPolarHBondContact O-CE2 3.39Å; D41-Y45 PolarHBondContact O-OH 2.92Å; G43-Y45 WeakPolarHBondContact O-CD2 3.39Å; Y45-S59 CarbonylContact O-C 3.57Å; Y45-S59 WeakPolarHBondContact O-CA 3.39Å; Y45-S59 WeakPolarHBondContact O-CB 3.44Å; Y45-A60 PolarHBondContact N-O 3.01Å; Y45-A60 PolarHBondContact O-N 2.8Å; Y45-I62 HydrophobicContact CD2-CB 4.16Å; Y45-I62 HydrophobicContact CD2-CD1 3.63Å; Y45-I62 HydrophobicContact CD2-CG1 3.88Å; Y45-I62 HydrophobicContact CE2-CB 4.21Å; Y45-I62 HydrophobicContact CE2-CD1 3.97Å; Y45-I62 HydrophobicContact CE2-CG1 4.33Å; Y45-I62 HydrophobicContact CG-CD1 4.14Å
46	S	65.6	Low	62.2	Low	19 Å²	19	76 Å²	76	13%	0.133	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	139.2	-175.5	-54.1	0	0	0	0	111.5	W8 Y9 T58 S59	W8-S46 CarbonylContact C-O 3.52Å; W8-S46 VanDerWaalsContact CA-O 3.3Å; W8-S46 WeakPolarHBondContact CA-O 3.46Å; Y9-S46 PolarHBondContact N-O 3.36Å; Y9-S46 PolarHBondContact O-N 3.32Å; S46-T58 CarbonylContact C-O 3.59Å; S46-T58 WeakPolarHBondContact CA-O 3.4Å; S46-S59 VanDerWaalsContact OG-CB 3.22Å; S46-S59 WeakPolarHBondContact OG-CB 3.05Å
47	C	75.4	Confident	62.6	Low	13 Å²	13	72.8 Å²	72.8	9%	0.088	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.5	177	-177	0	0	0	0	109.7	W7 W8 S57 T58	W7-C47 WeakPolarHBondContact O-CA 3.47Å; W8-C47 HydrophobicContact CD2-CB 3.83Å; W8-C47 VanDerWaalsContact CE2-SG 3.52Å; W8-C47 HydrophobicContact CE3-CB 3.76Å; W8-C47 HydrophobicContact CH2-CB 3.87Å; W8-C47 HydrophobicContact CZ2-CB 3.93Å; W8-C47 HydrophobicContact CZ3-CB 3.78Å; C47-S57 VanDerWaalsContact O-CA 3.31Å; C47-S57 WeakPolarHBondContact O-CA 3.38Å; C47-T58 HydrophobicContact CB-CG2 4.23Å; C47-T58 PolarHBondContact N-O 3.2Å; C47-T58 PolarHBondContact O-N 3.39Å
48	F	62	Low	62.3	Low	76 Å²	76	74.6 Å²	74.6	33%	0.333	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.8	179.8	-71.1	-98.3	0	0	0	110	F6 W7 Y9 S57	F6-F48 VanDerWaalsContact CA-O 3.23Å; F6-F48 WeakPolarHBondContact CA-O 3.07Å; W7-F48 PolarHBondContact N-O 2.63Å; W7-F48 PolarHBondContact O-N 3.24Å; Y9-F48 AromaticContact CD2-CD2 3.65Å; Y9-F48 HydrophobicContact CD2-CD2 3.65Å; Y9-F48 AromaticContact CD2-CE2 3.92Å; Y9-F48 HydrophobicContact CD2-CE2 3.92Å; Y9-F48 AromaticContact CE2-CD2 3.81Å; Y9-F48 HydrophobicContact CE2-CD2 3.81Å; Y9-F48 HydrophobicContact CE2-CE2 4.31Å; F48-S57 VanDerWaalsContact CE1-CB 3.46Å
49	A	68.4	Low	62.2	Low	21 Å²	21	71.1 Å²	71.1	17%	0.174	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	117.4	-178.8	0	0	0	0	0	110.2	S5 F6 T55 D56	S5-A49 CarbonylContact O-C 3.49Å; S5-A49 WeakPolarHBondContact O-CA 3.49Å; F6-A49 HydrophobicContact CD1-CB 3.59Å; F6-A49 HydrophobicContact CE1-CB 3.39Å; F6-A49 HydrophobicContact CG-CB 4.4Å; F6-A49 HydrophobicContact CZ-CB 4.06Å; A49-T55 WeakPolarHBondContact O-CA 3.34Å; A49-D56 PolarHBondContact N-O 2.8Å; A49-D56 PolarHBondContact O-N 2.84Å
50	S	56.4	Low	61.6	Low	27 Å²	27	66.7 Å²	66.7	19%	0.189	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	144.6	-174.2	-165.7	0	0	0	0	113.6	L4 S5 T55	L4-S50 WeakPolarHBondContact CA-O 3.39Å; S5-S50 PolarHBondContact N-O 3.14Å; S5-S50 PolarHBondContact O-N 2.96Å; S50-T55 WeakPolarHBondContact CB-OG1 3.42Å; S50-T55 PolarHBondContact OG-OG1 3.11Å
51	N	65.6	Low	61.1	Low	52 Å²	52	63.8 Å²	63.8	28%	0.278	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	-179.3	162.5	70.9	70.9	0	0	0	110.6	L4 Y53 G54	L4-N51 HydrophobicContact CD2-CB 4.07Å; L4-N51 VanDerWaalsContact CD2-ND2 3.27Å; L4-N51 WeakPolarHBondContact CD2-ND2 3.22Å; L4-N51 HydrophobicContact CG-CB 4.38Å; N51-Y53 PolarHBondContact O-N 2.91Å; N51-Y53 WeakPolarHBondContact OD1-CB 3.46Å; N51-Y53 WeakPolarHBondContact OD1-CD2 3.3Å; N51-Y53 PolarHBondContact OD1-N 2.9Å; N51-G54 PolarHBondContact N-O 3.33Å; N51-G54 PolarHBondContact O-N 3.2Å
52	I	48	Very low	60.5	Low	121 Å²	121	65.5 Å²	65.5	62%	0.621	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-10.5	-175.2	65.9	172.1	0	0	0	116	F2	F2-I52 HydrophobicContact CD1-CD1 3.66Å; F2-I52 HydrophobicContact CD1-CG1 4.47Å; F2-I52 HydrophobicContact CD2-CD1 4.02Å; F2-I52 HydrophobicContact CE1-CD1 3.67Å; F2-I52 HydrophobicContact CE2-CD1 4.03Å; F2-I52 HydrophobicContact CG-CD1 3.84Å; F2-I52 HydrophobicContact CG-CG1 4.29Å; F2-I52 HydrophobicContact CZ-CD1 3.86Å
53	Y	50.8	Low	59.4	Low	180 Å²	180	71.8 Å²	71.8	71%	0.706	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-9.9	177.7	-59.3	-69.7	0	0	0	114.1	F2 N51	F2-Y53 AromaticContact CD2-CE2 3.72Å; F2-Y53 HydrophobicContact CD2-CE2 3.72Å; F2-Y53 AromaticContact CE2-CE2 3.94Å; F2-Y53 HydrophobicContact CE2-CE2 3.94Å; F2-Y53 WeakPolarHBondContact CE2-OH 3.25Å; N51-Y53 PolarHBondContact O-N 2.91Å; N51-Y53 WeakPolarHBondContact OD1-CB 3.46Å; N51-Y53 WeakPolarHBondContact OD1-CD2 3.3Å; N51-Y53 PolarHBondContact OD1-N 2.9Å
54	G	40.6	Very low	59.5	Low	42 Å²	42	73.1 Å²	73.1	43%	0.433	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160.2	168.8	-177.8	0	0	0	0	0	113.6	N51	N51-G54 PolarHBondContact N-O 3.33Å; N51-G54 PolarHBondContact O-N 3.2Å
55	T	46.4	Very low	58.8	Low	92 Å²	92	75 Å²	75	56%	0.564	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.7	171.9	-51.6	0	0	0	0	108.4	A49 S50	A49-T55 WeakPolarHBondContact O-CA 3.34Å; S50-T55 WeakPolarHBondContact CB-OG1 3.42Å; S50-T55 PolarHBondContact OG-OG1 3.11Å
56	D	47.5	Very low	57.4	Low	123 Å²	123	75.9 Å²	75.9	66%	0.658	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	158.3	176	-166.9	8.5	0	0	0	109	A49	A49-D56 PolarHBondContact N-O 2.8Å; A49-D56 PolarHBondContact O-N 2.84Å
57	S	67.2	Low	56.2	Low	68 Å²	68	81.5 Å²	81.5	48%	0.476	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	140.9	-172.8	62.6	0	0	0	0	113.3	C47 F48	C47-S57 VanDerWaalsContact O-CA 3.31Å; C47-S57 WeakPolarHBondContact O-CA 3.38Å; F48-S57 VanDerWaalsContact CE1-CB 3.46Å
58	T	53.6	Low	54.2	Low	97 Å²	97	86.5 Å²	86.5	60%	0.595	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	151.1	173.8	-174	0	0	0	0	110.6	S46 C47	S46-T58 CarbonylContact C-O 3.59Å; S46-T58 WeakPolarHBondContact CA-O 3.4Å; C47-T58 HydrophobicContact CB-CG2 4.23Å; C47-T58 PolarHBondContact N-O 3.2Å; C47-T58 PolarHBondContact O-N 3.39Å
59	S	64.5	Low	52.9	Low	37 Å²	37	87.8 Å²	87.8	26%	0.259	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	142.8	179.4	64.7	0	0	0	0	112.1	R44 Y45 S46	R44-S59 PolarHBondContact NE-OG 2.94Å; R44-S59 VanDerWaalsContact NE-OG 3.16Å; R44-S59 PolarHBondContact NH2-OG 3.04Å; Y45-S59 CarbonylContact O-C 3.57Å; Y45-S59 WeakPolarHBondContact O-CA 3.39Å; Y45-S59 WeakPolarHBondContact O-CB 3.44Å; S46-S59 VanDerWaalsContact OG-CB 3.22Å; S46-S59 WeakPolarHBondContact OG-CB 3.05Å
60	A	52.1	Low	51.2	Low	42 Å²	42	92.2 Å²	92.2	35%	0.347	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.2	175	0	0	0	0	0	110.1	Y45 F306	Y45-A60 PolarHBondContact N-O 3.01Å; Y45-A60 PolarHBondContact O-N 2.8Å; A60-F306 HydrophobicContact CB-CE1 4.2Å; A60-F306 HydrophobicContact CB-CZ 4.31Å
61	E	56.5	Low	49.9	Very low	122 Å²	122	98.4 Å²	98.4	57%	0.57	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.6	130.9	175.1	-75.3	162.7	-161.6	0	0	109.3	R44 F306	R44-E61 HydrophobicContact CB-CG 3.73Å; R44-E61 WeakPolarHBondContact CD-OE1 3.32Å; R44-E61 HydrophobicContact CG-CG 3.79Å; R44-E61 IonicContact NE-OE1 2.84Å; R44-E61 IonicContact NH1-OE1 3.08Å; E61-F306 WeakPolarHBondContact O-CE1 3.09Å
62	I	64.4	Low	48.2	Very low	58 Å²	58	100.7 Å²	100.7	30%	0.297	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.3	128.8	177.3	-58.7	-177.3	0	0	0	106.9	I34 T42 G43 Y45 I64	I34-I62 HydrophobicContact CD1-CD1 4.32Å; T42-I62 CarbonylContact C-O 3.48Å; T42-I62 WeakPolarHBondContact CA-O 3.33Å; G43-I62 PolarHBondContact N-O 3.02Å; G43-I62 PolarHBondContact O-N 2.86Å; Y45-I62 HydrophobicContact CD2-CB 4.16Å; Y45-I62 HydrophobicContact CD2-CD1 3.63Å; Y45-I62 HydrophobicContact CD2-CG1 3.88Å; Y45-I62 HydrophobicContact CE2-CB 4.21Å; Y45-I62 HydrophobicContact CE2-CD1 3.97Å; Y45-I62 HydrophobicContact CE2-CG1 4.33Å; Y45-I62 HydrophobicContact CG-CD1 4.14Å; I62-I64 HydrophobicContact CG2-CD1 4.02Å; I62-I64 HydrophobicContact CG2-CG1 4.07Å
63	Y	53.5	Low	47.4	Very low	179 Å²	179	104.4 Å²	104.4	70%	0.702	60%	0.595	S	S	*	*			trans	-130.1	124.4	-179.8	-169	-97.2	0	0	0	109.5	T42 E65	T42-Y63 HydrophobicContact CG2-CD2 3.49Å; T42-Y63 VanDerWaalsContact CG2-CD2 3.49Å; T42-Y63 HydrophobicContact CG2-CE2 4.02Å; T42-Y63 HydrophobicContact CG2-CG 4.3Å; Y63-E65 HydrophobicContact CD1-CG 3.95Å; Y63-E65 HydrophobicContact CE1-CG 3.72Å
64	I	68.3	Low	46.3	Very low	37 Å²	37	99 Å²	99	19%	0.19	60%	0.595	C	S	.	*			trans	-119.4	103.7	-170	-64.3	158.2	0	0	0	108.2	A37 F38 D41 T42 I62 G66	A37-I64 HydrophobicContact CB-CD1 3.86Å; F38-I64 WeakPolarHBondContact O-CD1 3.48Å; D41-I64 HydrophobicContact CB-CD1 3.68Å; T42-I64 PolarHBondContact OG1-N 3.24Å; T42-I64 VanDerWaalsContact OG1-N 3.1Å; I62-I64 HydrophobicContact CG2-CD1 4.02Å; I62-I64 HydrophobicContact CG2-CG1 4.07Å; I64-G66 PolarHBondContact O-N 3.24Å; I64-G66 VanDerWaalsContact O-N 3.11Å
65	E	50.5	Low	45.8	Very low	154 Å²	154	104.6 Å²	104.6	72%	0.72	62%	0.615	S	S	*	*			trans	-71.5	104.1	-173.7	-73.1	-176.1	158.2	0	0	112.3	Y63 V67	Y63-E65 HydrophobicContact CD1-CG 3.95Å; Y63-E65 HydrophobicContact CE1-CG 3.72Å; E65-V67 PolarHBondContact O-N 3.06Å
66	G	47.8	Very low	45.7	Very low	33 Å²	33	104 Å²	104	34%	0.34	61%	0.612	S	S	.	*			trans	-61.8	126.2	168.9	0	0	0	0	0	111.7	I64 S68	I64-G66 PolarHBondContact O-N 3.24Å; I64-G66 VanDerWaalsContact O-N 3.11Å; G66-S68 VanDerWaalsContact C-N 3.28Å; G66-S68 PolarHBondContact O-N 3.2Å
67	V	40.1	Very low	44.9	Very low	138 Å²	138	104.5 Å²	104.5	84%	0.836	62%	0.615	S	S	*	*			trans	-77.6	79.2	-179.2	-172.5	0	0	0	0	110.2	E65 S69	E65-V67 PolarHBondContact O-N 3.06Å; V67-S69 PolarHBondContact O-N 3.08Å
68	S	33.5	Very low	42.9	Very low	118 Å²	118	108.1 Å²	108.1	83%	0.825	62%	0.622	S	S	*	*			trans	-55.8	136.2	168	64.2	0	0	0	0	110.3	G66	G66-S68 VanDerWaalsContact C-N 3.28Å; G66-S68 PolarHBondContact O-N 3.2Å
69	S	36	Very low	41.8	Very low	102 Å²	102	110 Å²	110	71%	0.713	62%	0.624	S	S	*	*			trans	-144	154.3	-176.1	65.3	0	0	0	0	112.5	V67	V67-S69 PolarHBondContact O-N 3.08Å
70	S	31.7	Very low	40.2	Very low	115 Å²	115	115.3 Å²	115.3	80%	0.804	65%	0.645	S	S	*	*			trans	69.9	133.4	-178.5	75.5	0	0	0	0	117.5
71	D	28.7	Very low	39	Very low	156 Å²	156	119.8 Å²	119.8	83%	0.834	66%	0.66	S	S	*	*				-120.5	133.6	125.8	-110.1	-36.8	0	0	0	106.6
72	S	31.7	Very low	37.6	Very low	100 Å²	100	119.4 Å²	119.4	70%	0.699	66%	0.662	S	S	*	*			trans	37.4	127.8	153.3	65.1	0	0	0	0	120.5
73	E	30.7	Very low	35.9	Very low	199 Å²	199	126 Å²	126	93%	0.93	68%	0.683	S	S	*	*			cis	-150.7	173.2	10.1	-60.6	-168	98.1	0	0	109
74	G	27.6	Very low	34.9	Very low	68 Å²	68	123.4 Å²	123.4	70%	0.701	68%	0.68	S	S	*	*			cis	152.4	149.5	-7	0	0	0	0	0	113.1
75	D	30.3	Very low	32.9	Very low	159 Å²	159	129.9 Å²	129.9	85%	0.85	71%	0.71	S	S	*	*			trans	64.5	160	167.5	-128.1	45.1	0	0	0	118.5
76	P	44.6	Very low	31.7	Very low	78 Å²	78	128.7 Å²	128.7	51%	0.506	70%	0.702	S	S	.	*				-132.5	177.4	-72.7	41.7	-30.9	0	0	0	115.7
77	N	28.9	Very low	31.2	Very low	135 Å²	135	132.5 Å²	132.5	72%	0.722	72%	0.721	S	S	*	*			trans	69.1	149.3	154.8	-67.5	-40.2	0	0	0	118
78	K	26.5	Very low	30.7	Very low	144 Å²	144	130.8 Å²	130.8	63%	0.626	71%	0.707	S	S	*	*			cis	-165.2	152.2	-19.2	-123.8	169.2	171.6	-81.5	0	109.2
79	E	30.7	Very low	30.5	Very low	137 Å²	137	133 Å²	133	64%	0.64	70%	0.704	S	S	*	*			trans	54.9	117.1	143.1	-79	149.4	-168.5	0	0	123.3
80	E	30.1	Very low	30.3	Very low	147 Å²	147	133.5 Å²	133.5	69%	0.687	70%	0.703	S	S	*	*				100.6	100.6	111	-162.8	160	-176.9	0	0	122.7
81	M	27.1	Very low	30.1	Very low	137 Å²	137	133.4 Å²	133.4	68%	0.675	70%	0.702	S	S	*	*			trans	67.2	142.6	132.7	-80.3	-154	-61.9	0	0	126.1
82	N	27.6	Very low	30.2	Very low	113 Å²	113	131.6 Å²	131.6	60%	0.604	70%	0.702	S	S	*	*			trans	76.1	150.6	138.2	-75.7	-23.8	0	0	0	119.7
83	R	29.1	Very low	31	Very low	196 Å²	196	132.8 Å²	132.8	74%	0.74	71%	0.707	S	S	*	*			cis	-170.4	163.6	8.6	-122.5	166.3	-172.8	-142.8	3.4	111.4
84	I	30.7	Very low	32	Very low	125 Å²	125	129 Å²	129	64%	0.641	70%	0.7	S	S	*	*			trans	70	139.7	144.2	-73.9	167.1	0	0	0	117.9
85	Q	27.3	Very low	31.9	Very low	173 Å²	173	131.9 Å²	131.9	81%	0.808	70%	0.704	S	S	*	*			cis	-159.6	175.4	-6.3	-114.9	169.2	11.2	0	0	113.6
86	K	24.5	Very low	31.7	Very low	130 Å²	130	130.1 Å²	130.1	57%	0.565	70%	0.699	S	S	*	*			trans	-61.5	-177.4	173.7	-81.8	-171.7	168.2	-167.5	0	116.1
87	P	37.7	Very low	30.8	Very low	112 Å²	112	131.9 Å²	131.9	73%	0.727	71%	0.713	S	S	*	*			cis	-140.3	171.9	5.1	32.1	-7.9	0	0	0	119.6
88	N	30.4	Very low	30.7	Very low	103 Å²	103	129.6 Å²	129.6	55%	0.551	71%	0.713	S	S	*	*			trans	23.4	166.6	132.2	-59.5	39.6	0	0	0	122.8
89	E	29.6	Very low	30.6	Very low	163 Å²	163	129.6 Å²	129.6	76%	0.762	73%	0.725	S	S	*	*			cis	178.5	-171.9	-11	-98.2	179.8	139	0	0	107.9
90	V	30.2	Very low	30.4	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.685	73%	0.732	S	S	*	*			cis	-163.9	156.2	-9.7	117.6	0	0	0	0	109.9
91	S	27.5	Very low	30.6	Very low	114 Å²	114	129.2 Å²	129.2	80%	0.797	74%	0.737	S	S	*	*			trans	140	153.9	136.2	64.5	0	0	0	0	119.1
92	S	31	Very low	31.4	Very low	118 Å²	118	128.3 Å²	128.3	83%	0.825	74%	0.742	S	S	*	*			trans	-164.6	136.9	168.3	54.1	0	0	0	0	116.1
93	P	49.6	Very low	31.2	Very low	124 Å²	124	126.9 Å²	126.9	81%	0.805	75%	0.746	S	S	*	*			trans	-128.5	-164.6	166.5	43.5	-30.7	0	0	0	111.8
94	P	50.6	Low	30.9	Very low	119 Å²	119	124.2 Å²	124.2	77%	0.773	75%	0.751	S	S	*	*			cis	-127.4	-156.8	-9.2	43.3	-25.4	0	0	0	113.5
95	T	25.3	Very low	31.1	Very low	130 Å²	130	123.3 Å²	123.3	80%	0.798	75%	0.753	S	S	*	*			trans	-160.2	176.4	-177.9	-35.8	0	0	0	0	114.4
96	T	27	Very low	30.9	Very low	122 Å²	122	123.8 Å²	123.8	75%	0.748	76%	0.755	S	S	*	*			trans	95	133.9	143.1	23.3	0	0	0	0	126.1
97	S	25.1	Very low	30.8	Very low	114 Å²	114	122 Å²	122	80%	0.797	76%	0.764	S	S	*	*			trans	72.2	158	138.9	-62.7	0	0	0	0	123.2
98	A	27.5	Very low	30.2	Very low	87 Å²	87	125.5 Å²	125.5	72%	0.719	77%	0.771	S	S	*	*			cis	-176.5	-175.2	-24.7	0	0	0	0	0	112.5
99	V	24	Very low	30	Very low	144 Å²	144	128.5 Å²	128.5	87%	0.873	78%	0.781	S	S	*	*			trans	101.2	152.4	161.6	-170.8	0	0	0	0	119.3
100	I	26.1	Very low	29.6	Very low	153 Å²	153	127.9 Å²	127.9	79%	0.785	78%	0.782	S	S	*	*			trans	-147.6	166.7	-168.1	54.2	168.3	0	0	0	112.4
101	P	35.7	Very low	29.3	Very low	123 Å²	123	129.1 Å²	129.1	80%	0.799	79%	0.79	S	S	*	*				-157	-139.9	106.8	49.8	-28.1	0	0	0	115.7
102	P	42.8	Very low	29.2	Very low	119 Å²	119	128.2 Å²	128.2	77%	0.773	79%	0.789	S	S	*	*			trans	-145.6	-175.7	-137.3	42.2	-15.2	0	0	0	122.5
103	A	23.5	Very low	28.9	Very low	83 Å²	83	130.7 Å²	130.7	69%	0.686	79%	0.788	S	S	*	*			trans	82.3	106.2	137.9	0	0	0	0	0	127.8
104	V	22.4	Very low	27.6	Very low	140 Å²	140	131.2 Å²	131.2	85%	0.848	79%	0.791	S	S	*	*			trans	54.8	162.3	143.1	-86.2	0	0	0	0	124.4
105	P	34.9	Very low	26.4	Very low	105 Å²	105	136.6 Å²	136.6	68%	0.682	80%	0.796	S	S	*	*			cis	-139.7	-175.3	-28.6	39.2	-19.8	0	0	0	117.5
106	Q	23.3	Very low	26.4	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	80%	0.8	S	S	*	*			trans	79.1	116.3	165.7	-59.4	-175.6	5.5	0	0	118.5
107	A	22.5	Very low	26.2	Very low	91 Å²	91	135.3 Å²	135.3	75%	0.752	80%	0.796	S	S	*	*				90	139.7	74.6	0	0	0	0	0	113.5
108	Q	25	Very low	26.2	Very low	187 Å²	187	136.2 Å²	136.2	87%	0.874	80%	0.797	S	S	*	*			cis	-150.7	156.2	26.6	-57.6	173.2	-9.2	0	0	115.4
109	H	26.7	Very low	26.1	Very low	166 Å²	166	139.5 Å²	139.5	77%	0.769	80%	0.801	S	S	*	*			trans	55.9	127.9	144.7	-104.1	-130.5	0	0	0	127
110	L	21.5	Very low	26	Very low	150 Å²	150	140.7 Å²	140.7	79%	0.785	80%	0.797	S	S	*	*			trans	61.1	143.6	151	-64.6	168.3	0	0	0	118.8
111	V	24.1	Very low	26	Very low	138 Å²	138	140.5 Å²	140.5	84%	0.836	79%	0.793	S	S	*	*			cis	-126.4	156.5	14.8	173.7	0	0	0	0	111
112	A	24.1	Very low	25.4	Very low	95 Å²	95	141 Å²	141	79%	0.785	80%	0.797	S	S	*	*			trans	-86.7	148.7	-174.2	0	0	0	0	0	115.6
113	Q	24.9	Very low	24.6	Very low	171 Å²	171	142.9 Å²	142.9	80%	0.799	80%	0.796	S	S	*	*			trans	-109.7	145.2	161.5	-67.3	179.5	-7.8	0	0	109.9	R115	Q113-R115 PolarHBondContact O-N 2.88Å; Q113-R115 VanDerWaalsContact O-N 3.13Å
114	P	23.4	Very low	24.5	Very low	135 Å²	135	143.2 Å²	143.2	88%	0.877	79%	0.793	S	S	*	*			trans	-75.5	99.6	171.9	30.9	-32.6	0	0	0	110.4
115	R	24.9	Very low	24.6	Very low	232 Å²	232	141.7 Å²	141.7	88%	0.875	79%	0.786	S	S	*	*			trans	-75.8	143.9	166.5	-91	-173.9	168.6	179.8	-3.9	110.6	Q113 A117	Q113-R115 PolarHBondContact O-N 2.88Å; Q113-R115 VanDerWaalsContact O-N 3.13Å; R115-A117 PolarHBondContact O-N 3.02Å; R115-A117 VanDerWaalsContact O-N 3.12Å
116	V	25.7	Very low	24.3	Very low	144 Å²	144	142.2 Å²	142.2	87%	0.873	79%	0.787	S	S	*	*			trans	-57.1	114.6	168.8	176.8	0	0	0	0	108.6
117	A	22.5	Very low	24.3	Very low	81 Å²	81	139.4 Å²	139.4	67%	0.669	78%	0.778	S	S	*	*			trans	-78	120.8	170.5	0	0	0	0	0	108.8	R115 I119	R115-A117 PolarHBondContact O-N 3.02Å; R115-A117 VanDerWaalsContact O-N 3.12Å; A117-I119 PolarHBondContact O-N 2.91Å; A117-I119 VanDerWaalsContact O-N 3.13Å
118	T	25	Very low	24.5	Very low	132 Å²	132	144.6 Å²	144.6	81%	0.81	78%	0.78	S	S	*	*			trans	-55.4	117.2	161.4	-55.6	0	0	0	0	107.7	Q120	T118-Q120 PolarHBondContact O-N 3.43Å
119	I	25.2	Very low	24.6	Very low	157 Å²	157	143.1 Å²	143.1	81%	0.805	78%	0.777	S	S	*	*			trans	-71.6	92	172.5	-61.8	-178.8	0	0	0	107.3	A117 Q121	A117-I119 PolarHBondContact O-N 2.91Å; A117-I119 VanDerWaalsContact O-N 3.13Å; I119-Q121 PolarHBondContact O-N 3.15Å
120	Q	22.6	Very low	25	Very low	168 Å²	168	143.4 Å²	143.4	79%	0.785	78%	0.779	S	S	*	*			trans	-53.9	124.3	167.5	-176.1	170.5	-6.1	0	0	108.1	T118 C122	T118-Q120 PolarHBondContact O-N 3.43Å; Q120-C122 PolarHBondContact O-N 3.1Å; Q120-C122 VanDerWaalsContact O-N 3.17Å
121	Q	25.5	Very low	25.3	Very low	150 Å²	150	139.6 Å²	139.6	70%	0.701	78%	0.776	S	S	*	*			trans	-56.3	123.3	-179.7	-71.9	177.4	-21.5	0	0	109.8	I119 Q123	I119-Q121 PolarHBondContact O-N 3.15Å; Q121-Q123 HydrophobicContact CB-CG 4.37Å; Q121-Q123 PolarHBondContact O-N 2.72Å
122	C	22.3	Very low	26	Very low	133 Å²	133	139.4 Å²	139.4	90%	0.899	77%	0.77	S	S	*	*			trans	-70.5	74.3	167.2	-70	0	0	0	0	109.7	Q120 S124	Q120-C122 PolarHBondContact O-N 3.1Å; Q120-C122 VanDerWaalsContact O-N 3.17Å; C122-S124 PolarHBondContact O-N 3.22Å
123	Q	26	Very low	26.5	Very low	158 Å²	158	141.2 Å²	141.2	74%	0.738	77%	0.766	S	S	*	*			trans	-63.1	103.8	164	-66.3	-176.8	-0.8	0	0	107.5	Q121	Q121-Q123 HydrophobicContact CB-CG 4.37Å; Q121-Q123 PolarHBondContact O-N 2.72Å
124	S	22.1	Very low	27.1	Very low	91 Å²	91	136.7 Å²	136.7	64%	0.636	77%	0.766	S	S	*	*			trans	-63.9	128.5	165.5	46.5	0	0	0	0	108.2	C122 T126	C122-S124 PolarHBondContact O-N 3.22Å; S124-T126 VanDerWaalsContact C-N 3.25Å; S124-T126 PolarHBondContact O-N 3.01Å
125	P	25.3	Very low	27.7	Very low	107 Å²	107	137.9 Å²	137.9	70%	0.695	76%	0.757	S	S	*	*			trans	-73.8	84.2	179	30	-34.2	0	0	0	109.3	N127	P125-N127 PolarHBondContact O-N 2.8Å
126	T	27.3	Very low	28.4	Very low	116 Å²	116	132.1 Å²	132.1	71%	0.712	75%	0.75	S	S	*	*			trans	-70.1	74.1	164.6	-53.9	0	0	0	0	107.8	S124 Y128	S124-T126 VanDerWaalsContact C-N 3.25Å; S124-T126 PolarHBondContact O-N 3.01Å; T126-Y128 PolarHBondContact O-N 2.84Å
127	N	22.9	Very low	29.5	Very low	125 Å²	125	131.5 Å²	131.5	67%	0.668	74%	0.74	S	S	*	*			trans	-58.4	119.6	176.2	-83.7	-34.9	0	0	0	109	P125 L129	P125-N127 PolarHBondContact O-N 2.8Å; N127-L129 HydrophobicContact CB-CG 4.39Å; N127-L129 PolarHBondContact O-N 3.05Å
128	Y	28.4	Very low	31.3	Very low	201 Å²	201	132.7 Å²	132.7	79%	0.788	73%	0.734	S	S	*	*			trans	-65.8	86.4	162.9	-83.3	-99	0	0	0	108.6	T126	T126-Y128 PolarHBondContact O-N 2.84Å
129	L	26.7	Very low	32.7	Very low	156 Å²	156	128.2 Å²	128.2	82%	0.817	71%	0.71	S	S	*	*			trans	-92.2	145.1	163.5	-72.5	-179.5	0	0	0	110.2	N127 G131	N127-L129 HydrophobicContact CB-CG 4.39Å; N127-L129 PolarHBondContact O-N 3.05Å; L129-G131 PolarHBondContact O-N 2.9Å
130	Q	35.5	Very low	34.1	Very low	171 Å²	171	122.8 Å²	122.8	80%	0.799	69%	0.689	S	S	*	*			trans	-70.2	113.6	-156.2	-167.5	170.7	13.4	0	0	112.3	L132	Q130-L132 PolarHBondContact O-N 2.96Å
131	G	27.5	Very low	36.4	Very low	70 Å²	70	114.9 Å²	114.9	72%	0.722	65%	0.652	S	S	*	*			trans	-66.8	95.5	162.9	0	0	0	0	0	110.1	L129	L129-G131 PolarHBondContact O-N 2.9Å
132	L	37.8	Very low	38.1	Very low	135 Å²	135	111.4 Å²	111.4	71%	0.707	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	168.4	157.1	-61.8	171.3	0	0	0	109.3	Q130 G134	Q130-L132 PolarHBondContact O-N 2.96Å; L132-G134 PolarHBondContact O-N 3.02Å
133	D	35.2	Very low	40.1	Very low	132 Å²	132	106.3 Å²	106.3	71%	0.706	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.4	2.3	179.8	-44.5	-10.8	0	0	0	117.6	K135	D133-K135 VanDerWaalsContact C-N 3.29Å; D133-K135 PolarHBondContact O-N 2.82Å; D133-K135 IonicContact OD2-NZ 2.69Å
134	G	37.4	Very low	41.7	Very low	77 Å²	77	101.3 Å²	101.3	79%	0.794	58%	0.584	S	S	*	*			trans	61.5	22.7	160.5	0	0	0	0	0	117.6	L132	L132-G134 PolarHBondContact O-N 3.02Å
135	K	35.8	Very low	43.5	Very low	159 Å²	159	100.2 Å²	100.2	69%	0.691	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-76.2	143.6	178.8	-72.5	161.8	-175	146	0	111.4	D133 I137	D133-K135 VanDerWaalsContact C-N 3.29Å; D133-K135 PolarHBondContact O-N 2.82Å; D133-K135 IonicContact OD2-NZ 2.69Å; K135-I137 PolarHBondContact O-N 2.86Å
136	P	40.2	Very low	45.1	Very low	112 Å²	112	100.4 Å²	100.4	73%	0.727	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-65.8	129.5	178.3	27.3	-34.3	0	0	0	111
137	I	49.4	Very low	46.8	Very low	131 Å²	131	95.5 Å²	95.5	67%	0.672	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-66.1	133.6	173.7	-59.8	174.5	0	0	0	108.4	K135 A167	K135-I137 PolarHBondContact O-N 2.86Å; I137-A167 WeakPolarHBondContact O-CB 3.22Å
138	I	58.7	Low	48.4	Very low	106 Å²	106	95.9 Å²	95.9	54%	0.544	53%	0.528	S	S	.	.			trans	-113.1	123.3	179.8	-75.8	168.6	0	0	0	108.2	Y227	I138-Y227 HydrophobicContact CB-CE2 4.27Å; I138-Y227 HydrophobicContact CG1-CE2 4.05Å; I138-Y227 HydrophobicContact CG2-CD1 4.04Å; I138-Y227 HydrophobicContact CG2-CD2 3.65Å; I138-Y227 HydrophobicContact CG2-CE1 3.93Å; I138-Y227 HydrophobicContact CG2-CE2 3.52Å; I138-Y227 HydrophobicContact CG2-CG 3.91Å
139	A	56.1	Low	50	Low	38 Å²	38	91.3 Å²	91.3	31%	0.314	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	132	-178.2	0	0	0	0	0	111.5	A167 N225	A139-A167 HydrophobicContact CB-CB 4.09Å; A139-A167 PolarHBondContact N-O 2.96Å; A139-A167 CarbonylContact O-C 3.53Å; A139-A167 PolarHBondContact O-N 3.19Å; A139-A167 VanDerWaalsContact O-O 3.11Å; A139-N225 PolarHBondContact O-ND2 2.83Å
140	A	52.9	Low	51.4	Low	43 Å²	43	86.6 Å²	86.6	36%	0.355	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	154.9	165.1	0	0	0	0	0	110.4	Y227	A140-Y227 WeakPolarHBondContact CB-O 3.4Å
141	P	72.5	Confident	52.7	Low	2 Å²	2	82.4 Å²	82.4	1%	0.013	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	139.2	178.1	27.8	-33.6	0	0	0	111.6	V164 K165 P170 A223 N225 G228 V230	P141-V164 HydrophobicContact CB-CG2 4.07Å; P141-K165 CarbonylContact C-O 3.51Å; P141-K165 VanDerWaalsContact CA-O 3.3Å; P141-K165 WeakPolarHBondContact CA-O 3.27Å; P141-P170 HydrophobicContact CB-CB 4.09Å; P141-A223 HydrophobicContact CB-CB 4.24Å; P141-A223 VanDerWaalsContact CG-O 3.27Å; P141-A223 WeakPolarHBondContact CG-O 3.46Å; P141-N225 WeakPolarHBondContact CD-OD1 3.21Å; P141-G228 WeakPolarHBondContact CD-O 3.44Å; P141-G228 WeakPolarHBondContact CG-O 3.27Å; P141-V230 HydrophobicContact CB-CG2 3.94Å; P141-V230 HydrophobicContact CG-CG2 4.1Å; P141-V230 WeakPolarHBondContact O-CG1 3.41Å; P141-V230 VanDerWaalsContact O-CG2 3.29Å; P141-V230 WeakPolarHBondContact O-CG2 3.23Å
142	V	59.9	Low	54.4	Low	77 Å²	77	79.5 Å²	79.5	47%	0.467	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	127.7	176.4	179.6	0	0	0	0	109	V164 K165	V142-V164 WeakPolarHBondContact O-CA 3.3Å; V142-V164 WeakPolarHBondContact O-CG2 3.5Å; V142-K165 PolarHBondContact N-O 2.82Å; V142-K165 PolarHBondContact O-N 2.77Å
143	F	64.4	Low	55.8	Low	26 Å²	26	75.9 Å²	75.9	11%	0.114	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.6	170.7	-74	-73.6	0	0	0	110.7	M146 C162 R163 V164 C221 A223 V230	F143-M146 HydrophobicContact CB-CG 4.04Å; F143-C162 HydrophobicContact CD1-CB 3.97Å; F143-C162 HydrophobicContact CE1-CB 3.96Å; F143-R163 CarbonylContact C-O 3.56Å; F143-R163 VanDerWaalsContact CA-O 3.32Å; F143-R163 WeakPolarHBondContact CA-O 3.39Å; F143-R163 WeakPolarHBondContact CD1-O 3.47Å; F143-V164 HydrophobicContact CD1-CB 4.05Å; F143-V164 HydrophobicContact CD1-CG2 4.45Å; F143-V164 HydrophobicContact CE1-CB 4.11Å; F143-V164 HydrophobicContact CE1-CG2 4.5Å; F143-C221 HydrophobicContact CZ-CB 4.32Å; F143-C221 WeakPolarHBondContact CZ-O 3.44Å; F143-A223 HydrophobicContact CE1-CB 4.49Å; F143-A223 HydrophobicContact CE2-CB 4.33Å; F143-A223 HydrophobicContact CZ-CB 3.89Å; F143-V230 HydrophobicContact CD2-CB 4.25Å; F143-V230 HydrophobicContact CD2-CG2 3.7Å; F143-V230 HydrophobicContact CE2-CB 4.3Å; F143-V230 HydrophobicContact CE2-CG2 3.71Å
144	T	60.6	Low	57.7	Low	52 Å²	52	73.5 Å²	73.5	32%	0.319	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	-28.9	179.9	56.8	0	0	0	0	110.9	R163 K165 E201	T144-R163 PolarHBondContact N-O 2.87Å; T144-R163 VanDerWaalsContact OG1-CB 3.27Å; T144-R163 WeakPolarHBondContact OG1-CB 3.35Å; T144-R163 PolarHBondContact OG1-O 2.83Å; T144-K165 HydrophobicContact CG2-CD 3.72Å; T144-K165 HydrophobicContact CG2-CG 3.74Å; T144-E201 WeakPolarHBondContact CB-OE1 3.28Å; T144-E201 VanDerWaalsContact CB-OE2 3.24Å; T144-E201 WeakPolarHBondContact CB-OE2 3.47Å; T144-E201 WeakPolarHBondContact CG2-OE1 3.36Å; T144-E201 PolarHBondContact OG1-OE2 3.49Å
145	K	59.5	Low	58.7	Low	69 Å²	69	71.7 Å²	71.7	30%	0.3	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.4	158	-175.3	-166.3	179.7	-155	0	107.8	E161 C162 R163	K145-E161 VanDerWaalsContact CD-OE1 3.3Å; K145-E161 WeakPolarHBondContact CD-OE1 3.28Å; K145-E161 WeakPolarHBondContact CE-O 3.44Å; K145-E161 VanDerWaalsContact NZ-CD 3.31Å; K145-E161 PolarHBondContact NZ-O 2.85Å; K145-E161 IonicContact NZ-OE1 3.05Å; K145-E161 PolarHBondContact NZ-OE1 2.89Å; K145-C162 VanDerWaalsContact O-CA 3.32Å; K145-C162 WeakPolarHBondContact O-CA 3.41Å; K145-C162 VanDerWaalsContact O-CB 3.23Å; K145-C162 WeakPolarHBondContact O-CB 3.48Å; K145-R163 HydrophobicContact CB-CB 3.81Å; K145-R163 HydrophobicContact CB-CG 3.87Å; K145-R163 HydrophobicContact CD-CG 4.33Å; K145-R163 PolarHBondContact N-O 3.15Å; K145-R163 PolarHBondContact O-N 3.01Å
146	M	59.6	Low	59.7	Low	110 Å²	110	68.8 Å²	68.8	54%	0.542	39%	0.392	S	S	.	.			trans	-83.5	162.7	174.1	-62.6	-172.4	89	0	0	110.8	F143 S232	F143-M146 HydrophobicContact CB-CG 4.04Å; M146-S232 WeakPolarHBondContact CA-OG 3.19Å; M146-S232 WeakPolarHBondContact CB-OG 3.38Å
147	L	61.8	Low	60.6	Low	13 Å²	13	68.8 Å²	68.8	7%	0.068	39%	0.386	C	S	.	.			trans	-61.3	159.3	168.2	-57.2	-175.8	0	0	0	111.1	F160 C162 W174 C221 S232 A234	L147-F160 HydrophobicContact CD2-CB 4.23Å; L147-C162 HydrophobicContact CD2-CB 3.66Å; L147-C162 HydrophobicContact CG-CB 4.34Å; L147-W174 HydrophobicContact CD1-CH2 4.37Å; L147-W174 HydrophobicContact CD1-CZ3 3.75Å; L147-W174 HydrophobicContact CD2-CH2 3.47Å; L147-W174 VanDerWaalsContact CD2-CH2 3.47Å; L147-W174 HydrophobicContact CD2-CZ3 3.68Å; L147-W174 HydrophobicContact CG-CZ3 4.38Å; L147-C221 HydrophobicContact CD1-CB 3.88Å; L147-C221 HydrophobicContact CD2-CB 4.4Å; L147-C221 HydrophobicContact CG-CB 4.3Å; L147-S232 WeakPolarHBondContact CD1-O 3.49Å; L147-S232 PolarHBondContact N-OG 3.07Å; L147-A234 HydrophobicContact CB-CB 3.62Å; L147-A234 HydrophobicContact CD1-CB 4.39Å
148	Q	57.3	Low	61.3	Low	133 Å²	133	63 Å²	63	62%	0.621	36%	0.356	S	S	*	.			trans	-135.3	143.2	179.8	-60.6	-178.5	5.2	0	0	108.6	F160 A234	Q148-F160 WeakPolarHBondContact O-CE1 3.49Å; Q148-A234 VanDerWaalsContact C-CB 3.46Å; Q148-A234 VanDerWaalsContact O-CB 3.25Å; Q148-A234 WeakPolarHBondContact O-CB 3.27Å
149	N	61.6	Low	61.8	Low	106 Å²	106	61.2 Å²	61.2	57%	0.567	35%	0.35	S	S	*	.			trans	-62.3	139.2	178.2	-66.6	-2.6	0	0	0	110.6	A234 Q235	N149-A234 WeakPolarHBondContact OD1-CA 3.44Å; N149-Q235 CarbonylContact C-O 3.49Å; N149-Q235 VanDerWaalsContact CA-O 3.28Å; N149-Q235 WeakPolarHBondContact CA-O 3.43Å; N149-Q235 PolarHBondContact OD1-N 2.8Å
150	L	55.5	Low	62.1	Low	56 Å²	56	59.5 Å²	59.5	29%	0.293	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	154.2	-179.1	-63	179.3	0	0	0	110.6	V158 V159 F160 Q235 L236 H237	L150-V158 HydrophobicContact CD1-CG1 3.64Å; L150-V159 WeakPolarHBondContact CD1-O 3.4Å; L150-F160 HydrophobicContact CB-CE1 4.24Å; L150-F160 HydrophobicContact CB-CZ 4.3Å; L150-F160 HydrophobicContact CD1-CD1 3.7Å; L150-F160 HydrophobicContact CD1-CD2 4.47Å; L150-F160 HydrophobicContact CD1-CE1 3.59Å; L150-F160 HydrophobicContact CD1-CE2 4.38Å; L150-F160 HydrophobicContact CD1-CG 4.15Å; L150-F160 HydrophobicContact CD1-CZ 3.96Å; L150-F160 HydrophobicContact CG-CD1 4.23Å; L150-F160 HydrophobicContact CG-CE1 3.76Å; L150-F160 HydrophobicContact CG-CZ 4.25Å; L150-Q235 PolarHBondContact N-O 3.35Å; L150-L236 HydrophobicContact CB-CD1 4.07Å; L150-H237 PolarHBondContact O-N 2.67Å
151	S	63.9	Low	63.5	Low	84 Å²	84	60.2 Å²	60.2	59%	0.587	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	135.7	170.3	-60	0	0	0	0	109	H237	S151-H237 VanDerWaalsContact CA-O 3.27Å; S151-H237 WeakPolarHBondContact CA-O 3.26Å
152	A	62.8	Low	63.2	Low	9 Å²	9	60.1 Å²	60.1	7%	0.074	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161	-172.5	0	0	0	0	0	110.1	Q156 V158 V211 L236 H237 V238 R239	A152-Q156 HydrophobicContact CB-CB 4.33Å; A152-V158 HydrophobicContact CB-CG2 3.61Å; A152-V211 HydrophobicContact CB-CG2 3.82Å; A152-L236 HydrophobicContact CB-CD1 4.42Å; A152-H237 PolarHBondContact N-O 2.88Å; A152-H237 VanDerWaalsContact N-O 3.07Å; A152-V238 CarbonylContact O-C 3.49Å; A152-V238 WeakPolarHBondContact O-CA 3.47Å; A152-R239 PolarHBondContact O-N 3.15Å
153	S	66.4	Low	64	Low	59 Å²	59	60.4 Å²	60.4	41%	0.413	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	157.3	163.7	-64.7	0	0	0	0	110.4	Q156	S153-Q156 WeakPolarHBondContact O-CB 3.25Å; S153-Q156 WeakPolarHBondContact O-CG 3.44Å; S153-Q156 PolarHBondContact O-N 2.82Å
154	E	75	Confident	64.5	Low	81 Å²	81	59.2 Å²	59.2	38%	0.379	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	136	172.3	-151.9	175	173.1	0	0	112	V211 F212 V238 R239 G240 N241	E154-V211 CarbonylContact C-O 3.59Å; E154-V211 WeakPolarHBondContact CA-O 3.37Å; E154-F212 HydrophobicContact CG-CD1 4.31Å; E154-V238 HydrophobicContact CB-CG1 4.42Å; E154-R239 PolarHBondContact N-O 2.75Å; E154-G240 VanDerWaalsContact OE2-CA 3.3Å; E154-G240 WeakPolarHBondContact OE2-CA 3.36Å; E154-N241 PolarHBondContact OE2-N 2.81Å
155	G	59.7	Low	65.1	Low	40 Å²	40	60.6 Å²	60.6	41%	0.412	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	6.5	-177.6	0	0	0	0	0	116	V211	G155-V211 PolarHBondContact N-O 2.82Å
156	Q	55	Low	65.6	Low	98 Å²	98	58.2 Å²	58.2	46%	0.458	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	145.7	177.7	-67.8	-169.4	-41.5	0	0	113.4	A152 S153 V211	A152-Q156 HydrophobicContact CB-CB 4.33Å; S153-Q156 WeakPolarHBondContact O-CB 3.25Å; S153-Q156 WeakPolarHBondContact O-CG 3.44Å; S153-Q156 PolarHBondContact O-N 2.82Å; Q156-V211 WeakPolarHBondContact O-CG2 3.36Å; Q156-V211 PolarHBondContact O-N 2.98Å
157	L	60.4	Low	65.9	Low	112 Å²	112	54.2 Å²	54.2	59%	0.586	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	128.6	169.2	-178.2	140.3	0	0	0	110.6	V159 V207 I208 A209	L157-V159 HydrophobicContact CD2-CG2 3.59Å; L157-V207 HydrophobicContact CD1-CG1 3.89Å; L157-V207 HydrophobicContact CD2-CG1 4.1Å; L157-V207 HydrophobicContact CG-CG1 3.94Å; L157-I208 WeakPolarHBondContact CA-O 3.42Å; L157-A209 VanDerWaalsContact CA-O 3.3Å; L157-A209 WeakPolarHBondContact CA-O 3.29Å; L157-A209 VanDerWaalsContact CB-O 3.31Å; L157-A209 WeakPolarHBondContact CB-O 3.46Å
158	V	64.4	Low	66.3	Low	9 Å²	9	56.4 Å²	56.4	6%	0.055	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	134.6	-175.9	169.5	0	0	0	0	110.6	L150 A152 F160 V207 I208 V211 L236	L150-V158 HydrophobicContact CD1-CG1 3.64Å; A152-V158 HydrophobicContact CB-CG2 3.61Å; V158-F160 HydrophobicContact CG1-CD2 4.35Å; V158-F160 HydrophobicContact CG1-CE2 4.08Å; V158-V207 CarbonylContact O-C 3.39Å; V158-V207 WeakPolarHBondContact O-CA 3.41Å; V158-I208 HydrophobicContact CB-CB 4.37Å; V158-I208 HydrophobicContact CB-CD1 4.36Å; V158-I208 HydrophobicContact CG1-CD1 4.22Å; V158-I208 PolarHBondContact N-O 3.09Å; V158-I208 PolarHBondContact O-N 3.29Å; V158-V211 HydrophobicContact CB-CG1 3.74Å; V158-V211 HydrophobicContact CG2-CB 4.39Å; V158-V211 HydrophobicContact CG2-CG1 3.52Å; V158-V211 HydrophobicContact CG2-CG2 3.93Å; V158-L236 HydrophobicContact CG1-CD1 4.07Å; V158-L236 HydrophobicContact CG1-CD2 4.36Å; V158-L236 HydrophobicContact CG2-CD1 4.28Å
159	V	68.8	Low	66.9	Low	68 Å²	68	53.2 Å²	53.2	41%	0.412	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	111.5	-175.5	-174.6	0	0	0	0	111.4	L150 L157 T205 V207	L150-V159 WeakPolarHBondContact CD1-O 3.4Å; L157-V159 HydrophobicContact CD2-CG2 3.59Å; V159-T205 HydrophobicContact CG1-CG2 3.45Å; V159-T205 VanDerWaalsContact CG1-CG2 3.45Å; V159-V207 HydrophobicContact CG1-CG2 4.27Å; V159-V207 HydrophobicContact CG2-CG1 4.25Å; V159-V207 HydrophobicContact CG2-CG2 4.21Å
160	F	62.9	Low	67.5	Low	3 Å²	3	48.3 Å²	48.3	1%	0.013	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.1	168.7	-74.8	-70.4	0	0	0	109.8	L147 Q148 L150 V158 W174 T205 L206 I208 F219 A234 L236	L147-F160 HydrophobicContact CD2-CB 4.23Å; Q148-F160 WeakPolarHBondContact O-CE1 3.49Å; L150-F160 HydrophobicContact CB-CE1 4.24Å; L150-F160 HydrophobicContact CB-CZ 4.3Å; L150-F160 HydrophobicContact CD1-CD1 3.7Å; L150-F160 HydrophobicContact CD1-CD2 4.47Å; L150-F160 HydrophobicContact CD1-CE1 3.59Å; L150-F160 HydrophobicContact CD1-CE2 4.38Å; L150-F160 HydrophobicContact CD1-CG 4.15Å; L150-F160 HydrophobicContact CD1-CZ 3.96Å; L150-F160 HydrophobicContact CG-CD1 4.23Å; L150-F160 HydrophobicContact CG-CE1 3.76Å; L150-F160 HydrophobicContact CG-CZ 4.25Å; V158-F160 HydrophobicContact CG1-CD2 4.35Å; V158-F160 HydrophobicContact CG1-CE2 4.08Å; F160-W174 HydrophobicContact CB-CH2 3.73Å; F160-W174 HydrophobicContact CB-CZ3 3.67Å; F160-W174 HydrophobicContact CG-CZ3 4.45Å; F160-W174 WeakPolarHBondContact O-CH2 3.37Å; F160-T205 CarbonylContact O-C 3.47Å; F160-T205 VanDerWaalsContact O-CA 3.28Å; F160-T205 WeakPolarHBondContact O-CA 3.42Å; F160-L206 HydrophobicContact CB-CB 4.29Å; F160-L206 HydrophobicContact CD2-CD2 4.38Å; F160-L206 PolarHBondContact N-O 2.84Å; F160-L206 PolarHBondContact O-N 2.73Å; F160-I208 HydrophobicContact CD2-CD1 4.42Å; F160-I208 HydrophobicContact CE2-CD1 4.12Å; F160-F219 HydrophobicContact CD2-CB 4.4Å; F160-F219 HydrophobicContact CD2-CD1 4.5Å; F160-F219 HydrophobicContact CD2-CG 4.28Å; F160-F219 HydrophobicContact CE2-CB 4.03Å; F160-F219 HydrophobicContact CE2-CD1 4.23Å; F160-F219 AromaticContact CE2-CD2 3.72Å; F160-F219 HydrophobicContact CE2-CD2 3.72Å; F160-F219 HydrophobicContact CE2-CE2 4.24Å; F160-F219 AromaticContact CE2-CG 3.71Å; F160-F219 HydrophobicContact CE2-CG 3.71Å; F160-F219 HydrophobicContact CZ-CB 4.2Å; F160-F219 HydrophobicContact CZ-CD2 4.01Å; F160-F219 HydrophobicContact CZ-CG 4.2Å; F160-A234 HydrophobicContact CD1-CB 4.16Å; F160-A234 HydrophobicContact CE1-CB 3.64Å; F160-L236 HydrophobicContact CE2-CB 4.35Å; F160-L236 HydrophobicContact CZ-CB 4.01Å
161	E	82.4	Confident	68.6	Low	58 Å²	58	51.6 Å²	51.6	27%	0.271	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.3	175.2	-174.2	-148.8	94.3	0	0	111.6	K145 R163 I203 C204	K145-E161 VanDerWaalsContact CD-OE1 3.3Å; K145-E161 WeakPolarHBondContact CD-OE1 3.28Å; K145-E161 WeakPolarHBondContact CE-O 3.44Å; K145-E161 VanDerWaalsContact NZ-CD 3.31Å; K145-E161 PolarHBondContact NZ-O 2.85Å; K145-E161 IonicContact NZ-OE1 3.05Å; K145-E161 PolarHBondContact NZ-OE1 2.89Å; E161-R163 IonicContact OE1-NE 3.41Å; E161-I203 HydrophobicContact CG-CG2 3.64Å; E161-C204 WeakPolarHBondContact CA-O 3.31Å
162	C	65.1	Low	69.4	Low	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	168.1	165.6	55.4	0	0	0	0	111.3	F143 K145 L147 C204 C221	F143-C162 HydrophobicContact CD1-CB 3.97Å; F143-C162 HydrophobicContact CE1-CB 3.96Å; K145-C162 VanDerWaalsContact O-CA 3.32Å; K145-C162 WeakPolarHBondContact O-CA 3.41Å; K145-C162 VanDerWaalsContact O-CB 3.23Å; K145-C162 WeakPolarHBondContact O-CB 3.48Å; L147-C162 HydrophobicContact CD2-CB 3.66Å; L147-C162 HydrophobicContact CG-CB 4.34Å; C162-C204 PolarHBondContact N-O 2.97Å; C162-C204 PolarHBondContact O-N 2.95Å; C162-C221 PolarHBondContact SG-SG 2.88Å
163	R	77.8	Confident	70	Confident	83 Å²	83	50 Å²	50	31%	0.313	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137	173.9	-62.2	-177.3	-176.6	-159.8	-0.8	109.8	F143 T144 K145 E161 E202 I203	F143-R163 CarbonylContact C-O 3.56Å; F143-R163 VanDerWaalsContact CA-O 3.32Å; F143-R163 WeakPolarHBondContact CA-O 3.39Å; F143-R163 WeakPolarHBondContact CD1-O 3.47Å; T144-R163 PolarHBondContact N-O 2.87Å; T144-R163 VanDerWaalsContact OG1-CB 3.27Å; T144-R163 WeakPolarHBondContact OG1-CB 3.35Å; T144-R163 PolarHBondContact OG1-O 2.83Å; K145-R163 HydrophobicContact CB-CB 3.81Å; K145-R163 HydrophobicContact CB-CG 3.87Å; K145-R163 HydrophobicContact CD-CG 4.33Å; K145-R163 PolarHBondContact N-O 3.15Å; K145-R163 PolarHBondContact O-N 3.01Å; E161-R163 IonicContact OE1-NE 3.41Å; R163-E202 WeakPolarHBondContact CA-O 3.36Å; R163-I203 HydrophobicContact CG-CG1 4.29Å
164	V	73.7	Confident	70.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.3	-176.8	65.9	0	0	0	0	110.9	P141 V142 F143 P170 V172 E202 A223	P141-V164 HydrophobicContact CB-CG2 4.07Å; V142-V164 WeakPolarHBondContact O-CA 3.3Å; V142-V164 WeakPolarHBondContact O-CG2 3.5Å; F143-V164 HydrophobicContact CD1-CB 4.05Å; F143-V164 HydrophobicContact CD1-CG2 4.45Å; F143-V164 HydrophobicContact CE1-CB 4.11Å; F143-V164 HydrophobicContact CE1-CG2 4.5Å; V164-P170 HydrophobicContact CG1-CG 3.74Å; V164-P170 HydrophobicContact CG2-CG 4.07Å; V164-V172 HydrophobicContact CG1-CG2 4.24Å; V164-E202 HydrophobicContact CG1-CB 4.24Å; V164-E202 PolarHBondContact N-O 3.14Å; V164-E202 PolarHBondContact O-N 3.42Å; V164-A223 HydrophobicContact CB-CB 4.45Å; V164-A223 HydrophobicContact CG1-CB 4.45Å; V164-A223 HydrophobicContact CG2-CB 3.76Å
165	K	74	Confident	70.1	Confident	81 Å²	81	46.1 Å²	46.1	35%	0.352	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	142.5	168.5	60.4	-173.5	161.4	-138.9	0	110.7	P141 V142 T144 P200 E201	P141-K165 CarbonylContact C-O 3.51Å; P141-K165 VanDerWaalsContact CA-O 3.3Å; P141-K165 WeakPolarHBondContact CA-O 3.27Å; V142-K165 PolarHBondContact N-O 2.82Å; V142-K165 PolarHBondContact O-N 2.77Å; T144-K165 HydrophobicContact CG2-CD 3.72Å; T144-K165 HydrophobicContact CG2-CG 3.74Å; K165-P200 VanDerWaalsContact CB-O 3.32Å; K165-P200 WeakPolarHBondContact CB-O 3.48Å; K165-E201 HydrophobicContact CB-CG 4.36Å; K165-E201 HydrophobicContact CD-CG 4.45Å; K165-E201 IonicContact NZ-OE1 2.9Å; K165-E201 PolarHBondContact NZ-OE1 3.37Å
166	G	68.8	Low	70.9	Confident	19 Å²	19	47.2 Å²	47.2	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	151.9	178.9	0	0	0	0	0	110.4	P168	G166-P168 CarbonylContact C-O 3.47Å; G166-P168 VanDerWaalsContact C-O 3.23Å; G166-P168 CarbonylContact O-C 3.53Å
167	A	65.8	Low	71.5	Confident	27 Å²	27	48.4 Å²	48.4	22%	0.223	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	106.6	-179	0	0	0	0	0	110.1	I137 A139 Y227	I137-A167 WeakPolarHBondContact O-CB 3.22Å; A139-A167 HydrophobicContact CB-CB 4.09Å; A139-A167 PolarHBondContact N-O 2.96Å; A139-A167 CarbonylContact O-C 3.53Å; A139-A167 PolarHBondContact O-N 3.19Å; A139-A167 VanDerWaalsContact O-O 3.11Å; A167-Y227 WeakPolarHBondContact O-CD2 3.44Å
168	P	70.2	Confident	71	Confident	59 Å²	59	46.2 Å²	46.2	38%	0.383	25%	0.25	S	S	.	.	S	Bend	cis	-68.7	165.9	4.8	32.3	-38.5	0	0	0	113.6	G166 N225 K226	G166-P168 CarbonylContact C-O 3.47Å; G166-P168 VanDerWaalsContact C-O 3.23Å; G166-P168 CarbonylContact O-C 3.53Å; P168-N225 HydrophobicContact CG-CB 4.4Å; P168-N225 PolarHBondContact O-ND2 3.08Å; P168-K226 HydrophobicContact CG-CG 4.08Å
169	S	71.7	Confident	70.5	Confident	65 Å²	65	50.6 Å²	50.6	46%	0.455	28%	0.277	S	S	.	.			trans	-43	131.3	172.3	-69.7	0	0	0	0	111.7	E202	S169-E202 WeakPolarHBondContact CB-OE1 3.4Å; S169-E202 PolarHBondContact OG-OE1 3.49Å
170	P	73.1	Confident	70.1	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.026	28%	0.276	C	S	.	.			trans	-74.4	147.1	179.9	29.7	-32.7	0	0	0	112.4	P141 V164 V172 Q191 A223 S224	P141-P170 HydrophobicContact CB-CB 4.09Å; V164-P170 HydrophobicContact CG1-CG 3.74Å; V164-P170 HydrophobicContact CG2-CG 4.07Å; P170-V172 HydrophobicContact CG-CG2 4.34Å; P170-Q191 PolarHBondContact O-NE2 2.84Å; P170-A223 HydrophobicContact CB-CB 4.13Å; P170-A223 HydrophobicContact CG-CB 4.44Å; P170-S224 CarbonylContact C-O 3.55Å; P170-S224 WeakPolarHBondContact CA-O 3.37Å; P170-S224 WeakPolarHBondContact CB-O 3.24Å
171	K	79.6	Confident	70.6	Confident	125 Å²	125	51.6 Å²	51.6	54%	0.543	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	135.5	156.9	-170.7	-167.5	-178.5	-166	0	107.4	E173 A223 S224	K171-E173 HydrophobicContact CD-CG 4.2Å; K171-E173 VanDerWaalsContact CE-OE1 3.29Å; K171-E173 WeakPolarHBondContact CE-OE1 3.39Å; K171-E173 HydrophobicContact CG-CG 4.42Å; K171-E173 IonicContact NZ-OE1 2.82Å; K171-E173 PolarHBondContact NZ-OE1 2.84Å; K171-A223 WeakPolarHBondContact O-CA 3.39Å; K171-S224 PolarHBondContact N-O 2.92Å; K171-S224 PolarHBondContact O-N 3.27Å
172	V	80.6	Confident	69.7	Low	15 Å²	15	55.8 Å²	55.8	9%	0.091	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.4	179	179.8	0	0	0	0	110.2	V164 P170 C204 C221 T222 A223	V164-V172 HydrophobicContact CG1-CG2 4.24Å; P170-V172 HydrophobicContact CG-CG2 4.34Å; V172-C204 HydrophobicContact CG1-CB 4.1Å; V172-C221 WeakPolarHBondContact CG1-SG 3.23Å; V172-T222 WeakPolarHBondContact CA-O 3.16Å; V172-A223 HydrophobicContact CG2-CB 4.01Å
173	E	75.4	Confident	69.5	Low	44 Å²	44	58.7 Å²	58.7	21%	0.206	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.5	-171.7	-67.6	170.6	134.5	0	0	108.5	K171 Y175 L180 T222	K171-E173 HydrophobicContact CD-CG 4.2Å; K171-E173 VanDerWaalsContact CE-OE1 3.29Å; K171-E173 WeakPolarHBondContact CE-OE1 3.39Å; K171-E173 HydrophobicContact CG-CG 4.42Å; K171-E173 IonicContact NZ-OE1 2.82Å; K171-E173 PolarHBondContact NZ-OE1 2.84Å; E173-Y175 HydrophobicContact CB-CE2 3.83Å; E173-L180 HydrophobicContact CB-CD1 4.05Å; E173-T222 PolarHBondContact N-O 3.23Å; E173-T222 PolarHBondContact O-N 3.19Å
174	W	76.8	Confident	68.6	Low	1 Å²	1	55.7 Å²	55.7	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	150.4	-178.7	-70	83.9	0	0	0	111	L147 F160 L180 I181 I189 C204 L206 T220 C221	L147-W174 HydrophobicContact CD1-CH2 4.37Å; L147-W174 HydrophobicContact CD1-CZ3 3.75Å; L147-W174 HydrophobicContact CD2-CH2 3.47Å; L147-W174 VanDerWaalsContact CD2-CH2 3.47Å; L147-W174 HydrophobicContact CD2-CZ3 3.68Å; L147-W174 HydrophobicContact CG-CZ3 4.38Å; F160-W174 HydrophobicContact CB-CH2 3.73Å; F160-W174 HydrophobicContact CB-CZ3 3.67Å; F160-W174 HydrophobicContact CG-CZ3 4.45Å; F160-W174 WeakPolarHBondContact O-CH2 3.37Å; W174-L180 WeakPolarHBondContact O-CD1 3.47Å; W174-I181 HydrophobicContact CB-CB 4.17Å; W174-I181 HydrophobicContact CB-CD1 4.24Å; W174-I181 PolarHBondContact O-N 3.24Å; W174-I189 HydrophobicContact CB-CD1 4.09Å; W174-I189 HydrophobicContact CG-CD1 4.35Å; W174-I189 HydrophobicContact CG-CG1 4.43Å; W174-C204 HydrophobicContact CZ2-CB 4.5Å; W174-L206 HydrophobicContact CB-CD2 4.5Å; W174-L206 HydrophobicContact CD2-CB 3.61Å; W174-L206 HydrophobicContact CD2-CD2 4.12Å; W174-L206 HydrophobicContact CD2-CG 4.41Å; W174-L206 HydrophobicContact CE3-CB 3.58Å; W174-L206 HydrophobicContact CE3-CD2 3.61Å; W174-L206 HydrophobicContact CE3-CG 4.23Å; W174-L206 HydrophobicContact CG-CB 4.27Å; W174-L206 HydrophobicContact CH2-CB 3.71Å; W174-L206 HydrophobicContact CZ2-CB 3.78Å; W174-L206 HydrophobicContact CZ3-CB 3.62Å; W174-L206 HydrophobicContact CZ3-CD2 4.08Å; W174-T220 CarbonylContact C-O 3.54Å; W174-T220 VanDerWaalsContact CA-O 3.32Å; W174-T220 WeakPolarHBondContact CA-O 3.35Å; W174-C221 HydrophobicContact CD2-CB 3.9Å; W174-C221 HydrophobicContact CE3-CB 3.75Å; W174-C221 HydrophobicContact CH2-CB 3.97Å; W174-C221 HydrophobicContact CZ2-CB 4.06Å; W174-C221 HydrophobicContact CZ3-CB 3.8Å
175	Y	66.4	Low	67.5	Low	57 Å²	57	59 Å²	59	22%	0.224	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.5	-177.3	-57	-103.5	0	0	0	111.3	E173 T179 L180 F219 T220	E173-Y175 HydrophobicContact CB-CE2 3.83Å; Y175-T179 CarbonylContact C-O 3.37Å; Y175-T179 WeakPolarHBondContact CA-O 3.37Å; Y175-T179 WeakPolarHBondContact CB-O 3.4Å; Y175-L180 HydrophobicContact CD1-CB 4.15Å; Y175-L180 HydrophobicContact CD1-CD1 4.17Å; Y175-L180 HydrophobicContact CE1-CB 4.03Å; Y175-L180 HydrophobicContact CE1-CD1 3.65Å; Y175-L180 HydrophobicContact CE1-CG 4.47Å; Y175-L180 HydrophobicContact CE2-CD1 4.1Å; Y175-F219 CarbonylContact O-C 3.59Å; Y175-F219 VanDerWaalsContact O-CA 3.31Å; Y175-F219 WeakPolarHBondContact O-CA 3.47Å; Y175-T220 PolarHBondContact N-O 2.87Å; Y175-T220 PolarHBondContact O-N 2.81Å
176	R	76.2	Confident	66.3	Low	63 Å²	63	59.6 Å²	59.6	24%	0.238	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.8	168.8	168.8	176.6	164.9	-169.4	1.8	108.7	G178 T179 I181 F187 E214 D215 C218 F219	R176-G178 PolarHBondContact O-N 2.84Å; R176-G178 VanDerWaalsContact O-N 3.11Å; R176-T179 PolarHBondContact N-O 3.26Å; R176-T179 WeakPolarHBondContact O-CB 3.42Å; R176-T179 PolarHBondContact O-N 2.66Å; R176-I181 HydrophobicContact CB-CD1 3.94Å; R176-I181 HydrophobicContact CB-CG1 4.12Å; R176-F187 VanDerWaalsContact NH1-CZ 3.3Å; R176-E214 VanDerWaalsContact NH2-C 3.27Å; R176-E214 PolarHBondContact NH2-O 2.89Å; R176-D215 IonicContact CZ-OD1 3.81Å; R176-D215 IonicContact NH1-OD1 3.79Å; R176-D215 PolarHBondContact NH1-OD1 2.96Å; R176-D215 IonicContact NH2-OD1 3.71Å; R176-D215 PolarHBondContact NH2-OD1 2.92Å; R176-C218 WeakPolarHBondContact CA-O 3.09Å; R176-F219 HydrophobicContact CB-CD1 4.3Å; R176-F219 HydrophobicContact CB-CE1 4.08Å; R176-F219 HydrophobicContact CB-CZ 4.46Å; R176-F219 HydrophobicContact CG-CE1 4.37Å; R176-F219 HydrophobicContact CG-CZ 4.25Å
177	E	67.3	Low	66.1	Low	124 Å²	124	60.2 Å²	60.2	58%	0.579	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	39.3	-175.3	-59.9	-59.9	162.6	0	0	113.3	T179 G217 C218	E177-T179 VanDerWaalsContact C-N 3.27Å; E177-T179 PolarHBondContact O-N 2.9Å; E177-G217 VanDerWaalsContact OE1-CA 3.25Å; E177-G217 WeakPolarHBondContact OE1-CA 3.4Å; E177-C218 PolarHBondContact N-O 2.84Å; E177-C218 WeakPolarHBondContact OE1-CB 3.39Å; E177-C218 PolarHBondContact OE1-N 2.75Å
178	G	49.3	Very low	65.7	Low	65 Å²	65	64 Å²	64	67%	0.67	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	-6	-177.9	0	0	0	0	0	116	R176	R176-G178 PolarHBondContact O-N 2.84Å; R176-G178 VanDerWaalsContact O-N 3.11Å
179	T	54.1	Low	65.9	Low	101 Å²	101	63.1 Å²	63.1	62%	0.62	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	133.1	174.1	-53.6	0	0	0	0	109.8	Y175 R176 E177 I181	Y175-T179 CarbonylContact C-O 3.37Å; Y175-T179 WeakPolarHBondContact CA-O 3.37Å; Y175-T179 WeakPolarHBondContact CB-O 3.4Å; R176-T179 PolarHBondContact N-O 3.26Å; R176-T179 WeakPolarHBondContact O-CB 3.42Å; R176-T179 PolarHBondContact O-N 2.66Å; E177-T179 VanDerWaalsContact C-N 3.27Å; E177-T179 PolarHBondContact O-N 2.9Å; T179-I181 PolarHBondContact O-N 2.89Å
180	L	61.7	Low	65.6	Low	75 Å²	75	64.9 Å²	64.9	39%	0.393	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	133.2	177.2	-174.8	74.9	0	0	0	110.2	E173 W174 Y175 E182	E173-L180 HydrophobicContact CB-CD1 4.05Å; W174-L180 WeakPolarHBondContact O-CD1 3.47Å; Y175-L180 HydrophobicContact CD1-CB 4.15Å; Y175-L180 HydrophobicContact CD1-CD1 4.17Å; Y175-L180 HydrophobicContact CE1-CB 4.03Å; Y175-L180 HydrophobicContact CE1-CD1 3.65Å; Y175-L180 HydrophobicContact CE1-CG 4.47Å; Y175-L180 HydrophobicContact CE2-CD1 4.1Å; L180-E182 HydrophobicContact CD2-CG 4.3Å
181	I	71.9	Confident	65.5	Low	18 Å²	18	68.3 Å²	68.3	9%	0.092	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.7	170.9	-57.5	172.4	0	0	0	107.5	W174 R176 T179 F187 I189 L206 F219	W174-I181 HydrophobicContact CB-CB 4.17Å; W174-I181 HydrophobicContact CB-CD1 4.24Å; W174-I181 PolarHBondContact O-N 3.24Å; R176-I181 HydrophobicContact CB-CD1 3.94Å; R176-I181 HydrophobicContact CB-CG1 4.12Å; T179-I181 PolarHBondContact O-N 2.89Å; I181-F187 HydrophobicContact CG2-CB 3.47Å; I181-F187 VanDerWaalsContact CG2-CB 3.47Å; I181-F187 HydrophobicContact CG2-CD1 4.26Å; I181-F187 HydrophobicContact CG2-CG 3.9Å; I181-I189 HydrophobicContact CB-CD1 4.43Å; I181-I189 HydrophobicContact CG2-CD1 4.13Å; I181-I189 VanDerWaalsContact O-CD1 3.29Å; I181-I189 WeakPolarHBondContact O-CD1 3.44Å; I181-L206 HydrophobicContact CD1-CD2 3.74Å; I181-L206 HydrophobicContact CG2-CD1 4.23Å; I181-F219 HydrophobicContact CD1-CD1 3.72Å; I181-F219 HydrophobicContact CD1-CE1 3.78Å
182	E	64.1	Low	65.2	Low	145 Å²	145	67.2 Å²	67.2	68%	0.678	35%	0.348	S	S	*	.			trans	-105	154.9	173.9	-60.1	-171.1	162.1	0	0	110.5	L180 S184	L180-E182 HydrophobicContact CD2-CG 4.3Å; E182-S184 PolarHBondContact O-N 2.96Å; E182-S184 PolarHBondContact O-OG 3.25Å
183	D	60.5	Low	64.5	Low	61 Å²	61	73.9 Å²	73.9	33%	0.326	38%	0.375	S	S	.	.			trans	-64.9	121.2	-178.5	-168.9	82.1	0	0	0	111.3	R188 I189 R303	D183-R188 WeakPolarHBondContact OD1-CA 3.25Å; D183-R188 IonicContact OD2-CZ 3.86Å; D183-R188 IonicContact OD2-NH1 2.77Å; D183-R188 PolarHBondContact OD2-NH1 3.16Å; D183-I189 PolarHBondContact OD1-N 2.85Å; D183-R303 PolarHBondContact O-NH1 2.83Å; D183-R303 VanDerWaalsContact O-NH1 3.15Å; D183-R303 PolarHBondContact O-NH2 2.91Å
184	S	60	Low	63.7	Low	20 Å²	20	74.2 Å²	74.2	14%	0.14	38%	0.381	C	S	.	.			trans	-145	164.9	-170.2	52.4	0	0	0	0	109.8	E182 D186 F187 R188	E182-S184 PolarHBondContact O-N 2.96Å; E182-S184 PolarHBondContact O-OG 3.25Å; S184-D186 PolarHBondContact O-N 3.29Å; S184-F187 PolarHBondContact N-O 3.06Å; S184-F187 CarbonylContact O-C 3.46Å; S184-F187 PolarHBondContact O-N 2.98Å; S184-F187 WeakPolarHBondContact OG-CB 3.34Å; S184-F187 PolarHBondContact OG-N 2.69Å; S184-F187 VanDerWaalsContact OG-N 3.08Å; S184-F187 PolarHBondContact OG-O 2.89Å; S184-R188 WeakPolarHBondContact O-CD 3.23Å; S184-R188 PolarHBondContact O-NE 2.91Å
185	P	50.7	Low	62.5	Low	70 Å²	70	84.3 Å²	84.3	46%	0.455	42%	0.42	S	S	.	.	S	Bend	trans	-52.9	-41.2	174.7	-26	36.4	0	0	0	112.2
186	D	47.7	Very low	61.8	Low	94 Å²	94	84.8 Å²	84.8	50%	0.503	43%	0.431	S	S	.	.	S	Bend	trans	-84	-35.7	-172.8	-35.7	-64.8	0	0	0	111.9	S184 I208 A209	S184-D186 PolarHBondContact O-N 3.29Å; D186-I208 CarbonylContact O-C 3.55Å; D186-I208 VanDerWaalsContact O-CA 3.25Å; D186-I208 WeakPolarHBondContact O-CA 3.1Å; D186-A209 PolarHBondContact O-N 3.03Å
187	F	65.9	Low	60.6	Low	31 Å²	31	90.8 Å²	90.8	14%	0.136	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	99.5	177.2	-60.8	-87.1	0	0	0	111.1	R176 I181 S184 L206 I208 F219	R176-F187 VanDerWaalsContact NH1-CZ 3.3Å; I181-F187 HydrophobicContact CG2-CB 3.47Å; I181-F187 VanDerWaalsContact CG2-CB 3.47Å; I181-F187 HydrophobicContact CG2-CD1 4.26Å; I181-F187 HydrophobicContact CG2-CG 3.9Å; S184-F187 PolarHBondContact N-O 3.06Å; S184-F187 CarbonylContact O-C 3.46Å; S184-F187 PolarHBondContact O-N 2.98Å; S184-F187 WeakPolarHBondContact OG-CB 3.34Å; S184-F187 PolarHBondContact OG-N 2.69Å; S184-F187 VanDerWaalsContact OG-N 3.08Å; S184-F187 PolarHBondContact OG-O 2.89Å; F187-L206 HydrophobicContact CB-CD1 4.04Å; F187-L206 HydrophobicContact CD1-CD1 4.32Å; F187-I208 HydrophobicContact CD1-CB 4.39Å; F187-I208 HydrophobicContact CD1-CD1 4.48Å; F187-I208 HydrophobicContact CD1-CG1 3.88Å; F187-I208 HydrophobicContact CD1-CG2 3.97Å; F187-I208 HydrophobicContact CE1-CB 4.25Å; F187-I208 HydrophobicContact CE1-CD1 4Å; F187-I208 HydrophobicContact CE1-CG1 3.81Å; F187-I208 HydrophobicContact CE1-CG2 3.52Å; F187-I208 HydrophobicContact CZ-CG2 3.94Å; F187-F219 HydrophobicContact CD1-CE1 4.32Å; F187-F219 AromaticContact CE1-CE1 3.9Å; F187-F219 HydrophobicContact CE1-CE1 3.9Å; F187-F219 HydrophobicContact CE1-CZ 4.1Å
188	R	57.5	Low	59.6	Low	106 Å²	106	88.8 Å²	88.8	40%	0.4	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.1	-179.7	-67.7	-67.2	-176.5	-177.4	3.8	112.4	D183 S184 L206 V207	D183-R188 WeakPolarHBondContact OD1-CA 3.25Å; D183-R188 IonicContact OD2-CZ 3.86Å; D183-R188 IonicContact OD2-NH1 2.77Å; D183-R188 PolarHBondContact OD2-NH1 3.16Å; S184-R188 WeakPolarHBondContact O-CD 3.23Å; S184-R188 PolarHBondContact O-NE 2.91Å; R188-L206 CarbonylContact O-C 3.5Å; R188-L206 WeakPolarHBondContact O-CA 3.27Å; R188-V207 HydrophobicContact CB-CB 4.29Å; R188-V207 PolarHBondContact N-O 3.07Å; R188-V207 PolarHBondContact O-N 2.95Å
189	I	72.4	Confident	59.8	Low	42 Å²	42	91.4 Å²	91.4	22%	0.215	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114.8	-177.7	-63.2	171.9	0	0	0	110	W174 I181 D183 L206	W174-I189 HydrophobicContact CB-CD1 4.09Å; W174-I189 HydrophobicContact CG-CD1 4.35Å; W174-I189 HydrophobicContact CG-CG1 4.43Å; I181-I189 HydrophobicContact CB-CD1 4.43Å; I181-I189 HydrophobicContact CG2-CD1 4.13Å; I181-I189 VanDerWaalsContact O-CD1 3.29Å; I181-I189 WeakPolarHBondContact O-CD1 3.44Å; D183-I189 PolarHBondContact OD1-N 2.85Å; I189-L206 HydrophobicContact CG1-CD1 3.92Å
190	L	66.8	Low	60	Low	102 Å²	102	89.8 Å²	89.8	53%	0.534	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.3	-179.3	-55.2	175.7	0	0	0	110.3	C204 T205	L190-C204 WeakPolarHBondContact O-CA 3.32Å; L190-T205 PolarHBondContact N-O 2.91Å; L190-T205 PolarHBondContact O-N 2.8Å
191	Q	71.4	Confident	60.2	Low	76 Å²	76	88.5 Å²	88.5	36%	0.355	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	109.8	171.6	-175.1	174.8	-1.2	0	0	110.3	P170 E202	P170-Q191 PolarHBondContact O-NE2 2.84Å; Q191-E202 PolarHBondContact NE2-OE2 3.04Å
192	K	73.4	Confident	60.3	Low	102 Å²	102	87.8 Å²	87.8	44%	0.443	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	104.7	-174.7	-169.7	174.6	-173.3	170.3	0	110.3	E202 I203	K192-E202 WeakPolarHBondContact O-CA 3.41Å; K192-I203 HydrophobicContact CB-CB 4.26Å; K192-I203 PolarHBondContact N-O 3.02Å; K192-I203 PolarHBondContact O-N 2.84Å; K192-I203 VanDerWaalsContact O-N 3.14Å
193	K	64.3	Low	60.9	Low	154 Å²	154	82.9 Å²	82.9	67%	0.67	42%	0.421	S	S	*	.			trans	-58.4	155.5	178	-72.1	-179.1	179.7	173.9	0	112.4	R195	K193-R195 PolarHBondContact O-N 2.83Å
194	P	59.2	Low	61.7	Low	52 Å²	52	80 Å²	80	34%	0.338	41%	0.405	S	S	.	.			trans	-73.1	132.7	-170.2	2.4	14	0	0	0	110.2	S196 E199 E202	P194-S196 VanDerWaalsContact C-N 3.32Å; P194-S196 PolarHBondContact O-N 3.31Å; P194-E199 WeakPolarHBondContact CB-O 3.37Å; P194-E202 HydrophobicContact CG-CG 3.74Å
195	R	51.5	Low	62.2	Low	213 Å²	213	80 Å²	80	80%	0.804	41%	0.405	S	S	*	.	S	Bend	trans	-77.4	-13.9	-171.9	-76.1	175.9	162.9	178.8	-10	114.4	K193	K193-R195 PolarHBondContact O-N 2.83Å
196	S	51.3	Low	63.3	Low	67 Å²	67	76.7 Å²	76.7	47%	0.469	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-162.1	155.8	-177.6	177.1	0	0	0	0	110.4	P194 A198 E199	P194-S196 VanDerWaalsContact C-N 3.32Å; P194-S196 PolarHBondContact O-N 3.31Å; S196-A198 PolarHBondContact O-N 3.25Å; S196-A198 VanDerWaalsContact O-N 3.09Å; S196-A198 PolarHBondContact OG-N 3.26Å; S196-E199 CarbonylContact O-C 3.42Å; S196-E199 PolarHBondContact O-N 2.87Å; S196-E199 VanDerWaalsContact O-N 3.07Å
197	M	50.8	Low	64.3	Low	188 Å²	188	73.5 Å²	73.5	93%	0.926	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.1	169.8	-70.5	-70.8	-70.4	0	0	113.5
198	A	46.3	Very low	64.8	Low	83 Å²	83	72.1 Å²	72.1	69%	0.686	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-22.7	176	0	0	0	0	0	114.1	S196 P200	S196-A198 PolarHBondContact O-N 3.25Å; S196-A198 VanDerWaalsContact O-N 3.09Å; S196-A198 PolarHBondContact OG-N 3.26Å; A198-P200 WeakPolarHBondContact O-CD 3.25Å
199	E	53.5	Low	64.6	Low	120 Å²	120	68.9 Å²	68.9	56%	0.561	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-123.7	78.7	-178.3	-75.7	-89.8	141.7	0	0	108	P194 S196 E201	P194-E199 WeakPolarHBondContact CB-O 3.37Å; S196-E199 CarbonylContact O-C 3.42Å; S196-E199 PolarHBondContact O-N 2.87Å; S196-E199 VanDerWaalsContact O-N 3.07Å; E199-E201 PolarHBondContact O-N 2.73Å
200	P	58.3	Low	64.1	Low	66 Å²	66	72.4 Å²	72.4	43%	0.429	37%	0.373	S	S	.	.			trans	-80.8	24.6	-170.9	35.7	-39.1	0	0	0	113.6	K165 A198	K165-P200 VanDerWaalsContact CB-O 3.32Å; K165-P200 WeakPolarHBondContact CB-O 3.48Å; A198-P200 WeakPolarHBondContact O-CD 3.25Å
201	E	65.9	Low	63.8	Low	48 Å²	48	67.6 Å²	67.6	22%	0.224	35%	0.348	C	S	.	.			trans	-112.9	127.5	-174.3	-48.8	-160.7	162.4	0	0	110.1	T144 K165 E199	T144-E201 WeakPolarHBondContact CB-OE1 3.28Å; T144-E201 VanDerWaalsContact CB-OE2 3.24Å; T144-E201 WeakPolarHBondContact CB-OE2 3.47Å; T144-E201 WeakPolarHBondContact CG2-OE1 3.36Å; T144-E201 PolarHBondContact OG1-OE2 3.49Å; K165-E201 HydrophobicContact CB-CG 4.36Å; K165-E201 HydrophobicContact CD-CG 4.45Å; K165-E201 IonicContact NZ-OE1 2.9Å; K165-E201 PolarHBondContact NZ-OE1 3.37Å; E199-E201 PolarHBondContact O-N 2.73Å
202	E	74.5	Confident	64	Low	4 Å²	4	68.1 Å²	68.1	2%	0.019	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.9	174.7	-60.8	-171.1	174.1	0	0	109.3	R163 V164 S169 Q191 K192 P194	R163-E202 WeakPolarHBondContact CA-O 3.36Å; V164-E202 HydrophobicContact CG1-CB 4.24Å; V164-E202 PolarHBondContact N-O 3.14Å; V164-E202 PolarHBondContact O-N 3.42Å; S169-E202 WeakPolarHBondContact CB-OE1 3.4Å; S169-E202 PolarHBondContact OG-OE1 3.49Å; Q191-E202 PolarHBondContact NE2-OE2 3.04Å; K192-E202 WeakPolarHBondContact O-CA 3.41Å; P194-E202 HydrophobicContact CG-CG 3.74Å
203	I	77.8	Confident	63.6	Low	41 Å²	41	65.1 Å²	65.1	21%	0.21	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	124.3	177.1	-53.1	178	0	0	0	107.7	E161 R163 K192	E161-I203 HydrophobicContact CG-CG2 3.64Å; R163-I203 HydrophobicContact CG-CG1 4.29Å; K192-I203 HydrophobicContact CB-CB 4.26Å; K192-I203 PolarHBondContact N-O 3.02Å; K192-I203 PolarHBondContact O-N 2.84Å; K192-I203 VanDerWaalsContact O-N 3.14Å
204	C	76.4	Confident	64	Low	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	123.5	-176.9	-58.7	0	0	0	0	108.6	E161 C162 V172 W174 L190	E161-C204 WeakPolarHBondContact CA-O 3.31Å; C162-C204 PolarHBondContact N-O 2.97Å; C162-C204 PolarHBondContact O-N 2.95Å; V172-C204 HydrophobicContact CG1-CB 4.1Å; W174-C204 HydrophobicContact CZ2-CB 4.5Å; L190-C204 WeakPolarHBondContact O-CA 3.32Å
205	T	69.9	Low	64.5	Low	22 Å²	22	62.9 Å²	62.9	14%	0.135	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.4	-171.7	-49.1	0	0	0	0	110.3	V159 F160 L190 V207	V159-T205 HydrophobicContact CG1-CG2 3.45Å; V159-T205 VanDerWaalsContact CG1-CG2 3.45Å; F160-T205 CarbonylContact O-C 3.47Å; F160-T205 VanDerWaalsContact O-CA 3.28Å; F160-T205 WeakPolarHBondContact O-CA 3.42Å; L190-T205 PolarHBondContact N-O 2.91Å; L190-T205 PolarHBondContact O-N 2.8Å; T205-V207 HydrophobicContact CG2-CG2 3.96Å
206	L	74.9	Confident	65.5	Low	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.4	163.1	170.7	67.1	0	0	0	107.6	F160 W174 I181 F187 R188 I189 F219	F160-L206 HydrophobicContact CB-CB 4.29Å; F160-L206 HydrophobicContact CD2-CD2 4.38Å; F160-L206 PolarHBondContact N-O 2.84Å; F160-L206 PolarHBondContact O-N 2.73Å; W174-L206 HydrophobicContact CB-CD2 4.5Å; W174-L206 HydrophobicContact CD2-CB 3.61Å; W174-L206 HydrophobicContact CD2-CD2 4.12Å; W174-L206 HydrophobicContact CD2-CG 4.41Å; W174-L206 HydrophobicContact CE3-CB 3.58Å; W174-L206 HydrophobicContact CE3-CD2 3.61Å; W174-L206 HydrophobicContact CE3-CG 4.23Å; W174-L206 HydrophobicContact CG-CB 4.27Å; W174-L206 HydrophobicContact CH2-CB 3.71Å; W174-L206 HydrophobicContact CZ2-CB 3.78Å; W174-L206 HydrophobicContact CZ3-CB 3.62Å; W174-L206 HydrophobicContact CZ3-CD2 4.08Å; I181-L206 HydrophobicContact CD1-CD2 3.74Å; I181-L206 HydrophobicContact CG2-CD1 4.23Å; F187-L206 HydrophobicContact CB-CD1 4.04Å; F187-L206 HydrophobicContact CD1-CD1 4.32Å; R188-L206 CarbonylContact O-C 3.5Å; R188-L206 WeakPolarHBondContact O-CA 3.27Å; I189-L206 HydrophobicContact CG1-CD1 3.92Å; L206-F219 HydrophobicContact CD2-CD1 3.6Å; L206-F219 HydrophobicContact CD2-CE1 3.99Å
207	V	67.8	Low	65.5	Low	27 Å²	27	52.1 Å²	52.1	16%	0.164	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.9	171.6	-177.2	0	0	0	0	107.8	L157 V158 V159 R188 T205	L157-V207 HydrophobicContact CD1-CG1 3.89Å; L157-V207 HydrophobicContact CD2-CG1 4.1Å; L157-V207 HydrophobicContact CG-CG1 3.94Å; V158-V207 CarbonylContact O-C 3.39Å; V158-V207 WeakPolarHBondContact O-CA 3.41Å; V159-V207 HydrophobicContact CG1-CG2 4.27Å; V159-V207 HydrophobicContact CG2-CG1 4.25Å; V159-V207 HydrophobicContact CG2-CG2 4.21Å; R188-V207 HydrophobicContact CB-CB 4.29Å; R188-V207 PolarHBondContact N-O 3.07Å; R188-V207 PolarHBondContact O-N 2.95Å; T205-V207 HydrophobicContact CG2-CG2 3.96Å
208	I	75.9	Confident	66	Low	1 Å²	1	43.9 Å²	43.9	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.6	167.7	-40.7	172.1	0	0	0	106.5	L157 V158 F160 D186 F187 V211 F219 L236	L157-I208 WeakPolarHBondContact CA-O 3.42Å; V158-I208 HydrophobicContact CB-CB 4.37Å; V158-I208 HydrophobicContact CB-CD1 4.36Å; V158-I208 HydrophobicContact CG1-CD1 4.22Å; V158-I208 PolarHBondContact N-O 3.09Å; V158-I208 PolarHBondContact O-N 3.29Å; F160-I208 HydrophobicContact CD2-CD1 4.42Å; F160-I208 HydrophobicContact CE2-CD1 4.12Å; D186-I208 CarbonylContact O-C 3.55Å; D186-I208 VanDerWaalsContact O-CA 3.25Å; D186-I208 WeakPolarHBondContact O-CA 3.1Å; F187-I208 HydrophobicContact CD1-CB 4.39Å; F187-I208 HydrophobicContact CD1-CD1 4.48Å; F187-I208 HydrophobicContact CD1-CG1 3.88Å; F187-I208 HydrophobicContact CD1-CG2 3.97Å; F187-I208 HydrophobicContact CE1-CB 4.25Å; F187-I208 HydrophobicContact CE1-CD1 4Å; F187-I208 HydrophobicContact CE1-CG1 3.81Å; F187-I208 HydrophobicContact CE1-CG2 3.52Å; F187-I208 HydrophobicContact CZ-CG2 3.94Å; I208-V211 HydrophobicContact CB-CG1 3.79Å; I208-V211 HydrophobicContact CD1-CG1 4.06Å; I208-V211 HydrophobicContact CG2-CG1 3.68Å; I208-F219 HydrophobicContact CD1-CE1 3.79Å; I208-F219 HydrophobicContact CD1-CE2 4.15Å; I208-F219 HydrophobicContact CD1-CZ 3.52Å; I208-L236 HydrophobicContact CD1-CD2 3.73Å
209	A	54.7	Low	67.4	Low	39 Å²	39	39.9 Å²	39.9	32%	0.322	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	-48.2	-168.2	0	0	0	0	0	112.5	L157 D186	L157-A209 VanDerWaalsContact CA-O 3.3Å; L157-A209 WeakPolarHBondContact CA-O 3.29Å; L157-A209 VanDerWaalsContact CB-O 3.31Å; L157-A209 WeakPolarHBondContact CB-O 3.46Å; D186-A209 PolarHBondContact O-N 3.03Å
210	E	61.5	Low	68	Low	116 Å²	116	35.2 Å²	35.2	54%	0.542	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	134	172.2	-63.7	-179.1	-177.5	0	0	106.6	F212	E210-F212 HydrophobicContact CB-CE2 3.96Å; E210-F212 HydrophobicContact CB-CZ 4.19Å
211	V	60.9	Low	68.6	Low	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129	179.5	-58.7	0	0	0	0	112.1	A152 E154 G155 Q156 V158 I208 D215 L236 V238	A152-V211 HydrophobicContact CB-CG2 3.82Å; E154-V211 CarbonylContact C-O 3.59Å; E154-V211 WeakPolarHBondContact CA-O 3.37Å; G155-V211 PolarHBondContact N-O 2.82Å; Q156-V211 WeakPolarHBondContact O-CG2 3.36Å; Q156-V211 PolarHBondContact O-N 2.98Å; V158-V211 HydrophobicContact CB-CG1 3.74Å; V158-V211 HydrophobicContact CG2-CB 4.39Å; V158-V211 HydrophobicContact CG2-CG1 3.52Å; V158-V211 HydrophobicContact CG2-CG2 3.93Å; I208-V211 HydrophobicContact CB-CG1 3.79Å; I208-V211 HydrophobicContact CD1-CG1 4.06Å; I208-V211 HydrophobicContact CG2-CG1 3.68Å; V211-D215 HydrophobicContact CB-CB 4.31Å; V211-L236 HydrophobicContact CB-CD2 4.34Å; V211-L236 HydrophobicContact CG1-CD2 3.9Å; V211-V238 HydrophobicContact CB-CG2 3.85Å; V211-V238 HydrophobicContact CG2-CB 4.48Å; V211-V238 HydrophobicContact CG2-CG1 3.91Å; V211-V238 HydrophobicContact CG2-CG2 3.73Å
212	F	74.2	Confident	68.7	Low	87 Å²	87	30.6 Å²	30.6	38%	0.382	17%	0.172	S	C	.	.			trans	-103	170.5	177.1	-64.2	-82	0	0	0	111.6	E154 E210 E214 D215 V238	E154-F212 HydrophobicContact CG-CD1 4.31Å; E210-F212 HydrophobicContact CB-CE2 3.96Å; E210-F212 HydrophobicContact CB-CZ 4.19Å; F212-E214 PolarHBondContact O-N 3Å; F212-D215 PolarHBondContact N-OD2 2.91Å; F212-D215 WeakPolarHBondContact O-CB 3.36Å; F212-D215 PolarHBondContact O-N 2.72Å; F212-V238 WeakPolarHBondContact O-CB 3.36Å; F212-V238 WeakPolarHBondContact O-CG1 3.08Å; F212-V238 WeakPolarHBondContact O-CG2 3.32Å
213	A	66.9	Low	68.7	Low	39 Å²	39	30.4 Å²	30.4	32%	0.322	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-55.2	-41.2	-178.6	0	0	0	0	0	112.1	D215 S216	A213-D215 PolarHBondContact O-N 2.84Å; A213-S216 WeakPolarHBondContact O-CB 3.28Å; A213-S216 PolarHBondContact O-N 2.88Å; A213-S216 PolarHBondContact O-OG 2.79Å
214	E	72.4	Confident	68.1	Low	143 Å²	143	29.8 Å²	29.8	67%	0.668	17%	0.17	S	C	*	.	G	3₁₀ helix	trans	-59.7	-23.9	173.4	-59.8	88	-94.8	0	0	114.8	R176 F212 S216	R176-E214 VanDerWaalsContact NH2-C 3.27Å; R176-E214 PolarHBondContact NH2-O 2.89Å; F212-E214 PolarHBondContact O-N 3Å; E214-S216 PolarHBondContact O-N 3.16Å
215	D	69.8	Low	67.9	Low	16 Å²	16	30.8 Å²	30.8	9%	0.086	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-78	-5	-179.7	-59.8	-41.4	0	0	0	113.6	R176 V211 F212 A213 G217 F219 L236 V238	R176-D215 IonicContact CZ-OD1 3.81Å; R176-D215 IonicContact NH1-OD1 3.79Å; R176-D215 PolarHBondContact NH1-OD1 2.96Å; R176-D215 IonicContact NH2-OD1 3.71Å; R176-D215 PolarHBondContact NH2-OD1 2.92Å; V211-D215 HydrophobicContact CB-CB 4.31Å; F212-D215 PolarHBondContact N-OD2 2.91Å; F212-D215 WeakPolarHBondContact O-CB 3.36Å; F212-D215 PolarHBondContact O-N 2.72Å; A213-D215 PolarHBondContact O-N 2.84Å; D215-G217 PolarHBondContact O-N 2.9Å; D215-F219 WeakPolarHBondContact O-CE2 3.31Å; D215-L236 HydrophobicContact CB-CD2 4.5Å; D215-L236 WeakPolarHBondContact O-CD2 3.34Å; D215-V238 HydrophobicContact CB-CG2 4.43Å
216	S	71.4	Confident	67.4	Low	44 Å²	44	37.1 Å²	37.1	31%	0.308	20%	0.201	S	C	.	.			trans	-56.6	123.1	162.4	-59.2	0	0	0	0	110.5	A213 E214 L236 V238	A213-S216 WeakPolarHBondContact O-CB 3.28Å; A213-S216 PolarHBondContact O-N 2.88Å; A213-S216 PolarHBondContact O-OG 2.79Å; E214-S216 PolarHBondContact O-N 3.16Å; S216-L236 CarbonylContact C-O 3.56Å; S216-L236 WeakPolarHBondContact CA-O 3.44Å; S216-V238 PolarHBondContact OG-N 2.99Å
217	G	52.7	Low	66.5	Low	10 Å²	10	41.7 Å²	41.7	10%	0.103	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.3	-179.3	-178	0	0	0	0	0	115.5	E177 D215 Q235 L236	E177-G217 VanDerWaalsContact OE1-CA 3.25Å; E177-G217 WeakPolarHBondContact OE1-CA 3.4Å; D215-G217 PolarHBondContact O-N 2.9Å; G217-Q235 WeakPolarHBondContact O-CA 3.36Å; G217-L236 PolarHBondContact N-O 3.49Å; G217-L236 PolarHBondContact O-N 2.83Å
218	C	61.2	Low	65.4	Low	15 Å²	15	41.7 Å²	41.7	10%	0.101	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	107.2	-177.7	-170.9	0	0	0	0	111.2	R176 E177 I233	R176-C218 WeakPolarHBondContact CA-O 3.09Å; E177-C218 PolarHBondContact N-O 2.84Å; E177-C218 WeakPolarHBondContact OE1-CB 3.39Å; E177-C218 PolarHBondContact OE1-N 2.75Å; C218-I233 WeakPolarHBondContact SG-CG2 3.36Å
219	F	73.8	Confident	64.3	Low	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.2	174.8	-72.9	-94.8	0	0	0	110.8	F160 Y175 R176 I181 F187 L206 I208 D215 I233 A234 L236	F160-F219 HydrophobicContact CD2-CB 4.4Å; F160-F219 HydrophobicContact CD2-CD1 4.5Å; F160-F219 HydrophobicContact CD2-CG 4.28Å; F160-F219 HydrophobicContact CE2-CB 4.03Å; F160-F219 HydrophobicContact CE2-CD1 4.23Å; F160-F219 AromaticContact CE2-CD2 3.72Å; F160-F219 HydrophobicContact CE2-CD2 3.72Å; F160-F219 HydrophobicContact CE2-CE2 4.24Å; F160-F219 AromaticContact CE2-CG 3.71Å; F160-F219 HydrophobicContact CE2-CG 3.71Å; F160-F219 HydrophobicContact CZ-CB 4.2Å; F160-F219 HydrophobicContact CZ-CD2 4.01Å; F160-F219 HydrophobicContact CZ-CG 4.2Å; Y175-F219 CarbonylContact O-C 3.59Å; Y175-F219 VanDerWaalsContact O-CA 3.31Å; Y175-F219 WeakPolarHBondContact O-CA 3.47Å; R176-F219 HydrophobicContact CB-CD1 4.3Å; R176-F219 HydrophobicContact CB-CE1 4.08Å; R176-F219 HydrophobicContact CB-CZ 4.46Å; R176-F219 HydrophobicContact CG-CE1 4.37Å; R176-F219 HydrophobicContact CG-CZ 4.25Å; I181-F219 HydrophobicContact CD1-CD1 3.72Å; I181-F219 HydrophobicContact CD1-CE1 3.78Å; F187-F219 HydrophobicContact CD1-CE1 4.32Å; F187-F219 AromaticContact CE1-CE1 3.9Å; F187-F219 HydrophobicContact CE1-CE1 3.9Å; F187-F219 HydrophobicContact CE1-CZ 4.1Å; L206-F219 HydrophobicContact CD2-CD1 3.6Å; L206-F219 HydrophobicContact CD2-CE1 3.99Å; I208-F219 HydrophobicContact CD1-CE1 3.79Å; I208-F219 HydrophobicContact CD1-CE2 4.15Å; I208-F219 HydrophobicContact CD1-CZ 3.52Å; D215-F219 WeakPolarHBondContact O-CE2 3.31Å; F219-I233 CarbonylContact O-C 3.57Å; F219-I233 WeakPolarHBondContact O-CA 3.33Å; F219-A234 PolarHBondContact N-O 2.79Å; F219-A234 PolarHBondContact O-N 2.87Å; F219-A234 VanDerWaalsContact O-O 3.14Å; F219-L236 HydrophobicContact CD2-CB 3.89Å; F219-L236 HydrophobicContact CE2-CB 3.7Å; F219-L236 HydrophobicContact CE2-CD2 3.94Å; F219-L236 HydrophobicContact CE2-CG 4.47Å; F219-L236 HydrophobicContact CZ-CD2 4.41Å
220	T	67.1	Low	64.3	Low	22 Å²	22	44.9 Å²	44.9	14%	0.135	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.3	-179.8	-61.8	0	0	0	0	110.8	W174 Y175 S232 I233	W174-T220 CarbonylContact C-O 3.54Å; W174-T220 VanDerWaalsContact CA-O 3.32Å; W174-T220 WeakPolarHBondContact CA-O 3.35Å; Y175-T220 PolarHBondContact N-O 2.87Å; Y175-T220 PolarHBondContact O-N 2.81Å; T220-S232 CarbonylContact C-O 3.51Å; T220-S232 WeakPolarHBondContact CA-O 3.32Å; T220-I233 HydrophobicContact CG2-CG1 4.03Å
221	C	71.3	Confident	64.2	Low	0 Å²	0	42 Å²	42	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.6	166.5	-179.4	0	0	0	0	109	F143 L147 C162 V172 W174 S231 S232	F143-C221 HydrophobicContact CZ-CB 4.32Å; F143-C221 WeakPolarHBondContact CZ-O 3.44Å; L147-C221 HydrophobicContact CD1-CB 3.88Å; L147-C221 HydrophobicContact CD2-CB 4.4Å; L147-C221 HydrophobicContact CG-CB 4.3Å; C162-C221 PolarHBondContact SG-SG 2.88Å; V172-C221 WeakPolarHBondContact CG1-SG 3.23Å; W174-C221 HydrophobicContact CD2-CB 3.9Å; W174-C221 HydrophobicContact CE3-CB 3.75Å; W174-C221 HydrophobicContact CH2-CB 3.97Å; W174-C221 HydrophobicContact CZ2-CB 4.06Å; W174-C221 HydrophobicContact CZ3-CB 3.8Å; C221-S231 CarbonylContact O-C 3.59Å; C221-S231 VanDerWaalsContact O-CA 3.28Å; C221-S231 WeakPolarHBondContact O-CA 3.32Å; C221-S232 PolarHBondContact N-O 2.79Å; C221-S232 PolarHBondContact O-N 2.86Å
222	T	67.9	Low	64.3	Low	17 Å²	17	42.1 Å²	42.1	10%	0.104	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.6	174.8	-64.4	0	0	0	0	109.6	V172 E173 T229 V230 S231	V172-T222 WeakPolarHBondContact CA-O 3.16Å; E173-T222 PolarHBondContact N-O 3.23Å; E173-T222 PolarHBondContact O-N 3.19Å; T222-T229 HydrophobicContact CG2-CG2 3.47Å; T222-T229 VanDerWaalsContact CG2-CG2 3.47Å; T222-V230 CarbonylContact C-O 3.59Å; T222-V230 WeakPolarHBondContact CA-O 3.29Å; T222-S231 PolarHBondContact OG1-OG 2.79Å
223	A	73.4	Confident	63.8	Low	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.9	176.4	0	0	0	0	0	109.8	P141 F143 V164 P170 K171 V172 T229 V230	P141-A223 HydrophobicContact CB-CB 4.24Å; P141-A223 VanDerWaalsContact CG-O 3.27Å; P141-A223 WeakPolarHBondContact CG-O 3.46Å; F143-A223 HydrophobicContact CE1-CB 4.49Å; F143-A223 HydrophobicContact CE2-CB 4.33Å; F143-A223 HydrophobicContact CZ-CB 3.89Å; V164-A223 HydrophobicContact CB-CB 4.45Å; V164-A223 HydrophobicContact CG1-CB 4.45Å; V164-A223 HydrophobicContact CG2-CB 3.76Å; P170-A223 HydrophobicContact CB-CB 4.13Å; P170-A223 HydrophobicContact CG-CB 4.44Å; K171-A223 WeakPolarHBondContact O-CA 3.39Å; V172-A223 HydrophobicContact CG2-CB 4.01Å; A223-T229 WeakPolarHBondContact O-CA 3.36Å; A223-V230 HydrophobicContact CB-CG2 4.32Å; A223-V230 PolarHBondContact N-O 2.85Å; A223-V230 PolarHBondContact O-N 3.32Å
224	S	66.8	Low	63.5	Low	27 Å²	27	38.9 Å²	38.9	19%	0.189	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141	-173.9	64.8	0	0	0	0	112.4	P170 K171 T229	P170-S224 CarbonylContact C-O 3.55Å; P170-S224 WeakPolarHBondContact CA-O 3.37Å; P170-S224 WeakPolarHBondContact CB-O 3.24Å; K171-S224 PolarHBondContact N-O 2.92Å; K171-S224 PolarHBondContact O-N 3.27Å; S224-T229 WeakPolarHBondContact CB-OG1 3.45Å
225	N	72.2	Confident	63	Low	22 Å²	22	36.6 Å²	36.6	12%	0.118	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	176.1	162.1	81.2	13.4	0	0	0	110.2	A139 P141 P168 Y227 G228	A139-N225 PolarHBondContact O-ND2 2.83Å; P141-N225 WeakPolarHBondContact CD-OD1 3.21Å; P168-N225 HydrophobicContact CG-CB 4.4Å; P168-N225 PolarHBondContact O-ND2 3.08Å; N225-Y227 PolarHBondContact O-N 3.11Å; N225-Y227 WeakPolarHBondContact OD1-CA 3.42Å; N225-Y227 WeakPolarHBondContact OD1-CB 3.15Å; N225-Y227 PolarHBondContact OD1-N 2.6Å; N225-G228 PolarHBondContact N-O 2.82Å; N225-G228 PolarHBondContact O-N 2.84Å; N225-G228 VanDerWaalsContact O-O 3.05Å; N225-G228 PolarHBondContact OD1-N 3.44Å
226	K	58.8	Low	63.1	Low	154 Å²	154	36.1 Å²	36.1	67%	0.67	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	0.1	-179.7	56.1	159.9	167.7	160.1	0	116.2	P168	P168-K226 HydrophobicContact CG-CG 4.08Å
227	Y	55.4	Low	62.8	Low	97 Å²	97	38.7 Å²	38.7	38%	0.38	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-2.6	178.2	-56.1	-61.6	0	0	0	113.8	I138 A140 A167 N225	I138-Y227 HydrophobicContact CB-CE2 4.27Å; I138-Y227 HydrophobicContact CG1-CE2 4.05Å; I138-Y227 HydrophobicContact CG2-CD1 4.04Å; I138-Y227 HydrophobicContact CG2-CD2 3.65Å; I138-Y227 HydrophobicContact CG2-CE1 3.93Å; I138-Y227 HydrophobicContact CG2-CE2 3.52Å; I138-Y227 HydrophobicContact CG2-CG 3.91Å; A140-Y227 WeakPolarHBondContact CB-O 3.4Å; A167-Y227 WeakPolarHBondContact O-CD2 3.44Å; N225-Y227 PolarHBondContact O-N 3.11Å; N225-Y227 WeakPolarHBondContact OD1-CA 3.42Å; N225-Y227 WeakPolarHBondContact OD1-CB 3.15Å; N225-Y227 PolarHBondContact OD1-N 2.6Å
228	G	44.9	Very low	63.9	Low	27 Å²	27	38.5 Å²	38.5	28%	0.278	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	164.9	171.2	172.8	0	0	0	0	0	114.2	P141 N225	P141-G228 WeakPolarHBondContact CD-O 3.44Å; P141-G228 WeakPolarHBondContact CG-O 3.27Å; N225-G228 PolarHBondContact N-O 2.82Å; N225-G228 PolarHBondContact O-N 2.84Å; N225-G228 VanDerWaalsContact O-O 3.05Å; N225-G228 PolarHBondContact OD1-N 3.44Å
229	T	53.6	Low	64.4	Low	75 Å²	75	45.4 Å²	45.4	46%	0.46	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.8	175.7	-57.9	0	0	0	0	110	T222 A223 S224	T222-T229 HydrophobicContact CG2-CG2 3.47Å; T222-T229 VanDerWaalsContact CG2-CG2 3.47Å; A223-T229 WeakPolarHBondContact O-CA 3.36Å; S224-T229 WeakPolarHBondContact CB-OG1 3.45Å
230	V	53.7	Low	63.9	Low	31 Å²	31	47.3 Å²	47.3	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151.9	174.5	-66.5	0	0	0	0	110.2	P141 F143 T222 A223	P141-V230 HydrophobicContact CB-CG2 3.94Å; P141-V230 HydrophobicContact CG-CG2 4.1Å; P141-V230 WeakPolarHBondContact O-CG1 3.41Å; P141-V230 VanDerWaalsContact O-CG2 3.29Å; P141-V230 WeakPolarHBondContact O-CG2 3.23Å; F143-V230 HydrophobicContact CD2-CB 4.25Å; F143-V230 HydrophobicContact CD2-CG2 3.7Å; F143-V230 HydrophobicContact CE2-CB 4.3Å; F143-V230 HydrophobicContact CE2-CG2 3.71Å; T222-V230 CarbonylContact C-O 3.59Å; T222-V230 WeakPolarHBondContact CA-O 3.29Å; A223-V230 HydrophobicContact CB-CG2 4.32Å; A223-V230 PolarHBondContact N-O 2.85Å; A223-V230 PolarHBondContact O-N 3.32Å
231	S	59.9	Low	63.2	Low	55 Å²	55	52.4 Å²	52.4	39%	0.385	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153.2	177.6	-54.8	0	0	0	0	110.3	C221 T222	C221-S231 CarbonylContact O-C 3.59Å; C221-S231 VanDerWaalsContact O-CA 3.28Å; C221-S231 WeakPolarHBondContact O-CA 3.32Å; T222-S231 PolarHBondContact OG1-OG 2.79Å
232	S	62.4	Low	62.3	Low	4 Å²	4	60.9 Å²	60.9	3%	0.028	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	140	174.6	-176.4	0	0	0	0	108.2	M146 L147 T220 C221	M146-S232 WeakPolarHBondContact CA-OG 3.19Å; M146-S232 WeakPolarHBondContact CB-OG 3.38Å; L147-S232 WeakPolarHBondContact CD1-O 3.49Å; L147-S232 PolarHBondContact N-OG 3.07Å; T220-S232 CarbonylContact C-O 3.51Å; T220-S232 WeakPolarHBondContact CA-O 3.32Å; C221-S232 PolarHBondContact N-O 2.79Å; C221-S232 PolarHBondContact O-N 2.86Å
233	I	64.8	Low	61.1	Low	57 Å²	57	67.9 Å²	67.9	29%	0.292	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.5	-167.2	-51.9	-177.1	0	0	0	109.3	C218 F219 T220 L820	C218-I233 WeakPolarHBondContact SG-CG2 3.36Å; F219-I233 CarbonylContact O-C 3.57Å; F219-I233 WeakPolarHBondContact O-CA 3.33Å; T220-I233 HydrophobicContact CG2-CG1 4.03Å; I233-L820 HydrophobicContact CG2-CD1 3.97Å
234	A	60.5	Low	59.6	Low	1 Å²	1	75.5 Å²	75.5	1%	0.008	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	150.6	169.6	0	0	0	0	0	111.5	L147 Q148 N149 F160 F219	L147-A234 HydrophobicContact CB-CB 3.62Å; L147-A234 HydrophobicContact CD1-CB 4.39Å; Q148-A234 VanDerWaalsContact C-CB 3.46Å; Q148-A234 VanDerWaalsContact O-CB 3.25Å; Q148-A234 WeakPolarHBondContact O-CB 3.27Å; N149-A234 WeakPolarHBondContact OD1-CA 3.44Å; F160-A234 HydrophobicContact CD1-CB 4.16Å; F160-A234 HydrophobicContact CE1-CB 3.64Å; F219-A234 PolarHBondContact N-O 2.79Å; F219-A234 PolarHBondContact O-N 2.87Å; F219-A234 VanDerWaalsContact O-O 3.14Å
235	Q	61.2	Low	58.1	Low	95 Å²	95	79.4 Å²	79.4	44%	0.444	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	136	171.3	-70.1	179.6	-32	0	0	111	N149 L150 G217	N149-Q235 CarbonylContact C-O 3.49Å; N149-Q235 VanDerWaalsContact CA-O 3.28Å; N149-Q235 WeakPolarHBondContact CA-O 3.43Å; N149-Q235 PolarHBondContact OD1-N 2.8Å; L150-Q235 PolarHBondContact N-O 3.35Å; G217-Q235 WeakPolarHBondContact O-CA 3.36Å
236	L	72.1	Confident	56.3	Low	5 Å²	5	85.8 Å²	85.8	3%	0.026	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	135.6	160	-178.7	55.2	0	0	0	109.1	L150 A152 V158 F160 I208 V211 D215 S216 G217 F219 V238	L150-L236 HydrophobicContact CB-CD1 4.07Å; A152-L236 HydrophobicContact CB-CD1 4.42Å; V158-L236 HydrophobicContact CG1-CD1 4.07Å; V158-L236 HydrophobicContact CG1-CD2 4.36Å; V158-L236 HydrophobicContact CG2-CD1 4.28Å; F160-L236 HydrophobicContact CE2-CB 4.35Å; F160-L236 HydrophobicContact CZ-CB 4.01Å; I208-L236 HydrophobicContact CD1-CD2 3.73Å; V211-L236 HydrophobicContact CB-CD2 4.34Å; V211-L236 HydrophobicContact CG1-CD2 3.9Å; D215-L236 HydrophobicContact CB-CD2 4.5Å; D215-L236 WeakPolarHBondContact O-CD2 3.34Å; S216-L236 CarbonylContact C-O 3.56Å; S216-L236 WeakPolarHBondContact CA-O 3.44Å; G217-L236 PolarHBondContact N-O 3.49Å; G217-L236 PolarHBondContact O-N 2.83Å; F219-L236 HydrophobicContact CD2-CB 3.89Å; F219-L236 HydrophobicContact CE2-CB 3.7Å; F219-L236 HydrophobicContact CE2-CD2 3.94Å; F219-L236 HydrophobicContact CE2-CG 4.47Å; F219-L236 HydrophobicContact CZ-CD2 4.41Å; L236-V238 HydrophobicContact CD1-CG2 4.37Å; L236-V238 HydrophobicContact CD2-CG2 3.92Å; L236-V238 HydrophobicContact CG-CG2 3.87Å
237	H	65.4	Low	55.1	Low	98 Å²	98	87 Å²	87	45%	0.454	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	113.7	168	173.4	57.5	0	0	0	109.6	L150 S151 A152	L150-H237 PolarHBondContact O-N 2.67Å; S151-H237 VanDerWaalsContact CA-O 3.27Å; S151-H237 WeakPolarHBondContact CA-O 3.26Å; A152-H237 PolarHBondContact N-O 2.88Å; A152-H237 VanDerWaalsContact N-O 3.07Å
238	V	75.8	Confident	53.8	Low	7 Å²	7	85.6 Å²	85.6	4%	0.042	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.1	178.5	-172.5	0	0	0	0	109.4	A152 E154 V211 F212 D215 S216 L236	A152-V238 CarbonylContact O-C 3.49Å; A152-V238 WeakPolarHBondContact O-CA 3.47Å; E154-V238 HydrophobicContact CB-CG1 4.42Å; V211-V238 HydrophobicContact CB-CG2 3.85Å; V211-V238 HydrophobicContact CG2-CB 4.48Å; V211-V238 HydrophobicContact CG2-CG1 3.91Å; V211-V238 HydrophobicContact CG2-CG2 3.73Å; F212-V238 WeakPolarHBondContact O-CB 3.36Å; F212-V238 WeakPolarHBondContact O-CG1 3.08Å; F212-V238 WeakPolarHBondContact O-CG2 3.32Å; D215-V238 HydrophobicContact CB-CG2 4.43Å; S216-V238 PolarHBondContact OG-N 2.99Å; L236-V238 HydrophobicContact CD1-CG2 4.37Å; L236-V238 HydrophobicContact CD2-CG2 3.92Å; L236-V238 HydrophobicContact CG-CG2 3.87Å
239	R	71.4	Confident	53	Low	159 Å²	159	89.6 Å²	89.6	60%	0.6	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	111.3	174.9	-64.6	-178.2	-178.9	168.6	2.4	109.5	A152 E154	A152-R239 PolarHBondContact O-N 3.15Å; E154-R239 PolarHBondContact N-O 2.75Å
240	G	62.6	Low	51.8	Low	41 Å²	41	93 Å²	93	42%	0.423	52%	0.52	S	S	.	.			trans	-67.6	152.4	173.1	0	0	0	0	0	112.4	E154 E242	E154-G240 VanDerWaalsContact OE2-CA 3.3Å; E154-G240 WeakPolarHBondContact OE2-CA 3.36Å; G240-E242 PolarHBondContact O-N 3.34Å
241	N	53.8	Low	50.8	Low	128 Å²	128	100.3 Å²	100.3	68%	0.684	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	26.9	-163	-156.7	20.5	0	0	0	116.2	E154	E154-N241 PolarHBondContact OE2-N 2.81Å
242	E	51.5	Low	49.1	Very low	178 Å²	178	102.4 Å²	102.4	83%	0.832	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-10.5	-171.9	-65.5	-159.2	127.6	0	0	115.7	G240 L244	G240-E242 PolarHBondContact O-N 3.34Å; E242-L244 PolarHBondContact O-N 3.24Å; E242-L244 VanDerWaalsContact O-N 3.08Å
243	D	42.7	Very low	47.3	Very low	165 Å²	165	105.8 Å²	105.8	88%	0.882	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	21.5	-173.3	-97.8	-30.2	0	0	0	115.7
244	L	41.9	Very low	45.4	Very low	160 Å²	160	109.9 Å²	109.9	84%	0.838	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	26.6	178.5	-76.4	179.4	0	0	0	115	E242	E242-L244 PolarHBondContact O-N 3.24Å; E242-L244 VanDerWaalsContact O-N 3.08Å
245	S	35.5	Very low	43.6	Very low	108 Å²	108	114 Å²	114	76%	0.755	65%	0.646	S	S	*	*	S	Bend	trans	-137.1	28.8	175.8	70.3	0	0	0	0	117.1
246	N	33.7	Very low	41.9	Very low	157 Å²	157	115.2 Å²	115.2	84%	0.84	66%	0.66	S	S	*	*			trans	-147.9	94.4	166.5	-144	-15	0	0	0	115.4
247	N	34.6	Very low	39.6	Very low	178 Å²	178	119.7 Å²	119.7	95%	0.952	69%	0.688	S	S	*	*			trans	-156.9	98.9	165.9	-128.6	-29.4	0	0	0	110.6
248	G	28.5	Very low	37.7	Very low	68 Å²	68	122.2 Å²	122.2	70%	0.701	70%	0.704	S	S	*	*			trans	-171.9	101.6	-176.2	0	0	0	0	0	115.1
249	S	27.6	Very low	35.2	Very low	112 Å²	112	129 Å²	129	78%	0.783	74%	0.74	S	S	*	*			trans	61.8	105.8	175.5	-148	0	0	0	0	115.9
250	L	28.4	Very low	33.1	Very low	147 Å²	147	125.7 Å²	125.7	77%	0.77	75%	0.747	S	S	*	*			cis	68.7	104.6	49.5	-164.8	82.1	0	0	0	114.5
251	H	32.1	Very low	31.3	Very low	184 Å²	184	128 Å²	128	85%	0.852	76%	0.761	S	S	*	*			trans	-168.8	105.1	140.5	-100.4	54.6	0	0	0	104.8
252	S	23.9	Very low	30.2	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	77%	0.766	S	S	*	*			cis	89.6	112.6	46.1	-166.5	0	0	0	0	113.9
253	A	25.2	Very low	28.9	Very low	75 Å²	75	129 Å²	129	62%	0.62	77%	0.765	S	S	*	*			trans	49.3	131.4	159.7	0	0	0	0	0	119.4
254	N	25.3	Very low	28.8	Very low	143 Å²	143	126.3 Å²	126.3	77%	0.765	76%	0.757	S	S	*	*				-148.4	149.3	52.7	-86.1	-69.1	0	0	0	112.4
255	S	23.1	Very low	28	Very low	86 Å²	86	126.3 Å²	126.3	60%	0.601	75%	0.753	S	S	*	*				70.5	134.1	63.9	-35.4	0	0	0	0	112.3
256	T	24	Very low	27.9	Very low	122 Å²	122	127.2 Å²	127.2	75%	0.748	76%	0.756	S	S	*	*			cis	-165.6	175.5	12	-10.3	0	0	0	0	114
257	T	23.5	Very low	27.4	Very low	99 Å²	99	124.3 Å²	124.3	61%	0.607	75%	0.748	S	S	*	*			trans	66.3	118.3	146.7	46.6	0	0	0	0	123.5
258	N	25.9	Very low	28.2	Very low	150 Å²	150	120.8 Å²	120.8	80%	0.802	74%	0.735	S	S	*	*				-177.5	136.2	109.1	-84.8	-25.4	0	0	0	108
259	L	24.2	Very low	28.8	Very low	150 Å²	150	122.6 Å²	122.6	79%	0.785	73%	0.734	S	S	*	*			cis	69	130.6	28.2	-61	172.1	0	0	0	115.3
260	A	27.9	Very low	28.9	Very low	90 Å²	90	125.6 Å²	125.6	74%	0.744	74%	0.735	S	S	*	*			cis	-168.9	150.5	-18.1	0	0	0	0	0	111.7
261	A	24.3	Very low	28.9	Very low	88 Å²	88	124.7 Å²	124.7	73%	0.727	74%	0.741	S	S	*	*			trans	-177.3	133.6	156.8	0	0	0	0	0	109.3
262	I	30	Very low	28.4	Very low	154 Å²	154	124.6 Å²	124.6	79%	0.79	74%	0.741	S	S	*	*			cis	80.9	122.1	45.7	-65.1	170.5	0	0	0	110.5
263	E	25	Very low	29.6	Very low	173 Å²	173	124.8 Å²	124.8	81%	0.808	74%	0.74	S	S	*	*			cis	-161.8	-170.2	10.8	-128.9	-175.4	154.4	0	0	109.2
264	P	39.3	Very low	30.6	Very low	110 Å²	110	126.8 Å²	126.8	71%	0.714	75%	0.747	S	S	*	*			cis	-128.8	-168.1	-24	36.1	-15.2	0	0	0	114.6
265	Q	26.2	Very low	30.6	Very low	160 Å²	160	125 Å²	125	75%	0.748	75%	0.745	S	S	*	*			trans	-103.1	175.2	-175	-74.4	-86.7	-19.8	0	0	114.2
266	P	33.2	Very low	30.8	Very low	126 Å²	126	127 Å²	127	82%	0.818	75%	0.753	S	S	*	*				-143.8	155.7	94.1	37.9	-22	0	0	0	117.8
267	S	24.1	Very low	30.9	Very low	96 Å²	96	129.6 Å²	129.6	67%	0.671	76%	0.757	S	S	*	*			trans	-101	-156.1	-179.2	-32.1	0	0	0	0	111.9
268	P	50.5	Low	31	Very low	105 Å²	105	133.2 Å²	133.2	68%	0.682	77%	0.767	S	S	*	*			cis	-129.5	-142.3	-15.6	41.8	-21.1	0	0	0	110.2
269	P	41.9	Very low	31.9	Very low	106 Å²	106	131.6 Å²	131.6	69%	0.688	77%	0.765	S	S	*	*			cis	-126.9	138.4	-19.9	32.8	-12.8	0	0	0	115.6
270	H	28.8	Very low	32.4	Very low	174 Å²	174	130 Å²	130	81%	0.806	76%	0.764	S	S	*	*				69.1	125.4	91	-67.2	-73.8	0	0	0	120.1
271	S	27.4	Very low	32.5	Very low	128 Å²	128	135 Å²	135	90%	0.895	77%	0.768	S	S	*	*				-167.9	154	120.6	12.1	0	0	0	0	112.6
272	E	23.1	Very low	32.9	Very low	183 Å²	183	136.3 Å²	136.3	86%	0.855	77%	0.77	S	S	*	*			trans	-157.3	175.2	-172.8	-122.5	-165.1	173.5	0	0	109.1
273	P	49.5	Very low	32.6	Very low	103 Å²	103	137.9 Å²	137.9	67%	0.669	77%	0.771	S	S	*	*			cis	-110.8	-95.9	-17	20.2	4	0	0	0	111.6
274	P	44.5	Very low	32.6	Very low	116 Å²	116	135.3 Å²	135.3	75%	0.753	76%	0.762	S	S	*	*			cis	-110.7	-163.6	-4.9	44.1	-32.2	0	0	0	114.1
275	S	25.3	Very low	32	Very low	105 Å²	105	138 Å²	138	73%	0.734	77%	0.765	S	S	*	*			trans	-147.3	-168.6	-173.9	-54.7	0	0	0	0	113.8
276	V	28.5	Very low	32	Very low	128 Å²	128	133.7 Å²	133.7	78%	0.776	76%	0.763	S	S	*	*			trans	88.7	136.3	169.7	-170.9	0	0	0	0	113.1
277	E	26.4	Very low	31.6	Very low	178 Å²	178	133.5 Å²	133.5	83%	0.832	76%	0.76	S	S	*	*			cis	-147.5	171.7	24.5	-149.2	139.5	-142	0	0	115.4
278	Q	25.5	Very low	31.6	Very low	175 Å²	175	136.1 Å²	136.1	82%	0.818	77%	0.765	S	S	*	*			trans	-137.4	174.3	162.7	-65.1	-171.8	6.1	0	0	107.4
279	P	44.2	Very low	30.4	Very low	115 Å²	115	136.7 Å²	136.7	75%	0.747	77%	0.767	S	S	*	*			cis	-134.4	-139.8	12	37.4	-11.1	0	0	0	109.8
280	P	35.1	Very low	29.6	Very low	118 Å²	118	137.2 Å²	137.2	77%	0.766	76%	0.764	S	S	*	*			cis	-134.4	175.5	-9.3	41.4	-22.3	0	0	0	118.1
281	K	29.9	Very low	29.6	Very low	193 Å²	193	136 Å²	136	84%	0.839	76%	0.758	S	S	*	*			trans	-91.4	157	167.4	-62.5	179.4	178.2	179.7	0	111.8
282	P	31.5	Very low	29.4	Very low	116 Å²	116	137.4 Å²	137.4	75%	0.753	76%	0.756	S	S	*	*				-112.8	146.5	107.5	-8.4	28	0	0	0	110.9
283	K	25.2	Very low	30	Very low	187 Å²	187	137 Å²	137	81%	0.813	75%	0.754	S	S	*	*				69.3	140.6	62.1	-64.3	179.4	170.2	-172.2	0	112.2
284	L	25.2	Very low	29.5	Very low	119 Å²	119	136.8 Å²	136.8	62%	0.623	75%	0.752	S	S	*	*			cis	-155.7	157.9	20.9	-160	67	0	0	0	112.4
285	E	25.1	Very low	28.6	Very low	167 Å²	167	142 Å²	142	78%	0.78	76%	0.757	S	S	*	*			trans	51.8	143.5	158.1	-81.4	141	-146.8	0	0	120.8
286	G	26.9	Very low	28.9	Very low	69 Å²	69	142.3 Å²	142.3	71%	0.711	76%	0.759	S	S	*	*			cis	-163.8	-175	-8.4	0	0	0	0	0	108.3
287	V	24.7	Very low	28.7	Very low	122 Å²	122	141.8 Å²	141.8	74%	0.739	76%	0.761	S	S	*	*			cis	172	121.3	-9.2	139.9	0	0	0	0	102.9
288	L	24.5	Very low	28.8	Very low	151 Å²	151	138.7 Å²	138.7	79%	0.791	76%	0.759	S	S	*	*			trans	64	135.9	170.6	-57.2	168.3	0	0	0	117.6
289	V	24.5	Very low	28.8	Very low	117 Å²	117	141.8 Å²	141.8	71%	0.709	76%	0.763	S	S	*	*			cis	75.5	119.2	37.2	-176.7	0	0	0	0	110.1
290	N	26.1	Very low	27.9	Very low	118 Å²	118	144.2 Å²	144.2	63%	0.631	77%	0.768	S	S	*	*			cis	-161.7	174.1	30	-137	-10.9	0	0	0	115.3
291	H	29.1	Very low	27.6	Very low	149 Å²	149	141.8 Å²	141.8	69%	0.69	76%	0.764	S	S	*	*			trans	38.1	126.3	150.6	-61.8	-47.1	0	0	0	123.1
292	N	23.4	Very low	27.4	Very low	157 Å²	157	140.6 Å²	140.6	84%	0.84	77%	0.766	S	S	*	*				172.6	155.8	89.3	-109.7	-8.8	0	0	0	115.1
293	E	35.5	Very low	27.1	Very low	175 Å²	175	142.7 Å²	142.7	82%	0.818	76%	0.759	S	S	*	*			trans	-99.3	177.1	162.9	-108.9	-173.2	-155.8	0	0	109.9
294	P	37.8	Very low	26.9	Very low	98 Å²	98	139.9 Å²	139.9	64%	0.636	76%	0.757	S	S	*	*			cis	-156.4	-178.6	36.8	44.5	-21.8	0	0	0	121
295	R	26.9	Very low	27	Very low	226 Å²	226	142.6 Å²	142.6	85%	0.853	77%	0.766	S	S	*	*			trans	79	115.7	140.2	-88.6	173.9	-173.7	-173.3	1.4	125.9
296	S	30.2	Very low	26.9	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	76%	0.759	S	S	*	*				79.3	132.2	121.7	69.8	0	0	0	0	124.6
297	S	25.3	Very low	26.8	Very low	118 Å²	118	146 Å²	146	83%	0.825	77%	0.767	S	S	*	*			trans	-167.6	135.7	155.7	60	0	0	0	0	110.5
298	S	27.3	Very low	27	Very low	113 Å²	113	147.5 Å²	147.5	79%	0.79	77%	0.77	S	S	*	*			trans	-146.4	152.2	-166.8	-49.4	0	0	0	0	116.9
299	R	25.5	Very low	27.5	Very low	240 Å²	240	146 Å²	146	91%	0.906	77%	0.77	S	S	*	*			trans	-149.2	131.8	161.4	-75.2	-177.4	178.1	-162.4	-3.5	106.5
300	I	25.5	Very low	27.6	Very low	166 Å²	166	149.9 Å²	149.9	85%	0.851	78%	0.78	S	S	*	*			cis	75.4	121.9	39	-51.8	173.2	0	0	0	112.6
301	G	30	Very low	27.9	Very low	66 Å²	66	152.6 Å²	152.6	68%	0.68	79%	0.794	S	S	*	*			trans	-145	-162.3	175	0	0	0	0	0	110.4
302	L	25.2	Very low	28	Very low	169 Å²	169	152.1 Å²	152.1	89%	0.885	80%	0.797	S	S	*	*			trans	-155	165.5	-179.6	-110.7	164.2	0	0	0	114.4
303	R	24.7	Very low	28.3	Very low	160 Å²	160	154.6 Å²	154.6	60%	0.604	80%	0.8	S	S	*	*			trans	-148.9	140.3	178.6	-170.1	-174	-162.3	175.5	9.7	108.2	D183	D183-R303 PolarHBondContact O-NH1 2.83Å; D183-R303 VanDerWaalsContact O-NH1 3.15Å; D183-R303 PolarHBondContact O-NH2 2.91Å
304	V	22.4	Very low	28	Very low	127 Å²	127	148.7 Å²	148.7	77%	0.77	79%	0.786	S	S	*	*			trans	-120.5	151.5	-177.5	-177.4	0	0	0	0	111.3
305	H	25.8	Very low	27.6	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.815	80%	0.797	S	S	*	*			trans	-95.3	161.5	-178.3	-84	-109.4	0	0	0	113
306	F	24.2	Very low	27.6	Very low	143 Å²	143	147.8 Å²	147.8	63%	0.627	80%	0.797	S	S	*	*			trans	-123.9	149.5	163.5	-74.7	-78.7	0	0	0	111.8	A60 E61	A60-F306 HydrophobicContact CB-CE1 4.2Å; A60-F306 HydrophobicContact CB-CZ 4.31Å; E61-F306 WeakPolarHBondContact O-CE1 3.09Å
307	N	24.9	Very low	27.4	Very low	165 Å²	165	146.5 Å²	146.5	88%	0.882	79%	0.793	S	S	*	*			trans	-136.6	154.3	161.9	-102.5	-24.8	0	0	0	107.5
308	L	29	Very low	27.4	Very low	154 Å²	154	146.3 Å²	146.3	81%	0.806	79%	0.791	S	S	*	*			trans	-111.7	157.4	-178.3	-77.4	168.1	0	0	0	112.2
309	P	33.5	Very low	27.4	Very low	119 Å²	119	146 Å²	146	77%	0.773	79%	0.789	S	S	*	*			trans	-94.9	-180	-168	39	-38	0	0	0	114.7
310	E	27.8	Very low	27.6	Very low	198 Å²	198	143.5 Å²	143.5	93%	0.925	79%	0.788	S	S	*	*			trans	-106.4	158.4	164.8	-68.1	-174.8	140.4	0	0	111.2
311	D	32.6	Very low	27.6	Very low	175 Å²	175	140 Å²	140	94%	0.936	78%	0.783	S	S	*	*			trans	-81.6	157.5	-170.1	-81.1	-54	0	0	0	116.3
312	D	31.4	Very low	27.5	Very low	139 Å²	139	140.2 Å²	140.2	74%	0.743	79%	0.786	S	S	*	*			trans	-102.9	146	178.9	173.1	30.5	0	0	0	113.4	G314	D312-G314 PolarHBondContact OD1-N 2.59Å
313	K	29.2	Very low	27.6	Very low	210 Å²	210	138.5 Å²	138.5	91%	0.913	78%	0.782	S	S	*	*			trans	-148.1	67.5	162.2	-73.2	-154.9	175.4	-174.7	0	114.8
314	G	29.6	Very low	27.8	Very low	50 Å²	50	136.6 Å²	136.6	52%	0.515	79%	0.789	S	S	.	*			trans	20.8	152.6	137.6	0	0	0	0	0	125.9	D312	D312-G314 PolarHBondContact OD1-N 2.59Å
315	S	29.4	Very low	28	Very low	123 Å²	123	135.6 Å²	135.6	86%	0.86	78%	0.783	S	S	*	*			trans	77.8	145.9	160.4	75.8	0	0	0	0	117.9
316	E	25.9	Very low	28.2	Very low	182 Å²	182	133.2 Å²	133.2	85%	0.85	78%	0.781	S	S	*	*			cis	-137.1	158.1	15.1	-72.8	-174.4	118.2	0	0	115.6
317	A	26.6	Very low	28.3	Very low	84 Å²	84	136.4 Å²	136.4	69%	0.694	79%	0.789	S	S	*	*			trans	58.5	133.7	141.3	0	0	0	0	0	125.1
318	S	25.5	Very low	28.5	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	78%	0.783	S	S	*	*			trans	46.9	143.7	144.2	57.3	0	0	0	0	121
319	S	27.6	Very low	28.4	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	78%	0.783	S	S	*	*			cis	-165.3	-178.6	0.3	43	0	0	0	0	106.1
320	E	28.2	Very low	28.3	Very low	187 Å²	187	140.8 Å²	140.8	87%	0.874	79%	0.789	S	S	*	*			cis	-158.4	-155.1	22.8	-154.1	167.3	-163.4	0	0	110
321	A	26.9	Very low	29.6	Very low	92 Å²	92	136.3 Å²	136.3	76%	0.76	78%	0.776	S	S	*	*			trans	-52.5	153.3	-177.9	0	0	0	0	0	114.8
322	G	27.1	Very low	29.4	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	77%	0.771	S	S	*	*				87.1	144.7	56.5	0	0	0	0	0	110.1
323	V	28.3	Very low	29.4	Very low	132 Å²	132	133.1 Å²	133.1	80%	0.8	77%	0.767	S	S	*	*			cis	-155.1	147.2	21.6	163.4	0	0	0	0	110.4
324	V	28.3	Very low	29.4	Very low	121 Å²	121	132.4 Å²	132.4	73%	0.733	76%	0.764	S	S	*	*			trans	2.6	142.3	144.8	-150.5	0	0	0	0	116.4
325	T	27.2	Very low	29.5	Very low	106 Å²	106	138.3 Å²	138.3	65%	0.65	78%	0.778	S	S	*	*				177.9	143.6	65.8	-34.2	0	0	0	0	114.1
326	T	28.6	Very low	29.3	Very low	125 Å²	125	142 Å²	142	77%	0.767	78%	0.782	S	S	*	*			trans	54.7	165.6	147.8	49.7	0	0	0	0	122.7
327	R	27.3	Very low	29.6	Very low	211 Å²	211	143.3 Å²	143.3	80%	0.796	78%	0.779	S	S	*	*			cis	-179.4	159.1	-39.2	-150.8	-176.8	-169.2	-175.1	4	107.9
328	Q	27.8	Very low	29.8	Very low	163 Å²	163	147.6 Å²	147.6	76%	0.762	78%	0.782	S	S	*	*			trans	68.5	154.3	166.5	-62.9	173	-51.4	0	0	115.8
329	T	26.7	Very low	30	Very low	133 Å²	133	149.1 Å²	149.1	82%	0.816	78%	0.782	S	S	*	*			cis	-155.4	166.7	-7.1	5.6	0	0	0	0	111.9
330	R	33.3	Very low	30.1	Very low	234 Å²	234	147 Å²	147	88%	0.883	78%	0.776	S	S	*	*			trans	-78	-180	162.9	-78.2	-177.9	173.9	173.5	-2.3	111.3
331	P	53.8	Low	30	Very low	103 Å²	103	147.2 Å²	147.2	67%	0.669	78%	0.777	S	S	*	*			cis	-134.2	-176.7	5	35.8	-13.6	0	0	0	115.6
332	D	28.6	Very low	30.3	Very low	155 Å²	155	146.6 Å²	146.6	83%	0.829	77%	0.772	S	S	*	*				166.4	-173.6	110.7	-97.7	-30.3	0	0	0	114.6
333	S	32.4	Very low	30.4	Very low	93 Å²	93	149.4 Å²	149.4	65%	0.65	78%	0.775	S	S	*	*			trans	-148.2	157.6	-157	61.1	0	0	0	0	115.2
334	F	28.9	Very low	30.4	Very low	194 Å²	194	153.2 Å²	153.2	85%	0.851	78%	0.781	S	S	*	*				176.5	-176.6	127.8	-115.1	-94.6	0	0	0	114.3
335	Q	31.2	Very low	30.5	Very low	174 Å²	174	153.9 Å²	153.9	81%	0.813	79%	0.786	S	S	*	*			trans	-120.5	165.5	-170.6	-50.9	173.8	-66.5	0	0	113.6
336	E	25.9	Very low	31.4	Very low	201 Å²	201	154.8 Å²	154.8	94%	0.939	79%	0.793	S	S	*	*			trans	-147.4	-173.4	147.3	-133.4	174.3	-156.8	0	0	113.5
337	R	30.7	Very low	31.4	Very low	210 Å²	210	157.4 Å²	157.4	79%	0.792	80%	0.797	S	S	*	*			trans	-149	178.8	-140.9	-139	-173.6	-166.6	-174.1	6.2	117.4
338	F	31.3	Very low	32.5	Very low	174 Å²	174	152 Å²	152	76%	0.763	79%	0.789	S	S	*	*			trans	82.2	140.8	170.4	-64.9	-79.5	0	0	0	116.8
339	N	29.4	Very low	32.6	Very low	145 Å²	145	149.5 Å²	149.5	78%	0.775	79%	0.789	S	S	*	*			cis	-157.7	164.2	-3.5	-144.5	24.4	0	0	0	109.6
340	G	30.3	Very low	32.9	Very low	62 Å²	62	148.7 Å²	148.7	64%	0.639	79%	0.789	S	S	*	*			cis	154.5	33.7	-9.5	0	0	0	0	0	118.2
341	Q	26.4	Very low	33.3	Very low	191 Å²	191	143.3 Å²	143.3	89%	0.893	78%	0.784	S	S	*	*			trans	-151.2	169.1	-177.7	-77.3	-170.2	-2.6	0	0	112.7
342	A	33.6	Very low	32.1	Very low	79 Å²	79	145.5 Å²	145.5	65%	0.653	80%	0.796	S	S	*	*			cis	176.3	159	-35	0	0	0	0	0	109.4
343	T	29.1	Very low	32.2	Very low	131 Å²	131	147.5 Å²	147.5	80%	0.804	80%	0.797	S	S	*	*			cis	-167.8	128.1	-38.6	40.4	0	0	0	0	108.3
344	K	28.3	Very low	32.4	Very low	213 Å²	213	152 Å²	152	93%	0.926	81%	0.808	S	S	*	*			trans	-162.8	149.4	162.7	-116.6	174.6	-174.5	-180	0	113.3
345	T	28.8	Very low	32.7	Very low	135 Å²	135	148.5 Å²	148.5	83%	0.828	81%	0.805	S	S	*	*			trans	-125.8	176.4	-178	36.7	0	0	0	0	109.7
346	P	46.5	Very low	32.9	Very low	124 Å²	124	145.8 Å²	145.8	81%	0.805	80%	0.802	S	S	*	*			cis	-143.7	-171.6	22.1	44.4	-22.7	0	0	0	119.4
347	E	29.6	Very low	33.9	Very low	181 Å²	181	141.9 Å²	141.9	85%	0.846	79%	0.794	S	S	*	*			trans	-48	-173.5	170.1	-106.9	175	-135.9	0	0	120.1
348	P	49.5	Very low	33.8	Very low	96 Å²	96	138.3 Å²	138.3	62%	0.623	80%	0.795	S	S	*	*			cis	-141.8	-174.4	-8.4	32.2	-9.2	0	0	0	118
349	S	29.4	Very low	33.7	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	80%	0.796	S	S	*	*			trans	81.1	149.5	145.6	78.5	0	0	0	0	120.5
350	S	33.3	Very low	34.2	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	80%	0.796	S	S	*	*			cis	-164.2	-165.6	-21.3	70.7	0	0	0	0	110.5
351	P	41.7	Very low	34	Very low	121 Å²	121	140.9 Å²	140.9	79%	0.786	81%	0.805	S	S	*	*			trans	-123.5	-177.4	-137	36.5	-13.7	0	0	0	117.5
352	V	30.1	Very low	34.4	Very low	149 Å²	149	137.7 Å²	137.7	90%	0.903	80%	0.801	S	S	*	*			trans	-124.2	155.8	172.9	-180	0	0	0	0	110.5
353	K	29.1	Very low	34.4	Very low	197 Å²	197	144 Å²	144	86%	0.857	81%	0.814	S	S	*	*			trans	-114.2	154	-169.1	-62.3	178.4	177.5	179.1	0	114.4
354	E	38.3	Very low	34.9	Very low	189 Å²	189	145 Å²	145	88%	0.883	81%	0.813	S	S	*	*			trans	-82.6	155.8	159.7	-57.2	176.5	134.7	0	0	112.5
355	P	33.8	Very low	35.3	Very low	120 Å²	120	139.1 Å²	139.1	78%	0.779	79%	0.792	S	S	*	*			trans	-139.5	-171.5	145.6	46.9	-32.4	0	0	0	111.3
356	P	34.9	Very low	36	Very low	116 Å²	116	136.9 Å²	136.9	75%	0.753	78%	0.782	S	S	*	*				-127.4	178.7	-117.6	25.5	1	0	0	0	116.5
357	P	47.8	Very low	35.7	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	76%	0.76	S	S	*	*			trans	-106.4	149.2	-177.3	38.4	-32.5	0	0	0	115.5
358	V	29.2	Very low	36.3	Very low	134 Å²	134	131 Å²	131	81%	0.812	75%	0.747	S	S	*	*			trans	-158.6	149	164.5	-123.1	0	0	0	0	116.4
359	L	28.2	Very low	36.5	Very low	151 Å²	151	132.6 Å²	132.6	79%	0.791	75%	0.75	S	S	*	*			trans	74.8	135.6	148.3	-82.6	158	0	0	0	122.2
360	A	40.9	Very low	37.2	Very low	92 Å²	92	132.4 Å²	132.4	76%	0.76	74%	0.737	S	S	*	*			trans	-135.8	153.6	171.1	0	0	0	0	0	111.4
361	K	26.1	Very low	37.7	Very low	192 Å²	192	131.3 Å²	131.3	84%	0.835	72%	0.719	S	S	*	*			trans	-144.8	-171.5	171.9	-58.1	-169.8	175.9	178.7	0	110.3
362	P	33.9	Very low	37.9	Very low	125 Å²	125	131.3 Å²	131.3	81%	0.812	71%	0.712	S	S	*	*				-115.5	172.6	-107.3	30.9	-10.4	0	0	0	115.3
363	K	34.8	Very low	38.9	Very low	211 Å²	211	129.6 Å²	129.6	92%	0.917	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-85.6	156.6	174.1	-69.5	-175.5	176.5	-178.1	0	112.8
364	L	38.1	Very low	39.9	Very low	152 Å²	152	124.4 Å²	124.4	80%	0.796	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-91.4	160.4	171.6	-152	72.5	0	0	0	111.5
365	D	37.5	Very low	40.2	Very low	90 Å²	90	121.4 Å²	121.4	48%	0.481	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-83.6	140.3	-169.5	179.2	40.8	0	0	0	115.3	T367 Q368	D365-T367 VanDerWaalsContact C-N 3.3Å; D365-T367 PolarHBondContact O-N 2.92Å; D365-T367 WeakPolarHBondContact OD2-CB 3.18Å; D365-T367 PolarHBondContact OD2-N 3Å; D365-T367 PolarHBondContact OD2-OG1 2.7Å; D365-Q368 PolarHBondContact O-N 3.06Å
366	S	43.2	Very low	41.3	Very low	87 Å²	87	119 Å²	119	61%	0.608	64%	0.644	S	S	*	*	H	α-helix	trans	-64	-28.4	179.4	58.1	0	0	0	0	113.8	Q368 L369 Q370	S366-Q368 PolarHBondContact O-N 2.92Å; S366-L369 PolarHBondContact O-N 3.43Å; S366-L369 VanDerWaalsContact O-N 3.17Å; S366-Q370 PolarHBondContact O-N 2.95Å; S366-Q370 VanDerWaalsContact O-N 3.14Å
367	T	41.3	Very low	42.1	Very low	57 Å²	57	117.9 Å²	117.9	35%	0.35	63%	0.631	S	S	.	*	H	α-helix	trans	-61.2	-32.2	-177.3	-40.1	0	0	0	0	112.4	D365 Q371	D365-T367 VanDerWaalsContact C-N 3.3Å; D365-T367 PolarHBondContact O-N 2.92Å; D365-T367 WeakPolarHBondContact OD2-CB 3.18Å; D365-T367 PolarHBondContact OD2-N 3Å; D365-T367 PolarHBondContact OD2-OG1 2.7Å; T367-Q371 WeakPolarHBondContact O-CG 3.32Å; T367-Q371 PolarHBondContact O-N 2.87Å
368	Q	41.8	Very low	41.9	Very low	125 Å²	125	117.4 Å²	117.4	58%	0.584	62%	0.622	S	S	*	*	H	α-helix	trans	-71.9	-40.5	177.8	-68.2	-175.8	-20.8	0	0	112.1	D365 S366 Q371 L372	D365-Q368 PolarHBondContact O-N 3.06Å; S366-Q368 PolarHBondContact O-N 2.92Å; Q368-Q371 PolarHBondContact O-N 3.14Å; Q368-L372 PolarHBondContact O-N 3.13Å
369	L	52.2	Low	42.7	Very low	129 Å²	129	117.2 Å²	117.2	68%	0.675	61%	0.612	S	S	*	*	H	α-helix	trans	-61.1	-43.6	175.3	-92.4	159.8	0	0	0	111.9	S366 Q371 L372 H373	S366-L369 PolarHBondContact O-N 3.43Å; S366-L369 VanDerWaalsContact O-N 3.17Å; L369-Q371 PolarHBondContact O-N 3.43Å; L369-L372 PolarHBondContact O-N 3.12Å; L369-H373 WeakPolarHBondContact O-CB 3.4Å; L369-H373 PolarHBondContact O-N 3.2Å
370	Q	45	Very low	43.7	Very low	107 Å²	107	115.4 Å²	115.4	50%	0.5	60%	0.599	S	S	.	*	H	α-helix	trans	-67	-37	179	-165.6	65.6	62	0	0	112.6	S366 N374	S366-Q370 PolarHBondContact O-N 2.95Å; S366-Q370 VanDerWaalsContact O-N 3.14Å; Q370-N374 PolarHBondContact NE2-OD1 3.37Å; Q370-N374 WeakPolarHBondContact O-CB 3.42Å; Q370-N374 PolarHBondContact O-N 2.88Å; Q370-N374 PolarHBondContact O-OD1 3.06Å
371	Q	43.1	Very low	43.7	Very low	94 Å²	94	116.9 Å²	116.9	44%	0.439	59%	0.59	S	S	.	*	H	α-helix	trans	-66.7	-40.5	175	-73.6	-167.7	-123.5	0	0	111.8	T367 Q368 L369 N374 Q375	T367-Q371 WeakPolarHBondContact O-CG 3.32Å; T367-Q371 PolarHBondContact O-N 2.87Å; Q368-Q371 PolarHBondContact O-N 3.14Å; L369-Q371 PolarHBondContact O-N 3.43Å; Q371-N374 PolarHBondContact O-N 3.31Å; Q371-Q375 PolarHBondContact O-N 2.84Å
372	L	46.9	Very low	44.3	Very low	120 Å²	120	114.9 Å²	114.9	63%	0.628	58%	0.584	S	S	*	*	H	α-helix	trans	-65.3	-42.2	176.5	-163	72.7	0	0	0	112	Q368 L369 Q375 V376	Q368-L372 PolarHBondContact O-N 3.13Å; L369-L372 PolarHBondContact O-N 3.12Å; L372-Q375 WeakPolarHBondContact O-CB 3.41Å; L372-Q375 PolarHBondContact O-N 2.95Å; L372-V376 WeakPolarHBondContact O-CG2 3.39Å; L372-V376 PolarHBondContact O-N 3.27Å
373	H	50.3	Low	44.9	Very low	113 Å²	113	116.1 Å²	116.1	52%	0.523	58%	0.583	S	S	.	*	H	α-helix	trans	-60.5	-45.8	176	-175.3	80.3	0	0	0	112	L369 Q375 V376 L377	L369-H373 WeakPolarHBondContact O-CB 3.4Å; L369-H373 PolarHBondContact O-N 3.2Å; H373-Q375 VanDerWaalsContact C-N 3.32Å; H373-Q375 PolarHBondContact O-N 3.13Å; H373-V376 PolarHBondContact O-N 3.02Å; H373-L377 WeakPolarHBondContact NE2-CD1 3.41Å; H373-L377 PolarHBondContact O-N 3.24Å; H373-L377 VanDerWaalsContact O-N 3.12Å
374	N	51.4	Low	45.2	Very low	89 Å²	89	113.1 Å²	113.1	48%	0.476	57%	0.572	S	S	.	*	H	α-helix	trans	-68.2	-30	178.9	-67.3	10.6	0	0	0	112.6	Q370 Q371 L378	Q370-N374 PolarHBondContact NE2-OD1 3.37Å; Q370-N374 WeakPolarHBondContact O-CB 3.42Å; Q370-N374 PolarHBondContact O-N 2.88Å; Q370-N374 PolarHBondContact O-OD1 3.06Å; Q371-N374 PolarHBondContact O-N 3.31Å; N374-L378 PolarHBondContact O-N 2.96Å
375	Q	43.9	Very low	45.4	Very low	126 Å²	126	111.2 Å²	111.2	59%	0.589	56%	0.563	S	S	*	*	H	α-helix	trans	-63.3	-48.9	173.6	-166.6	87.3	30.3	0	0	111.1	Q371 L372 H373 L377 L378 E379	Q371-Q375 PolarHBondContact O-N 2.84Å; L372-Q375 WeakPolarHBondContact O-CB 3.41Å; L372-Q375 PolarHBondContact O-N 2.95Å; H373-Q375 VanDerWaalsContact C-N 3.32Å; H373-Q375 PolarHBondContact O-N 3.13Å; Q375-L377 PolarHBondContact O-N 2.69Å; Q375-L378 PolarHBondContact O-N 3.32Å; Q375-E379 PolarHBondContact O-N 2.9Å
376	V	57.3	Low	45.4	Very low	69 Å²	69	112.4 Å²	112.4	42%	0.418	58%	0.575	S	S	.	*	H	α-helix	trans	-64.6	-39.8	-179.4	173.6	0	0	0	0	111.8	L372 H373 L378 E379 Q380	L372-V376 WeakPolarHBondContact O-CG2 3.39Å; L372-V376 PolarHBondContact O-N 3.27Å; H373-V376 PolarHBondContact O-N 3.02Å; V376-L378 VanDerWaalsContact C-N 3.29Å; V376-L378 PolarHBondContact O-N 2.85Å; V376-E379 PolarHBondContact O-N 3.15Å; V376-Q380 WeakPolarHBondContact O-CG 3.29Å; V376-Q380 PolarHBondContact O-N 2.88Å
377	L	51	Low	45.1	Very low	93 Å²	93	113.6 Å²	113.6	49%	0.487	58%	0.581	S	S	.	*	H	α-helix	trans	-59.6	-37.7	173.9	-98.3	154.9	0	0	0	112.6	H373 Q375 H381	H373-L377 WeakPolarHBondContact NE2-CD1 3.41Å; H373-L377 PolarHBondContact O-N 3.24Å; H373-L377 VanDerWaalsContact O-N 3.12Å; Q375-L377 PolarHBondContact O-N 2.69Å; L377-H381 WeakPolarHBondContact O-CB 3.5Å; L377-H381 PolarHBondContact O-N 2.66Å; L377-H381 VanDerWaalsContact O-N 3.1Å
378	L	43.7	Very low	45.1	Very low	110 Å²	110	117.2 Å²	117.2	58%	0.576	61%	0.605	S	S	*	*	H	α-helix	trans	-73	-36.5	-179.4	-163.4	67.4	0	0	0	112.4	N374 Q375 V376 Q382	N374-L378 PolarHBondContact O-N 2.96Å; Q375-L378 PolarHBondContact O-N 3.32Å; V376-L378 VanDerWaalsContact C-N 3.29Å; V376-L378 PolarHBondContact O-N 2.85Å; L378-Q382 WeakPolarHBondContact O-CG 3.1Å; L378-Q382 PolarHBondContact O-N 2.93Å
379	E	45.5	Very low	44.6	Very low	130 Å²	130	117 Å²	117	61%	0.607	62%	0.618	S	S	*	*	H	α-helix	trans	-68.2	-43.3	172.7	-74	-169.3	125.6	0	0	112.2	Q375 V376 H381 Q382 L383	Q375-E379 PolarHBondContact O-N 2.9Å; V376-E379 PolarHBondContact O-N 3.15Å; E379-H381 VanDerWaalsContact C-N 3.34Å; E379-H381 PolarHBondContact O-N 3.45Å; E379-Q382 PolarHBondContact O-N 2.64Å; E379-L383 PolarHBondContact O-N 3.18Å
380	Q	49.3	Very low	43.4	Very low	112 Å²	112	116.2 Å²	116.2	52%	0.523	62%	0.623	S	S	.	*	H	α-helix	trans	-62.4	-40.5	178	-72.6	-171.7	9.4	0	0	112.2	V376 Q382 L383 Q384	V376-Q380 WeakPolarHBondContact O-CG 3.29Å; V376-Q380 PolarHBondContact O-N 2.88Å; Q380-Q382 VanDerWaalsContact C-N 3.28Å; Q380-Q382 PolarHBondContact O-N 2.86Å; Q380-L383 PolarHBondContact O-N 2.82Å; Q380-L383 VanDerWaalsContact O-N 3.14Å; Q380-Q384 PolarHBondContact O-N 2.87Å
381	H	41.6	Very low	43.5	Very low	124 Å²	124	116.4 Å²	116.4	57%	0.574	63%	0.634	S	S	*	*	H	α-helix	trans	-67.4	-26.5	179	-162.8	-69.2	0	0	0	113.2	L377 E379	L377-H381 WeakPolarHBondContact O-CB 3.5Å; L377-H381 PolarHBondContact O-N 2.66Å; L377-H381 VanDerWaalsContact O-N 3.1Å; E379-H381 VanDerWaalsContact C-N 3.34Å; E379-H381 PolarHBondContact O-N 3.45Å
382	Q	39.1	Very low	42.7	Very low	150 Å²	150	119.2 Å²	119.2	70%	0.701	65%	0.645	S	S	*	*	H	α-helix	trans	-76.5	-23.8	173.7	-70.7	-175.5	25.6	0	0	113.1	L378 E379 Q380	L378-Q382 WeakPolarHBondContact O-CG 3.1Å; L378-Q382 PolarHBondContact O-N 2.93Å; E379-Q382 PolarHBondContact O-N 2.64Å; Q380-Q382 VanDerWaalsContact C-N 3.28Å; Q380-Q382 PolarHBondContact O-N 2.86Å
383	L	45.5	Very low	41.6	Very low	151 Å²	151	121 Å²	121	79%	0.791	65%	0.649	S	S	*	*	H	α-helix	trans	-85	-16.3	179	-78.8	164.1	0	0	0	114.4	E379 Q380	E379-L383 PolarHBondContact O-N 3.18Å; Q380-L383 PolarHBondContact O-N 2.82Å; Q380-L383 VanDerWaalsContact O-N 3.14Å
384	Q	42.1	Very low	40.7	Very low	148 Å²	148	124.6 Å²	124.6	69%	0.692	66%	0.664	S	S	*	*	H	α-helix	trans	-101.2	-14.8	-175.2	-76.7	-177.9	-32.4	0	0	115.7	Q380	Q380-Q384 PolarHBondContact O-N 2.87Å
385	N	41.5	Very low	39.9	Very low	111 Å²	111	126.4 Å²	126.4	59%	0.594	68%	0.681	S	S	*	*			trans	-138.5	86	-175.7	-75.1	-67.7	0	0	0	113.5
386	P	38.7	Very low	39.4	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-72.2	141.6	167.2	30.7	-33.6	0	0	0	111.2
387	P	36.2	Very low	38.1	Very low	113 Å²	113	131.1 Å²	131.1	73%	0.734	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-72.1	151	-179.9	29.7	-35.1	0	0	0	112.6
388	P	40.1	Very low	37.2	Very low	132 Å²	132	133.5 Å²	133.5	86%	0.857	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-72.3	148.2	-179.8	31.2	-35.9	0	0	0	111.6
389	S	32.3	Very low	36.4	Very low	120 Å²	120	134 Å²	134	84%	0.839	73%	0.726	S	S	*	*			trans	-137.9	127.5	172.3	57.2	0	0	0	0	113.3
390	S	27.8	Very low	35.9	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	73%	0.73	S	S	*	*			trans	-166.4	158.2	164.9	71.2	0	0	0	0	107.8
391	P	45.8	Very low	34.9	Very low	110 Å²	110	134.3 Å²	134.3	71%	0.714	74%	0.738	S	S	*	*			cis	-124.5	-167.2	-36.2	38.6	-24.6	0	0	0	111.4
392	K	26	Very low	34.4	Very low	154 Å²	154	135.3 Å²	135.3	67%	0.67	75%	0.748	S	S	*	*			trans	79	114	156.7	-76.1	177.1	155.3	-74.5	0	121.8
393	E	25.5	Very low	34	Very low	156 Å²	156	132 Å²	132	73%	0.729	74%	0.741	S	S	*	*				82.1	158.4	120.9	-69.7	161.8	178.5	0	0	122.4
394	F	29.5	Very low	33.2	Very low	189 Å²	189	132.4 Å²	132.4	83%	0.829	74%	0.744	S	S	*	*			trans	-98.1	173.5	-166.3	-76.7	-99.5	0	0	0	113.4
395	P	36.2	Very low	32.8	Very low	127 Å²	127	129.5 Å²	129.5	83%	0.825	75%	0.746	S	S	*	*				-118.8	172.2	126.2	35.5	-32.6	0	0	0	114.9
396	F	33	Very low	33.4	Very low	188 Å²	188	130 Å²	130	83%	0.825	76%	0.755	S	S	*	*			trans	-110.4	160.9	-158.9	-97.8	-103.9	0	0	0	115.7	M398	F396-M398 HydrophobicContact CD1-CG 4.48Å
397	S	29.3	Very low	34.2	Very low	106 Å²	106	130 Å²	130	74%	0.741	76%	0.755	S	S	*	*				-166.9	97.2	123.7	-164	0	0	0	0	110.6
398	M	31.5	Very low	33.8	Very low	144 Å²	144	128.9 Å²	128.9	71%	0.709	76%	0.755	S	S	*	*				62.2	128.8	106.6	-62.9	-143.4	-66.4	0	0	116	F396	F396-M398 HydrophobicContact CD1-CG 4.48Å
399	T	28.3	Very low	33.3	Very low	121 Å²	121	128.5 Å²	128.5	74%	0.742	75%	0.75	S	S	*	*				-162.4	116.4	64.3	-61.6	0	0	0	0	108.9
400	V	34	Very low	33	Very low	115 Å²	115	128.5 Å²	128.5	70%	0.697	75%	0.745	S	S	*	*				72.7	134.2	96.8	134.4	0	0	0	0	114
401	L	29.1	Very low	32.9	Very low	133 Å²	133	128.8 Å²	128.8	70%	0.696	74%	0.742	S	S	*	*			cis	-158.8	150.3	18.5	-119.6	168.3	0	0	0	113.5
402	N	30.4	Very low	31.9	Very low	145 Å²	145	128.4 Å²	128.4	78%	0.775	74%	0.742	S	S	*	*			trans	52.2	155.1	145.5	-85.1	9.4	0	0	0	124.1
403	S	31.7	Very low	32	Very low	80 Å²	80	125.9 Å²	125.9	56%	0.559	74%	0.744	S	S	*	*			cis	-171	155.7	-6.9	46.6	0	0	0	0	114
404	N	28.8	Very low	32.1	Very low	159 Å²	159	126.7 Å²	126.7	85%	0.85	75%	0.745	S	S	*	*			trans	68.2	152.9	155.3	-60.3	-12.7	0	0	0	118.9
405	A	32.8	Very low	31.9	Very low	88 Å²	88	126 Å²	126	73%	0.727	75%	0.745	S	S	*	*			cis	-164.3	165.2	-19.6	0	0	0	0	0	110.4
406	P	53.4	Low	31.4	Very low	121 Å²	121	125.8 Å²	125.8	79%	0.786	74%	0.741	S	S	*	*			trans	-105	-155.7	-169.4	45.2	-38.5	0	0	0	112.7
407	P	55.5	Low	31.2	Very low	115 Å²	115	126 Å²	126	75%	0.747	74%	0.741	S	S	*	*			cis	-142.3	-152.8	-2.4	43.9	-22.1	0	0	0	115.7
408	A	29.6	Very low	31.4	Very low	90 Å²	90	125.3 Å²	125.3	74%	0.744	74%	0.742	S	S	*	*			trans	78	164.4	153.7	0	0	0	0	0	119.7
409	V	28.1	Very low	32	Very low	124 Å²	124	124.8 Å²	124.8	75%	0.752	75%	0.749	S	S	*	*			cis	175.2	175.2	-40.7	131.7	0	0	0	0	107.2
410	T	26.6	Very low	32.1	Very low	120 Å²	120	124.4 Å²	124.4	74%	0.736	75%	0.751	S	S	*	*			trans	66.3	127.1	175.1	45.4	0	0	0	0	116.3
411	T	25.8	Very low	31.9	Very low	119 Å²	119	124.4 Å²	124.4	73%	0.73	76%	0.756	S	S	*	*				83.8	117.4	50.2	67.6	0	0	0	0	117.2
412	S	25.5	Very low	32.1	Very low	102 Å²	102	126.9 Å²	126.9	71%	0.713	77%	0.765	S	S	*	*			trans	60.2	103.5	140.1	65	0	0	0	0	122.9
413	S	27.4	Very low	32.1	Very low	101 Å²	101	126 Å²	126	71%	0.706	77%	0.765	S	S	*	*				85.7	154.4	116.7	82.2	0	0	0	0	122.9
414	K	26.9	Very low	31.9	Very low	174 Å²	174	131.5 Å²	131.5	76%	0.757	78%	0.779	S	S	*	*			trans	81.9	133.1	156	-72	177.1	178.8	174	0	121
415	Q	25.9	Very low	32	Very low	175 Å²	175	127.9 Å²	127.9	82%	0.818	77%	0.766	S	S	*	*			trans	71.2	151.8	143	-75.2	172.6	-34	0	0	118.3
416	V	26.3	Very low	32	Very low	122 Å²	122	131.7 Å²	131.7	74%	0.739	77%	0.773	S	S	*	*			cis	-155.5	135.9	-23.3	104.9	0	0	0	0	112.1
417	K	27.5	Very low	30.8	Very low	192 Å²	192	130.7 Å²	130.7	84%	0.835	78%	0.775	S	S	*	*			trans	39.4	113.6	142.9	-155.1	177.8	-172.6	180	0	122
418	A	34.5	Very low	29.7	Very low	92 Å²	92	135.8 Å²	135.8	76%	0.76	78%	0.779	S	S	*	*			trans	71.5	165.6	151	0	0	0	0	0	117.6
419	P	43.5	Very low	30.6	Very low	133 Å²	133	137.4 Å²	137.4	86%	0.864	78%	0.782	S	S	*	*			cis	-127.6	-155	10.6	44.1	-26.7	0	0	0	115.5
420	S	31.4	Very low	31	Very low	112 Å²	112	138.4 Å²	138.4	78%	0.783	78%	0.776	S	S	*	*			trans	-140.7	133.4	-161.7	58.4	0	0	0	0	116.7
421	S	30.2	Very low	31.5	Very low	115 Å²	115	141 Å²	141	80%	0.804	77%	0.774	S	S	*	*			trans	-166.7	122.6	156.9	32.4	0	0	0	0	107.8
422	Q	33.2	Very low	31.6	Very low	186 Å²	186	143.4 Å²	143.4	87%	0.869	77%	0.774	S	S	*	*				62.7	110	69.4	-75.2	-159.6	4.8	0	0	116.4
423	T	29	Very low	32.3	Very low	127 Å²	127	147.5 Å²	147.5	78%	0.779	78%	0.78	S	S	*	*				-176.8	129.1	129.8	40	0	0	0	0	114.2
424	F	27.8	Very low	33.5	Very low	195 Å²	195	147.8 Å²	147.8	86%	0.855	78%	0.779	S	S	*	*			trans	38.3	158.1	142.2	-66.1	-100.9	0	0	0	124
425	S	31.5	Very low	33.8	Very low	82 Å²	82	143.9 Å²	143.9	57%	0.573	77%	0.774	S	S	*	*			cis	178.8	174.8	-31.7	64.2	0	0	0	0	112
426	L	31.8	Very low	34.3	Very low	169 Å²	169	141.3 Å²	141.3	89%	0.885	77%	0.77	S	S	*	*			trans	75.9	149.4	159.3	-68.9	165	0	0	0	118.5
427	A	28.9	Very low	34.5	Very low	99 Å²	99	142 Å²	142	82%	0.818	77%	0.769	S	S	*	*			cis	-154.9	-167	-1	0	0	0	0	0	115
428	R	32.2	Very low	34.8	Very low	223 Å²	223	137.5 Å²	137.5	84%	0.842	76%	0.758	S	S	*	*			trans	-95	-179.3	-169.6	-128.5	-177.7	-176.1	171.3	2.2	113.7
429	P	48.2	Very low	34.8	Very low	124 Å²	124	139.7 Å²	139.7	81%	0.805	76%	0.763	S	S	*	*				-151.5	-148.4	57.3	42	-17.1	0	0	0	118.3
430	K	36.4	Very low	34.3	Very low	144 Å²	144	137.5 Å²	137.5	63%	0.626	76%	0.755	S	S	*	*			trans	-88.3	-171.3	-164.7	-56.2	-173.9	178.8	-177.3	0	115.1
431	Y	37	Very low	34.4	Very low	174 Å²	174	136.3 Å²	136.3	68%	0.682	75%	0.752	S	S	*	*			cis	-155	-162.7	21.9	-111.3	-48.7	0	0	0	110.5
432	F	29.4	Very low	34.4	Very low	170 Å²	170	137 Å²	137	75%	0.746	75%	0.752	S	S	*	*			cis	-150	-134	10.4	-136.2	-45.8	0	0	0	114
433	F	40.2	Very low	34.3	Very low	189 Å²	189	134.7 Å²	134.7	83%	0.829	75%	0.751	S	S	*	*			trans	-160.5	168.3	-172.1	-105.5	-57.9	0	0	0	112
434	P	52.5	Low	34.3	Very low	107 Å²	107	132.6 Å²	132.6	70%	0.695	75%	0.746	S	S	*	*				-149.4	173	51.7	42.8	-22.1	0	0	0	120.1
435	S	32.7	Very low	35.6	Very low	92 Å²	92	128.5 Å²	128.5	64%	0.643	74%	0.739	S	S	*	*			trans	49.2	135.6	152.2	55.8	0	0	0	0	120.9
436	T	35.6	Very low	35.5	Very low	121 Å²	121	130.2 Å²	130.2	74%	0.742	75%	0.751	S	S	*	*			cis	-173.9	179.7	4	18.8	0	0	0	0	106.3
437	N	31.3	Very low	35.9	Very low	135 Å²	135	127.3 Å²	127.3	72%	0.722	74%	0.744	S	S	*	*			cis	-163.3	173.6	1.1	-114.3	-7.4	0	0	0	106.9
438	T	33	Very low	36	Very low	98 Å²	98	127.6 Å²	127.6	60%	0.601	74%	0.741	S	S	*	*			cis	-172.8	118	-39.4	-93.1	0	0	0	0	110.8
439	T	35.7	Very low	37	Very low	139 Å²	139	122.2 Å²	122.2	85%	0.853	74%	0.735	S	S	*	*			trans	67.8	155.7	158.9	62.3	0	0	0	0	120.7
440	A	32.3	Very low	36.1	Very low	86 Å²	86	122.2 Å²	122.2	71%	0.711	73%	0.732	S	S	*	*			cis	-135.8	136.8	5.1	0	0	0	0	0	110.2
441	A	33.7	Very low	35.7	Very low	87 Å²	87	124.1 Å²	124.1	72%	0.719	74%	0.741	S	S	*	*				61.7	136	78.6	0	0	0	0	0	113.5
442	T	30.1	Very low	35.2	Very low	130 Å²	130	121.4 Å²	121.4	80%	0.798	74%	0.742	S	S	*	*			cis	-159.9	174.6	8.7	-7.4	0	0	0	0	107.2
443	V	30.3	Very low	35.1	Very low	138 Å²	138	120.4 Å²	120.4	84%	0.836	74%	0.744	S	S	*	*			cis	-142.3	-164.8	15.4	-143.1	0	0	0	0	110.7
444	A	29.8	Very low	34.4	Very low	82 Å²	82	116 Å²	116	68%	0.678	74%	0.736	S	S	*	*			trans	-155.5	-163	175.8	0	0	0	0	0	108.8
445	P	54.6	Low	33.2	Very low	109 Å²	109	116.6 Å²	116.6	71%	0.708	74%	0.743	S	S	*	*			cis	-140.8	-172.7	-12.8	41.5	-23.2	0	0	0	115.7
446	S	30.1	Very low	33.3	Very low	118 Å²	118	118.5 Å²	118.5	83%	0.825	75%	0.751	S	S	*	*			trans	84.3	170.6	140.5	76.4	0	0	0	0	121.3
447	S	39.3	Very low	33.8	Very low	108 Å²	108	117.8 Å²	117.8	76%	0.755	75%	0.749	S	S	*	*			trans	-155.6	-178.9	-153.9	58.8	0	0	0	0	112.4
448	S	30.8	Very low	33.9	Very low	106 Å²	106	119.7 Å²	119.7	74%	0.741	75%	0.753	S	S	*	*			trans	96.8	173	167.9	-37.8	0	0	0	0	115.6
449	P	54.5	Low	33.7	Very low	110 Å²	110	120.3 Å²	120.3	71%	0.714	76%	0.757	S	S	*	*				-143.4	165.4	-90.1	42.8	-24	0	0	0	119
450	V	29.5	Very low	33.3	Very low	123 Å²	123	121.2 Å²	121.2	75%	0.745	76%	0.755	S	S	*	*			trans	78.1	137.1	136.1	158.8	0	0	0	0	123.9
451	F	28.1	Very low	33.1	Very low	184 Å²	184	123.7 Å²	123.7	81%	0.807	75%	0.752	S	S	*	*			trans	83.4	130.6	153.2	-89	-42.5	0	0	0	126
452	T	25.4	Very low	33	Very low	117 Å²	117	129.7 Å²	129.7	72%	0.718	76%	0.756	S	S	*	*			trans	67.1	153.7	146.5	57.4	0	0	0	0	120.4
453	L	26.7	Very low	32.9	Very low	150 Å²	150	129.5 Å²	129.5	79%	0.785	76%	0.755	S	S	*	*			cis	-160.5	146.9	-13.4	-117.1	166.7	0	0	0	112.4
454	S	26.1	Very low	32.9	Very low	95 Å²	95	129.7 Å²	129.7	66%	0.664	76%	0.756	S	S	*	*			trans	46.7	139.4	147.5	63.1	0	0	0	0	125.8
455	S	28.1	Very low	32.7	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	77%	0.765	S	S	*	*			trans	111.7	147.8	137.2	77.6	0	0	0	0	120.3
456	T	33.6	Very low	31.5	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	77%	0.766	S	S	*	*			trans	-130.6	172.4	-176.8	60.3	0	0	0	0	109.8
457	P	46.3	Very low	31.5	Very low	105 Å²	105	135.9 Å²	135.9	68%	0.682	76%	0.76	S	S	*	*				-159.3	154.3	102.1	38.8	-19.1	0	0	0	119.6
458	Q	35	Very low	30.8	Very low	175 Å²	175	135.1 Å²	135.1	82%	0.818	75%	0.754	S	S	*	*			trans	65.5	156.8	138.8	-69	175.4	18.9	0	0	122.2
459	T	28.6	Very low	30.6	Very low	111 Å²	111	137.3 Å²	137.3	68%	0.681	76%	0.757	S	S	*	*			cis	-117	-130	1.6	-31.3	0	0	0	0	112.2
460	I	26.9	Very low	29.1	Very low	159 Å²	159	139.4 Å²	139.4	82%	0.815	76%	0.761	S	S	*	*			cis	-133.2	-160.5	3.3	-62.2	168.1	0	0	0	108.1
461	Q	28.6	Very low	28.9	Very low	138 Å²	138	139.1 Å²	139.1	65%	0.645	76%	0.76	S	S	*	*			trans	-143.7	170.8	-175.1	-50.8	-179	20.5	0	0	110.7
462	R	31	Very low	28.7	Very low	212 Å²	212	135.7 Å²	135.7	80%	0.8	76%	0.759	S	S	*	*			cis	-139.1	-135.8	2	-140.5	161.7	174.8	140.5	-15.4	108.5
463	T	26.7	Very low	29	Very low	127 Å²	127	138.1 Å²	138.1	78%	0.779	76%	0.761	S	S	*	*			cis	-156.2	-172.9	5.4	-29.1	0	0	0	0	108.8
464	V	30.2	Very low	29.5	Very low	141 Å²	141	136.6 Å²	136.6	86%	0.855	76%	0.76	S	S	*	*			trans	-144.8	145.5	-179.3	179	0	0	0	0	112
465	S	27.3	Very low	29.5	Very low	125 Å²	125	137 Å²	137	87%	0.874	76%	0.763	S	S	*	*			trans	-156.7	-178.1	162.2	57.9	0	0	0	0	112.5
466	K	28.9	Very low	29.5	Very low	166 Å²	166	136.6 Å²	136.6	72%	0.722	76%	0.755	S	S	*	*			trans	-145.8	158.3	-150.8	-141.5	-177	173	-137.9	0	112
467	E	29.3	Very low	29.1	Very low	149 Å²	149	138.3 Å²	138.3	70%	0.696	75%	0.754	S	S	*	*			trans	64.7	158.3	157.8	-76.2	148.3	-162	0	0	118.3
468	S	25.8	Very low	28.2	Very low	92 Å²	92	138 Å²	138	64%	0.643	75%	0.751	S	S	*	*			cis	-168.5	164.1	-22.4	58.3	0	0	0	0	112.7
469	L	25	Very low	27.7	Very low	152 Å²	152	138.5 Å²	138.5	80%	0.796	75%	0.75	S	S	*	*			trans	74.4	149.5	147.6	-83.4	167.2	0	0	0	123.2
470	L	25.1	Very low	27.6	Very low	153 Å²	153	138.2 Å²	138.2	80%	0.801	75%	0.753	S	S	*	*			trans	66.3	159.9	161.1	-64.1	164.9	0	0	0	118.8
471	V	24.5	Very low	28.5	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.715	75%	0.752	S	S	*	*			cis	-173.6	167.6	-45.1	118.2	0	0	0	0	109.3
472	S	24.1	Very low	28.4	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	76%	0.762	S	S	*	*			trans	87.4	135.9	158.8	73.6	0	0	0	0	121.9
473	H	31.2	Very low	28.2	Very low	168 Å²	168	127.3 Å²	127.3	78%	0.778	76%	0.76	S	S	*	*			trans	-82.5	158.6	153.5	-66.4	-83.2	0	0	0	109.7
474	P	37.1	Very low	28.2	Very low	118 Å²	118	129.9 Å²	129.9	77%	0.766	77%	0.768	S	S	*	*				-116.8	160.8	87.4	-5.2	26.1	0	0	0	112.2
475	S	26.2	Very low	28	Very low	102 Å²	102	128.1 Å²	128.1	71%	0.713	76%	0.762	S	S	*	*			cis	83.8	156.6	28.2	-52.4	0	0	0	0	115.3
476	V	27.8	Very low	28.2	Very low	114 Å²	114	128.8 Å²	128.8	69%	0.691	75%	0.754	S	S	*	*			trans	83	95.2	175.5	-173.4	0	0	0	0	113.4
477	Q	26	Very low	28.3	Very low	168 Å²	168	128.7 Å²	128.7	79%	0.785	76%	0.756	S	S	*	*				78	156.3	88.2	-74.2	176.9	22.9	0	0	113.5
478	T	25.8	Very low	28.3	Very low	99 Å²	99	128.2 Å²	128.2	61%	0.607	76%	0.758	S	S	*	*			cis	-161.4	174.4	9.6	-1.7	0	0	0	0	112.2
479	K	26.2	Very low	28.6	Very low	185 Å²	185	132.1 Å²	132.1	80%	0.804	77%	0.767	S	S	*	*			trans	76.3	110.4	140.7	-80.3	162.8	-174.4	175.6	0	121.3
480	S	25.4	Very low	30.1	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	76%	0.756	S	S	*	*			trans	-56.9	-172.8	134.9	58.8	0	0	0	0	112.8
481	P	46.3	Very low	30.5	Very low	123 Å²	123	129.3 Å²	129.3	80%	0.799	76%	0.757	S	S	*	*			cis	-140	177	4.3	43	-25	0	0	0	117
482	G	26.2	Very low	32.5	Very low	83 Å²	83	128.8 Å²	128.8	86%	0.856	76%	0.756	S	S	*	*			trans	76.9	164.1	157.9	0	0	0	0	0	116.9
483	G	26.8	Very low	34.3	Very low	73 Å²	73	129.5 Å²	129.5	75%	0.753	76%	0.758	S	S	*	*			cis	162.8	129.2	-11.3	0	0	0	0	0	113.3
484	L	27	Very low	34.4	Very low	182 Å²	182	124.9 Å²	124.9	95%	0.953	76%	0.756	S	S	*	*			trans	50	121.7	164.1	-59.6	170.6	0	0	0	119.4
485	S	26.2	Very low	35.6	Very low	104 Å²	104	125.1 Å²	125.1	73%	0.727	76%	0.757	S	S	*	*				160.2	129.7	109.9	-162.7	0	0	0	0	115.1
486	I	30.3	Very low	35.9	Very low	139 Å²	139	126.9 Å²	126.9	71%	0.713	76%	0.764	S	S	*	*			trans	37.2	115.8	140.7	-54.7	172.8	0	0	0	121.3
487	Q	31.3	Very low	36.2	Very low	164 Å²	164	129.9 Å²	129.9	77%	0.766	77%	0.771	S	S	*	*			trans	17.4	133.5	136.9	-53.3	170.8	-35.3	0	0	121.7
488	N	30.2	Very low	37	Very low	139 Å²	139	127.3 Å²	127.3	74%	0.743	77%	0.769	S	S	*	*				174.6	132.2	103.5	-93.6	-23	0	0	0	115.6
489	E	32.5	Very low	37.5	Very low	174 Å²	174	128.7 Å²	128.7	81%	0.813	78%	0.777	S	S	*	*			trans	57.1	172.8	138.2	-76.4	-132.1	106	0	0	122.1
490	P	56.4	Low	38.8	Very low	89 Å²	89	125.5 Å²	125.5	58%	0.578	78%	0.775	S	S	*	*				-146.7	-163.4	-61.9	45.3	-26.8	0	0	0	116.1
491	L	34	Very low	40.4	Very low	157 Å²	157	125.7 Å²	125.7	82%	0.822	77%	0.774	S	S	*	*			trans	87.2	162.1	147.4	-79.2	177.3	0	0	0	121.2
492	P	65.6	Low	41.1	Very low	107 Å²	107	125.5 Å²	125.5	70%	0.695	77%	0.773	S	S	*	*			trans	-132.5	-137.5	-135	45.4	-23.9	0	0	0	112.6
493	P	61.5	Low	41.5	Very low	126 Å²	126	130.5 Å²	130.5	82%	0.818	77%	0.771	S	S	*	*			cis	-134.3	-178.5	-20.3	36.6	-16.4	0	0	0	116.8
494	G	34.5	Very low	41.4	Very low	72 Å²	72	134 Å²	134	74%	0.742	78%	0.778	S	S	*	*			trans	-178.8	150	162.2	0	0	0	0	0	114.3
495	P	62	Low	41.5	Very low	122 Å²	122	134 Å²	134	79%	0.792	77%	0.771	S	S	*	*			trans	-135	-170.5	-152.5	42.8	-25.1	0	0	0	119.2
496	T	31.1	Very low	41.5	Very low	139 Å²	139	134.9 Å²	134.9	85%	0.853	78%	0.777	S	S	*	*			trans	103.5	147.2	155.6	18.7	0	0	0	0	122.9
497	E	34.5	Very low	41.6	Very low	178 Å²	178	135.4 Å²	135.4	83%	0.832	78%	0.78	S	S	*	*			trans	-90	-174.8	-167.6	-80.1	-173.7	107.1	0	0	114.9
498	P	42.7	Very low	42.2	Very low	114 Å²	114	133.1 Å²	133.1	74%	0.74	78%	0.779	S	S	*	*			cis	-141.5	-161.1	15.9	44.2	-22.1	0	0	0	117.8
499	T	36.3	Very low	42.2	Very low	127 Å²	127	132.4 Å²	132.4	78%	0.779	79%	0.785	S	S	*	*			trans	-142.9	-149.9	-177.4	60.6	0	0	0	0	110
500	P	54.2	Low	41.9	Very low	118 Å²	118	127.2 Å²	127.2	77%	0.766	78%	0.778	S	S	*	*			cis	-121.8	-77.7	-21.8	18.4	4.5	0	0	0	123.1
501	P	59	Low	40.7	Very low	110 Å²	110	130 Å²	130	71%	0.714	79%	0.788	S	S	*	*			trans	-117.9	-163	-146.1	47.5	-34.5	0	0	0	114.5
502	P	60	Low	40.4	Very low	119 Å²	119	129 Å²	129	77%	0.773	78%	0.779	S	S	*	*			cis	-140.3	-120.2	10.1	43.1	-19.1	0	0	0	117.7
503	F	36.3	Very low	38.6	Very low	188 Å²	188	132.1 Å²	132.1	83%	0.825	78%	0.782	S	S	*	*			trans	-143.8	170.7	-164.4	-91.9	-102.3	0	0	0	112.9
504	T	25.1	Very low	37.1	Very low	147 Å²	147	133.8 Å²	133.8	90%	0.902	78%	0.779	S	S	*	*			trans	-157.2	166.7	144.4	-7.8	0	0	0	0	113.6
505	F	28.7	Very low	37.9	Very low	181 Å²	181	134.9 Å²	134.9	79%	0.794	77%	0.773	S	S	*	*			trans	-123.8	154.6	-170.4	-115.3	-102.3	0	0	0	111.8
506	S	25	Very low	36.4	Very low	122 Å²	122	139.7 Å²	139.7	85%	0.853	78%	0.775	S	S	*	*			trans	171.8	165.8	132.5	-80.7	0	0	0	0	115.2
507	I	32.9	Very low	36.3	Very low	150 Å²	150	138.2 Å²	138.2	77%	0.769	77%	0.769	S	S	*	*			trans	-125.5	139	-169.6	-74.8	164.9	0	0	0	108.9
508	P	43	Very low	36.1	Very low	116 Å²	116	136 Å²	136	75%	0.753	77%	0.768	S	S	*	*				-152.8	154.4	106.7	37.6	-18.4	0	0	0	118.7
509	S	30.4	Very low	35.5	Very low	125 Å²	125	135.7 Å²	135.7	87%	0.874	77%	0.768	S	S	*	*			trans	25	144.7	142.7	-49.8	0	0	0	0	122.9
510	G	28	Very low	35.8	Very low	64 Å²	64	135 Å²	135	66%	0.66	77%	0.766	S	S	*	*			cis	158.4	159.5	-2.9	0	0	0	0	0	113.5
511	N	29.4	Very low	34.7	Very low	147 Å²	147	136.9 Å²	136.9	79%	0.786	77%	0.768	S	S	*	*			trans	63.6	140.4	-175	-65	-30.3	0	0	0	115
512	Q	28	Very low	34.1	Very low	136 Å²	136	137.4 Å²	137.4	64%	0.636	77%	0.771	S	S	*	*			cis	-161.8	178.6	-2.2	-114.4	159.9	28	0	0	107.4
513	F	29.3	Very low	32.7	Very low	174 Å²	174	138.3 Å²	138.3	76%	0.763	77%	0.774	S	S	*	*			cis	-146.3	-136.4	9.5	-139.4	-46.7	0	0	0	111.1
514	Q	29.8	Very low	32.4	Very low	161 Å²	161	134.6 Å²	134.6	75%	0.752	77%	0.772	S	S	*	*			trans	-167.4	-179.5	-173.9	-115.2	-167.8	43.8	0	0	109.3
515	P	50.3	Low	33.4	Very low	94 Å²	94	133.6 Å²	133.6	61%	0.61	77%	0.768	S	S	*	*			cis	-138.7	158.3	-5.8	35.2	-15.7	0	0	0	118.3
516	R	31.4	Very low	33.5	Very low	224 Å²	224	131.7 Å²	131.7	85%	0.845	77%	0.771	S	S	*	*			trans	62	154.5	140.3	-71.9	177.6	174	-173.6	-3.4	119.6
517	C	29.3	Very low	33.8	Very low	107 Å²	107	132.1 Å²	132.1	72%	0.723	77%	0.774	S	S	*	*			cis	-156.7	176.2	4.8	-128.4	0	0	0	0	108.8
518	V	28.7	Very low	33.5	Very low	132 Å²	132	135.8 Å²	135.8	80%	0.8	78%	0.778	S	S	*	*			cis	-144.3	-139.7	0.2	66.3	0	0	0	0	109.4
519	S	30.4	Very low	32.8	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	77%	0.774	S	S	*	*			trans	-145.2	163.1	-168.6	-44	0	0	0	0	114.5
520	P	43.4	Very low	32.7	Very low	114 Å²	114	139.6 Å²	139.6	74%	0.74	78%	0.775	S	S	*	*			trans	-111.2	161.7	171.3	40.1	-32.6	0	0	0	116
521	I	29.9	Very low	32.8	Very low	156 Å²	156	143.9 Å²	143.9	80%	0.8	78%	0.783	S	S	*	*			trans	32.1	129.3	143.7	-51.9	170.8	0	0	0	121.1
522	P	46	Very low	33.8	Very low	121 Å²	121	142.1 Å²	142.1	79%	0.786	78%	0.779	S	S	*	*			trans	-102.8	173.4	169.5	40.3	-34.2	0	0	0	115.5
523	V	30.6	Very low	33.9	Very low	138 Å²	138	142.1 Å²	142.1	84%	0.836	79%	0.788	S	S	*	*			trans	-140.7	156.1	-175.7	-166	0	0	0	0	112.3
524	S	31.3	Very low	34	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	79%	0.788	S	S	*	*			trans	-80.1	161.7	179.7	-38.1	0	0	0	0	115.4
525	P	46.2	Very low	33.9	Very low	126 Å²	126	139.2 Å²	139.2	82%	0.818	79%	0.79	S	S	*	*			trans	-139.2	171.2	147.3	38.8	-25.1	0	0	0	115.3
526	T	30.9	Very low	32.9	Very low	140 Å²	140	141.9 Å²	141.9	86%	0.859	80%	0.799	S	S	*	*			trans	-145.6	146.6	179.3	52.4	0	0	0	0	112.2
527	S	30.4	Very low	32.7	Very low	131 Å²	131	135.9 Å²	135.9	92%	0.916	79%	0.791	S	S	*	*			trans	-166.5	178.2	154.2	57.4	0	0	0	0	112.7
528	R	27.7	Very low	32.9	Very low	228 Å²	228	135.9 Å²	135.9	86%	0.86	79%	0.792	S	S	*	*			trans	-142.7	151.3	-153.1	-171.5	-160.3	-154.1	-177.9	9.2	109.8
529	I	28.3	Very low	32.9	Very low	130 Å²	130	135.8 Å²	135.8	67%	0.667	79%	0.791	S	S	*	*				151.4	129.1	126.6	-78.8	172.2	0	0	0	115.5
530	Q	26.5	Very low	33.1	Very low	191 Å²	191	138.3 Å²	138.3	89%	0.893	80%	0.796	S	S	*	*			trans	78.7	165.3	152.9	-82.6	162.1	-4.7	0	0	125.2
531	N	31.9	Very low	33.2	Very low	153 Å²	153	138.5 Å²	138.5	82%	0.818	80%	0.797	S	S	*	*			trans	-103.2	177.5	-157.4	-108	9.5	0	0	0	111.8
532	P	50.6	Low	33.1	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	80%	0.799	S	S	*	*			cis	-154.6	-169.5	45.6	38.1	-12.3	0	0	0	119.4
533	V	29.3	Very low	32.5	Very low	137 Å²	137	138.5 Å²	138.5	83%	0.83	80%	0.801	S	S	*	*			trans	88.4	139.4	165.3	-173.6	0	0	0	0	118.5
534	A	30.4	Very low	32.8	Very low	92 Å²	92	137.4 Å²	137.4	76%	0.76	80%	0.796	S	S	*	*			trans	-159.2	163.4	167.5	0	0	0	0	0	110.3
535	F	28	Very low	33	Very low	182 Å²	182	136.5 Å²	136.5	80%	0.798	80%	0.796	S	S	*	*			trans	-152	124.6	-175.7	-128.7	-103.2	0	0	0	114.2
536	L	29.3	Very low	32.4	Very low	150 Å²	150	137.8 Å²	137.8	79%	0.785	79%	0.794	S	S	*	*			trans	54.3	154.2	160.5	-61.5	178.4	0	0	0	119.4
537	S	28	Very low	32.6	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	79%	0.789	S	S	*	*			cis	179.6	160.8	-17.5	54.7	0	0	0	0	106.8
538	S	32.5	Very low	33.7	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	78%	0.781	S	S	*	*			cis	-168	-163.4	-5.7	38.2	0	0	0	0	105.2
539	V	29.1	Very low	33.8	Very low	130 Å²	130	130.6 Å²	130.6	79%	0.788	77%	0.774	S	S	*	*			cis	-149.7	164.3	8.6	-166.8	0	0	0	0	107.5
540	L	34.7	Very low	34	Very low	161 Å²	161	131.7 Å²	131.7	84%	0.843	78%	0.781	S	S	*	*			trans	-144.5	156.5	167.3	-86.1	171.7	0	0	0	111.5
541	P	46	Very low	34.1	Very low	118 Å²	118	127 Å²	127	77%	0.766	78%	0.775	S	S	*	*			trans	-128.6	152.5	147.6	36.8	-25.3	0	0	0	112.5
542	S	28.3	Very low	34	Very low	119 Å²	119	128.9 Å²	128.9	83%	0.832	78%	0.781	S	S	*	*			cis	-158.8	156.2	-8.9	43.9	0	0	0	0	112.2
543	L	32.4	Very low	32.9	Very low	158 Å²	158	127.2 Å²	127.2	83%	0.827	78%	0.784	S	S	*	*			trans	-81.7	176.4	178.9	-98.7	166.8	0	0	0	111.8
544	P	36	Very low	32.9	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	79%	0.787	S	S	*	*			cis	-149	173.9	42.3	42.6	-21.2	0	0	0	120.1
545	A	37.3	Very low	33.6	Very low	92 Å²	92	129.1 Å²	129.1	76%	0.76	78%	0.781	S	S	*	*			trans	-148.8	132.7	164.7	0	0	0	0	0	110.8
546	I	32.2	Very low	33.7	Very low	153 Å²	153	131.5 Å²	131.5	79%	0.785	79%	0.785	S	S	*	*			trans	-153.6	174.4	-179.3	-20.6	177.1	0	0	0	109.1
547	P	35.4	Very low	33.7	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	78%	0.782	S	S	*	*				-113	-171	-94.1	42	-27.1	0	0	0	114.9
548	P	54.2	Low	33.7	Very low	115 Å²	115	129.2 Å²	129.2	75%	0.747	79%	0.787	S	S	*	*			trans	-112.1	-169.2	-167.2	42.9	-35.7	0	0	0	117.3
549	T	30.1	Very low	34.6	Very low	118 Å²	118	129.9 Å²	129.9	72%	0.724	79%	0.789	S	S	*	*			trans	97.6	126.9	155.2	30	0	0	0	0	123.7
550	N	32.1	Very low	34.4	Very low	152 Å²	152	129.6 Å²	129.6	81%	0.813	79%	0.793	S	S	*	*			trans	76.9	124.2	146.2	-61.3	-20.9	0	0	0	122.9
551	A	28.4	Very low	34.3	Very low	92 Å²	92	130.4 Å²	130.4	76%	0.76	79%	0.794	S	S	*	*				-177.8	144.9	108.5	0	0	0	0	0	115.3
552	M	29.4	Very low	34.6	Very low	194 Å²	194	129.7 Å²	129.7	96%	0.956	79%	0.79	S	S	*	*			trans	63.1	151.8	164	-52	-152.5	-67.4	0	0	119.4
553	G	28.1	Very low	34.6	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	79%	0.786	S	S	*	*			cis	-170	171.8	-2	0	0	0	0	0	114
554	L	29.6	Very low	34.4	Very low	170 Å²	170	131.1 Å²	131.1	89%	0.89	79%	0.791	S	S	*	*			trans	-116.7	178.9	-179.2	-93.7	171.6	0	0	0	110
555	P	44.5	Very low	33.9	Very low	100 Å²	100	129 Å²	129	65%	0.649	79%	0.791	S	S	*	*			cis	-155.1	-176.5	29.1	47.7	-26.6	0	0	0	120.6
556	R	30.4	Very low	33.4	Very low	231 Å²	231	132.7 Å²	132.7	87%	0.872	80%	0.797	S	S	*	*			trans	67.5	168.2	156.7	-70.5	172.7	-175.3	-170.1	0.6	119.6
557	S	29.4	Very low	33.2	Very low	105 Å²	105	129.2 Å²	129.2	73%	0.734	79%	0.791	S	S	*	*				171.6	141.4	-65.2	53.4	0	0	0	0	111.9
558	A	27.8	Very low	32.9	Very low	96 Å²	96	133.2 Å²	133.2	79%	0.793	80%	0.796	S	S	*	*			cis	-154.5	-65.4	-13.4	0	0	0	0	0	117.2
559	P	51.3	Low	31.6	Very low	119 Å²	119	136.7 Å²	136.7	77%	0.773	80%	0.8	S	S	*	*			trans	-127.5	152.6	-147	39.5	-24	0	0	0	119
560	S	25.3	Very low	31.4	Very low	125 Å²	125	137.6 Å²	137.6	87%	0.874	80%	0.8	S	S	*	*			trans	175.5	168.2	137.2	47.4	0	0	0	0	114.2
561	M	31.4	Very low	31.3	Very low	177 Å²	177	135.8 Å²	135.8	87%	0.872	80%	0.795	S	S	*	*			trans	-153.6	162.3	172.3	-96.9	-84.9	-161.5	0	0	106.1
562	P	53.7	Low	31.3	Very low	104 Å²	104	141 Å²	141	68%	0.675	80%	0.8	S	S	*	*			cis	-130	-169.4	-10.6	40.5	-23.3	0	0	0	112.7
563	S	27.8	Very low	31.2	Very low	108 Å²	108	137 Å²	137	76%	0.755	79%	0.792	S	S	*	*				148.9	130.3	120.7	62.7	0	0	0	0	118.1
564	Q	28.3	Very low	31.7	Very low	198 Å²	198	139.7 Å²	139.7	93%	0.925	80%	0.795	S	S	*	*			trans	42	131.7	143.7	-58.9	-169.5	3	0	0	125
565	G	25	Very low	31.6	Very low	72 Å²	72	139.6 Å²	139.6	74%	0.742	79%	0.79	S	S	*	*			trans	105	154	142.7	0	0	0	0	0	117.1
566	L	26.5	Very low	31.6	Very low	169 Å²	169	140 Å²	140	89%	0.885	79%	0.793	S	S	*	*			cis	-170	148.9	-15.5	-130.2	171	0	0	0	109.4
567	A	28.4	Very low	31.7	Very low	79 Å²	79	133.7 Å²	133.7	65%	0.653	78%	0.78	S	S	*	*			trans	65.3	163.6	164	0	0	0	0	0	118.2
568	K	28.6	Very low	31.8	Very low	200 Å²	200	135.7 Å²	135.7	87%	0.87	78%	0.783	S	S	*	*			cis	-157.9	140.9	-22.4	-108.3	167.3	-171.6	174.3	0	111
569	K	27.1	Very low	32.3	Very low	187 Å²	187	136.9 Å²	136.9	81%	0.813	78%	0.776	S	S	*	*			trans	5.8	145.8	151.6	-78.1	-174.3	173.6	-176.9	0	123.2
570	N	27.1	Very low	31.7	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	78%	0.781	S	S	*	*			trans	76.1	154.7	146	-66.7	11.9	0	0	0	117.6
571	T	28.3	Very low	32.2	Very low	114 Å²	114	139.4 Å²	139.4	70%	0.699	77%	0.773	S	S	*	*			cis	-157.7	149.1	8.2	-10.7	0	0	0	0	114.2
572	K	28.8	Very low	32.6	Very low	201 Å²	201	135.9 Å²	135.9	87%	0.874	76%	0.756	S	S	*	*			trans	61.1	152.6	146.4	-87.3	177.9	178.4	-173.9	0	123.6
573	S	27.8	Very low	32.1	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	77%	0.765	S	S	*	*			trans	-74.4	172.1	179.2	3.2	0	0	0	0	114.3
574	P	38	Very low	32.7	Very low	129 Å²	129	144.2 Å²	144.2	84%	0.838	77%	0.765	S	S	*	*			cis	-137.3	-177.2	37	40.2	-19.7	0	0	0	118.9
575	Q	29	Very low	33.1	Very low	168 Å²	168	138.7 Å²	138.7	79%	0.785	75%	0.745	S	S	*	*			trans	-76.7	171.7	179.5	-87.8	-108.6	-14.7	0	0	113.2
576	P	43	Very low	33.7	Very low	109 Å²	109	142.3 Å²	142.3	71%	0.708	74%	0.74	S	S	*	*			cis	-148	171.9	32.8	45.8	-25.8	0	0	0	121.3
577	V	32.8	Very low	34.3	Very low	99 Å²	99	139.6 Å²	139.6	60%	0.6	73%	0.726	S	S	*	*			trans	52	123.8	162	-130.2	0	0	0	0	122.4
578	N	30.8	Very low	35	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	72%	0.72	S	S	*	*				177.4	88.2	118.8	-91.9	-0	0	0	0	114	D580	N578-D580 PolarHBondContact O-N 2.81Å
579	D	38.9	Very low	35.4	Very low	121 Å²	121	133.1 Å²	133.1	65%	0.647	70%	0.702	S	S	*	*			trans	44.8	-20	136.2	-67	9.5	0	0	0	126.1	N581	D579-N581 PolarHBondContact O-N 2.97Å
580	D	39	Very low	36.1	Very low	166 Å²	166	130.4 Å²	130.4	89%	0.888	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-3.3	-175.1	-99.9	-46.5	0	0	0	115.7	N578	N578-D580 PolarHBondContact O-N 2.81Å
581	N	35.7	Very low	36.6	Very low	131 Å²	131	133.6 Å²	133.6	70%	0.701	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-9.5	178.4	-105.4	-68.4	0	0	0	114.8	D579 R583 T585	D579-N581 PolarHBondContact O-N 2.97Å; N581-R583 PolarHBondContact O-N 2.95Å; N581-R583 VanDerWaalsContact O-N 3.13Å; N581-T585 PolarHBondContact O-OG1 3.08Å; N581-T585 VanDerWaalsContact O-OG1 3.1Å
582	I	40.6	Very low	36.9	Very low	103 Å²	103	134.5 Å²	134.5	53%	0.528	70%	0.697	S	S	.	*	H	α-helix	trans	-69.7	-16.5	-166	-66.9	174.4	0	0	0	113.3
583	R	42.2	Very low	37.1	Very low	226 Å²	226	130.3 Å²	130.3	85%	0.853	68%	0.684	S	S	*	*	H	α-helix	trans	-89.7	-25.5	-172.5	-135.6	170.9	-173.7	167.6	1.4	115.4	N581	N581-R583 PolarHBondContact O-N 2.95Å; N581-R583 VanDerWaalsContact O-N 3.13Å
584	E	40.1	Very low	37.4	Very low	161 Å²	161	128.3 Å²	128.3	75%	0.752	68%	0.68	S	S	*	*	H	α-helix	trans	-92.6	-32	177.3	-66	-155.8	126	0	0	113.3	K586 N587 A588	E584-K586 PolarHBondContact O-N 3.4Å; E584-N587 PolarHBondContact O-N 3.42Å; E584-N587 VanDerWaalsContact O-N 3.08Å; E584-A588 PolarHBondContact O-N 2.82Å
585	T	37	Very low	37.3	Very low	82 Å²	82	131.1 Å²	131.1	50%	0.503	68%	0.679	S	S	.	*	H	α-helix	trans	-62.4	-32.3	179.4	-17.8	0	0	0	0	112.5	N581 N587 A588 V589	N581-T585 PolarHBondContact O-OG1 3.08Å; N581-T585 VanDerWaalsContact O-OG1 3.1Å; T585-N587 VanDerWaalsContact C-N 3.3Å; T585-N587 PolarHBondContact O-N 2.93Å; T585-A588 PolarHBondContact O-N 2.62Å; T585-V589 WeakPolarHBondContact O-CG2 3.16Å; T585-V589 PolarHBondContact O-N 2.8Å
586	K	37.2	Very low	37.6	Very low	147 Å²	147	132.3 Å²	132.3	64%	0.639	68%	0.682	S	S	*	*	H	α-helix	trans	-60.8	-34.7	175.1	-84.3	-173.7	172	-179.5	0	113.1	E584 I590	E584-K586 PolarHBondContact O-N 3.4Å; K586-I590 VanDerWaalsContact O-CD1 3.3Å; K586-I590 WeakPolarHBondContact O-CD1 3.41Å; K586-I590 VanDerWaalsContact O-CG1 3.3Å; K586-I590 WeakPolarHBondContact O-CG1 3.39Å
587	N	40.8	Very low	36.9	Very low	112 Å²	112	133.8 Å²	133.8	60%	0.599	68%	0.682	S	S	*	*	H	α-helix	trans	-86.1	-15.1	-176.3	-71.6	-16.8	0	0	0	113.9	E584 T585	E584-N587 PolarHBondContact O-N 3.42Å; E584-N587 VanDerWaalsContact O-N 3.08Å; T585-N587 VanDerWaalsContact C-N 3.3Å; T585-N587 PolarHBondContact O-N 2.93Å
588	A	41.9	Very low	36.6	Very low	64 Å²	64	135.5 Å²	135.5	53%	0.529	69%	0.693	S	S	.	*	H	α-helix	trans	-83.2	-48.8	171.9	0	0	0	0	0	112	E584 T585 I590 R591	E584-A588 PolarHBondContact O-N 2.82Å; T585-A588 PolarHBondContact O-N 2.62Å; A588-I590 VanDerWaalsContact C-N 3.33Å; A588-I590 PolarHBondContact O-N 2.94Å; A588-R591 WeakPolarHBondContact O-CB 3.43Å; A588-R591 PolarHBondContact O-N 2.8Å
589	V	37.8	Very low	36.3	Very low	80 Å²	80	138 Å²	138	49%	0.485	70%	0.698	S	S	.	*	H	α-helix	trans	-63.7	-35.6	-173.8	172.9	0	0	0	0	112.7	T585 R591 D592 L593	T585-V589 WeakPolarHBondContact O-CG2 3.16Å; T585-V589 PolarHBondContact O-N 2.8Å; V589-R591 PolarHBondContact O-N 2.87Å; V589-R591 VanDerWaalsContact O-N 3.15Å; V589-D592 PolarHBondContact O-N 2.83Å; V589-L593 HydrophobicContact CG1-CD1 3.91Å; V589-L593 PolarHBondContact O-N 3.45Å
590	I	41.3	Very low	35.8	Very low	129 Å²	129	137.1 Å²	137.1	66%	0.662	70%	0.701	S	S	*	*	H	α-helix	trans	-59.2	-24.9	175.3	-69.8	171.2	0	0	0	112.3	K586 A588	K586-I590 VanDerWaalsContact O-CD1 3.3Å; K586-I590 WeakPolarHBondContact O-CD1 3.41Å; K586-I590 VanDerWaalsContact O-CG1 3.3Å; K586-I590 WeakPolarHBondContact O-CG1 3.39Å; A588-I590 VanDerWaalsContact C-N 3.33Å; A588-I590 PolarHBondContact O-N 2.94Å
591	R	36.7	Very low	35.1	Very low	206 Å²	206	136.8 Å²	136.8	78%	0.777	70%	0.699	S	S	*	*	H	α-helix	trans	-88.4	-16.5	-176.3	-156.7	175.5	-66.2	159.9	1.7	114.3	A588 V589	A588-R591 WeakPolarHBondContact O-CB 3.43Å; A588-R591 PolarHBondContact O-N 2.8Å; V589-R591 PolarHBondContact O-N 2.87Å; V589-R591 VanDerWaalsContact O-N 3.15Å
592	D	35.3	Very low	34.7	Very low	132 Å²	132	136.1 Å²	136.1	71%	0.706	70%	0.699	S	S	*	*	H	α-helix	trans	-106.5	-29.7	-175.2	-150.1	43.4	0	0	0	113.2	V589 G594	V589-D592 PolarHBondContact O-N 2.83Å; D592-G594 PolarHBondContact O-N 2.84Å
593	L	32.3	Very low	33.9	Very low	114 Å²	114	142.2 Å²	142.2	60%	0.597	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-62.3	-25.5	171.6	-95.8	160.1	0	0	0	113.4	V589 K595 I597	V589-L593 HydrophobicContact CG1-CD1 3.91Å; V589-L593 PolarHBondContact O-N 3.45Å; L593-K595 PolarHBondContact O-N 2.85Å; L593-K595 VanDerWaalsContact O-N 3.13Å; L593-I597 HydrophobicContact CD2-CD1 4.37Å
594	G	34.8	Very low	33.2	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-74.3	8.1	-177.5	0	0	0	0	0	116.5	D592	D592-G594 PolarHBondContact O-N 2.84Å
595	K	37.3	Very low	32.5	Very low	188 Å²	188	137.5 Å²	137.5	82%	0.817	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-134.5	10.3	-174.7	-74.4	-169.9	175.7	179.8	0	116.5	L593	L593-K595 PolarHBondContact O-N 2.85Å; L593-K595 VanDerWaalsContact O-N 3.13Å
596	K	34.7	Very low	31.8	Very low	194 Å²	194	140.9 Å²	140.9	84%	0.843	73%	0.729	S	S	*	*	S	Bend	trans	-148.9	28.4	-177	-135.7	177.6	-176.9	-177.7	0	118.3
597	I	28.2	Very low	31.3	Very low	139 Å²	139	142 Å²	142	71%	0.713	74%	0.736	S	S	*	*			trans	-133.4	106.9	165.6	-52.9	178.1	0	0	0	109.3	L593	L593-I597 HydrophobicContact CD2-CD1 4.37Å
598	T	26	Very low	30.4	Very low	136 Å²	136	143.8 Å²	143.8	83%	0.834	74%	0.741	S	S	*	*			trans	-150	96.6	165.3	51.4	0	0	0	0	109.2
599	F	25	Very low	29.8	Very low	200 Å²	200	148.2 Å²	148.2	88%	0.877	75%	0.745	S	S	*	*			trans	-142	137.3	157	-114.6	-84.3	0	0	0	109.1
600	S	28.3	Very low	29.2	Very low	101 Å²	101	152.5 Å²	152.5	71%	0.706	76%	0.757	S	S	*	*			trans	7.7	125.2	163.9	54	0	0	0	0	119.6
601	D	23.5	Very low	28.8	Very low	160 Å²	160	149.8 Å²	149.8	86%	0.856	74%	0.743	S	S	*	*			trans	-142	161.8	133.5	-151.4	-15.6	0	0	0	110.1
602	V	28.1	Very low	28.9	Very low	117 Å²	117	142.6 Å²	142.6	71%	0.709	72%	0.724	S	S	*	*			trans	-114.7	138	-158.9	176.9	0	0	0	0	113.3
603	R	24.6	Very low	29	Very low	231 Å²	231	141.4 Å²	141.4	87%	0.872	73%	0.726	S	S	*	*			trans	-162	165.7	155.8	-111.3	153.4	-113.6	-141.6	-4.5	110.7
604	P	26.6	Very low	29.4	Very low	112 Å²	112	142.3 Å²	142.3	73%	0.727	73%	0.726	S	S	*	*				-90.5	169.1	-129.5	33.9	-41.2	0	0	0	116.5	Q606	P604-Q606 PolarHBondContact O-N 2.92Å
605	N	25.7	Very low	29.8	Very low	175 Å²	175	141.9 Å²	141.9	94%	0.936	71%	0.706	S	S	*	*			trans	-51.4	99.3	171.4	-82.4	-18	0	0	0	112.8
606	Q	22.5	Very low	30	Very low	153 Å²	153	137.4 Å²	137.4	72%	0.715	69%	0.688	S	S	*	*			trans	-98.3	142.3	140	-68.3	-173.7	-16.2	0	0	107.5	P604 E608	P604-Q606 PolarHBondContact O-N 2.92Å; Q606-E608 PolarHBondContact O-N 2.82Å; Q606-E608 VanDerWaalsContact O-N 3.09Å
607	Q	25.5	Very low	30.6	Very low	170 Å²	170	137.2 Å²	137.2	79%	0.794	68%	0.682	S	S	*	*			trans	-61.9	116.4	171.7	-77.8	175	-30.3	0	0	108.8	Y609	Q607-Y609 VanDerWaalsContact C-N 3.33Å; Q607-Y609 PolarHBondContact O-N 2.85Å
608	E	22.6	Very low	31.5	Very low	151 Å²	151	132.1 Å²	132.1	71%	0.706	66%	0.656	S	S	*	*			trans	-62.9	94.7	174.1	-174.6	-173.7	-131.4	0	0	108.7	Q606 K610	Q606-E608 PolarHBondContact O-N 2.82Å; Q606-E608 VanDerWaalsContact O-N 3.09Å; E608-K610 VanDerWaalsContact C-N 3.26Å; E608-K610 HydrophobicContact CG-CG 4.27Å; E608-K610 PolarHBondContact O-N 3.18Å; E608-K610 WeakPolarHBondContact OE2-CE 3.49Å; E608-K610 IonicContact OE2-NZ 2.81Å
609	Y	30	Very low	32.5	Very low	157 Å²	157	127.5 Å²	127.5	62%	0.616	63%	0.625	S	S	*	*			trans	-62.3	91.9	168.3	-89.9	-88.5	0	0	0	108	Q607 I611 R656	Q607-Y609 VanDerWaalsContact C-N 3.33Å; Q607-Y609 PolarHBondContact O-N 2.85Å; Y609-I611 VanDerWaalsContact C-N 3.34Å; Y609-I611 PolarHBondContact O-N 2.91Å; Y609-R656 VanDerWaalsContact CZ-NH2 3.26Å
610	K	24.9	Very low	33.6	Very low	169 Å²	169	122.3 Å²	122.3	74%	0.735	61%	0.606	S	S	*	*			trans	-63.7	98.7	175.5	-73.3	-175.8	178.1	177.5	0	109	E608 S612	E608-K610 VanDerWaalsContact C-N 3.26Å; E608-K610 HydrophobicContact CG-CG 4.27Å; E608-K610 PolarHBondContact O-N 3.18Å; E608-K610 WeakPolarHBondContact OE2-CE 3.49Å; E608-K610 IonicContact OE2-NZ 2.81Å; K610-S612 PolarHBondContact O-N 2.77Å
611	I	32.5	Very low	34.4	Very low	72 Å²	72	121.3 Å²	121.3	37%	0.369	59%	0.591	S	S	.	*			trans	-39.9	119.8	172	-60.3	167.3	0	0	0	107.7	Y609 E615 Q616 M619	Y609-I611 VanDerWaalsContact C-N 3.34Å; Y609-I611 PolarHBondContact O-N 2.91Å; I611-E615 HydrophobicContact CG2-CB 3.53Å; I611-Q616 HydrophobicContact CG2-CB 3.91Å; I611-Q616 VanDerWaalsContact CG2-N 3.35Å; I611-M619 HydrophobicContact CD1-CE 3.76Å; I611-M619 HydrophobicContact CG2-CE 4.34Å
612	S	38.4	Very low	35.6	Very low	55 Å²	55	114.4 Å²	114.4	39%	0.385	55%	0.554	S	S	.	*			trans	-54.3	146.8	179.1	173.6	0	0	0	0	109.8	K610 F614 E615 Q616	K610-S612 PolarHBondContact O-N 2.77Å; S612-F614 CarbonylContact O-C 3.56Å; S612-F614 PolarHBondContact O-N 2.81Å; S612-F614 PolarHBondContact OG-N 3.49Å; S612-E615 WeakPolarHBondContact CB-OE2 3.27Å; S612-E615 PolarHBondContact N-OE2 2.8Å; S612-E615 CarbonylContact O-C 3.5Å; S612-E615 WeakPolarHBondContact O-CA 3.21Å; S612-E615 PolarHBondContact O-N 2.97Å; S612-Q616 WeakPolarHBondContact O-CB 3.21Å; S612-Q616 PolarHBondContact O-N 2.88Å
613	S	38.4	Very low	36.6	Very low	107 Å²	107	112.7 Å²	112.7	75%	0.748	54%	0.538	S	S	*	.	H	α-helix	trans	-60.1	-18.6	175	58.9	0	0	0	0	112.9	R617	S613-R617 WeakPolarHBondContact O-CB 3.41Å; S613-R617 PolarHBondContact O-N 2.91Å
614	F	40.4	Very low	37.6	Very low	134 Å²	134	106.7 Å²	106.7	59%	0.588	52%	0.518	S	S	*	.	H	α-helix	trans	-72.5	-51.7	165.1	176.6	-100.2	0	0	0	112.5	S612 Q616 R617 L618	S612-F614 CarbonylContact O-C 3.56Å; S612-F614 PolarHBondContact O-N 2.81Å; S612-F614 PolarHBondContact OG-N 3.49Å; F614-Q616 VanDerWaalsContact C-N 3.34Å; F614-Q616 PolarHBondContact O-N 2.8Å; F614-R617 PolarHBondContact O-N 2.94Å; F614-L618 HydrophobicContact CE1-CD2 4.05Å; F614-L618 HydrophobicContact CZ-CD2 4.37Å; F614-L618 VanDerWaalsContact O-CB 3.28Å; F614-L618 WeakPolarHBondContact O-CB 3.44Å; F614-L618 PolarHBondContact O-N 2.93Å
615	E	42.6	Very low	38.4	Very low	58 Å²	58	108.3 Å²	108.3	27%	0.271	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-39.1	178.7	-67.3	170.5	128	0	0	111.9	I611 S612 L618 M619	I611-E615 HydrophobicContact CG2-CB 3.53Å; S612-E615 WeakPolarHBondContact CB-OE2 3.27Å; S612-E615 PolarHBondContact N-OE2 2.8Å; S612-E615 CarbonylContact O-C 3.5Å; S612-E615 WeakPolarHBondContact O-CA 3.21Å; S612-E615 PolarHBondContact O-N 2.97Å; E615-L618 PolarHBondContact O-N 2.82Å; E615-M619 WeakPolarHBondContact O-CB 3.45Å; E615-M619 WeakPolarHBondContact O-CG 3.3Å; E615-M619 PolarHBondContact O-N 2.8Å
616	Q	42.3	Very low	39.4	Very low	94 Å²	94	103.5 Å²	103.5	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-64.2	-44.5	175.7	-166.4	95.3	61.7	0	0	110.5	I611 S612 F614 M619 N620	I611-Q616 HydrophobicContact CG2-CB 3.91Å; I611-Q616 VanDerWaalsContact CG2-N 3.35Å; S612-Q616 WeakPolarHBondContact O-CB 3.21Å; S612-Q616 PolarHBondContact O-N 2.88Å; F614-Q616 VanDerWaalsContact C-N 3.34Å; F614-Q616 PolarHBondContact O-N 2.8Å; Q616-M619 PolarHBondContact O-N 3.04Å; Q616-N620 PolarHBondContact O-N 2.79Å; Q616-N620 PolarHBondContact O-OD1 3.17Å
617	R	46.4	Very low	40.4	Very low	191 Å²	191	103.7 Å²	103.7	72%	0.721	49%	0.485	S	S	*	.	H	α-helix	trans	-67.5	-36.7	176.5	-175.6	174.4	-178.1	162.8	1.3	112	S613 F614 N620 E621	S613-R617 WeakPolarHBondContact O-CB 3.41Å; S613-R617 PolarHBondContact O-N 2.91Å; F614-R617 PolarHBondContact O-N 2.94Å; R617-N620 PolarHBondContact O-N 2.94Å; R617-E621 WeakPolarHBondContact O-CB 3.49Å; R617-E621 PolarHBondContact O-N 3.47Å
618	L	47.5	Very low	41	Very low	32 Å²	32	103.8 Å²	103.8	17%	0.168	48%	0.478	C	S	.	.	H	α-helix	trans	-68.6	-40.9	175.5	-179.8	60.6	0	0	0	111.4	F614 E615 E621 I622	F614-L618 HydrophobicContact CE1-CD2 4.05Å; F614-L618 HydrophobicContact CZ-CD2 4.37Å; F614-L618 VanDerWaalsContact O-CB 3.28Å; F614-L618 WeakPolarHBondContact O-CB 3.44Å; F614-L618 PolarHBondContact O-N 2.93Å; E615-L618 PolarHBondContact O-N 2.82Å; L618-E621 PolarHBondContact O-N 2.85Å; L618-I622 HydrophobicContact CD1-CD1 3.98Å; L618-I622 HydrophobicContact CD1-CG1 4.27Å; L618-I622 HydrophobicContact CG-CD1 3.84Å; L618-I622 WeakPolarHBondContact O-CB 3.49Å; L618-I622 VanDerWaalsContact O-CG1 3.22Å; L618-I622 WeakPolarHBondContact O-CG1 3.25Å; L618-I622 PolarHBondContact O-N 3.5Å
619	M	46.2	Very low	41.5	Very low	38 Å²	38	100.7 Å²	100.7	19%	0.187	47%	0.469	C	S	.	.	H	α-helix	trans	-63.6	-42.4	172.9	-74.6	-139.9	-80.9	0	0	111.5	I611 E615 Q616 E621 I622 E623	I611-M619 HydrophobicContact CD1-CE 3.76Å; I611-M619 HydrophobicContact CG2-CE 4.34Å; E615-M619 WeakPolarHBondContact O-CB 3.45Å; E615-M619 WeakPolarHBondContact O-CG 3.3Å; E615-M619 PolarHBondContact O-N 2.8Å; Q616-M619 PolarHBondContact O-N 3.04Å; M619-E621 PolarHBondContact O-N 3.02Å; M619-I622 PolarHBondContact O-N 3.42Å; M619-E623 WeakPolarHBondContact O-CB 3.45Å; M619-E623 PolarHBondContact O-N 2.9Å
620	N	47.9	Very low	41.8	Very low	91 Å²	91	99 Å²	99	49%	0.487	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-37.1	174.6	-66	13.5	0	0	0	112.5	Q616 R617 F624	Q616-N620 PolarHBondContact O-N 2.79Å; Q616-N620 PolarHBondContact O-OD1 3.17Å; R617-N620 PolarHBondContact O-N 2.94Å; N620-F624 VanDerWaalsContact O-CB 3.26Å; N620-F624 WeakPolarHBondContact O-CB 3.29Å; N620-F624 PolarHBondContact O-N 3.26Å
621	E	46.5	Very low	42.4	Very low	80 Å²	80	96.7 Å²	96.7	37%	0.374	48%	0.477	S	S	.	.	H	α-helix	trans	-68.1	-38.7	174.8	178.8	82	-136.9	0	0	111.9	R617 L618 M619 R625	R617-E621 WeakPolarHBondContact O-CB 3.49Å; R617-E621 PolarHBondContact O-N 3.47Å; L618-E621 PolarHBondContact O-N 2.85Å; M619-E621 PolarHBondContact O-N 3.02Å; E621-R625 VanDerWaalsContact O-CG 3.26Å; E621-R625 WeakPolarHBondContact O-CG 3.47Å; E621-R625 PolarHBondContact O-N 3.01Å; E621-R625 IonicContact OE1-CZ 2.86Å; E621-R625 IonicContact OE1-NE 3.61Å; E621-R625 PolarHBondContact OE1-NE 2.62Å; E621-R625 IonicContact OE1-NH2 2.96Å; E621-R625 PolarHBondContact OE1-NH2 2.83Å
622	I	48.8	Very low	42.5	Very low	16 Å²	16	100.6 Å²	100.6	8%	0.082	50%	0.499	C	S	.	.	H	α-helix	trans	-69	-43.2	174.9	-73.1	167	0	0	0	110.6	L618 M619 R625 L626 F685 M726	L618-I622 HydrophobicContact CD1-CD1 3.98Å; L618-I622 HydrophobicContact CD1-CG1 4.27Å; L618-I622 HydrophobicContact CG-CD1 3.84Å; L618-I622 WeakPolarHBondContact O-CB 3.49Å; L618-I622 VanDerWaalsContact O-CG1 3.22Å; L618-I622 WeakPolarHBondContact O-CG1 3.25Å; L618-I622 PolarHBondContact O-N 3.5Å; M619-I622 PolarHBondContact O-N 3.42Å; I622-R625 PolarHBondContact O-N 2.84Å; I622-L626 HydrophobicContact CG2-CD1 3.69Å; I622-L626 HydrophobicContact CG2-CG 4.25Å; I622-L626 WeakPolarHBondContact O-CB 3.33Å; I622-L626 WeakPolarHBondContact O-CG 3.25Å; I622-L626 PolarHBondContact O-N 2.88Å; I622-F685 HydrophobicContact CD1-CD1 4.16Å; I622-F685 HydrophobicContact CD1-CE1 3.71Å; I622-F685 HydrophobicContact CD1-CE2 4.38Å; I622-F685 HydrophobicContact CD1-CZ 3.85Å; I622-F685 HydrophobicContact CG1-CE1 3.9Å; I622-F685 HydrophobicContact CG1-CZ 4.3Å; I622-F685 HydrophobicContact CG2-CE1 4.34Å; I622-F685 HydrophobicContact CG2-CZ 4.09Å; I622-M726 HydrophobicContact CG2-CE 4.35Å; I622-M726 HydrophobicContact CG2-SD 4.44Å
623	E	48.8	Very low	42.8	Very low	80 Å²	80	106.7 Å²	106.7	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-49	176.9	-174.9	153	-104.3	0	0	111.5	M619 R625 L626 E627 R733	M619-E623 WeakPolarHBondContact O-CB 3.45Å; M619-E623 PolarHBondContact O-N 2.9Å; E623-R625 PolarHBondContact O-N 2.85Å; E623-R625 VanDerWaalsContact O-N 3.14Å; E623-L626 PolarHBondContact O-N 3.09Å; E623-L626 VanDerWaalsContact O-N 3.17Å; E623-E627 PolarHBondContact O-N 2.89Å; E623-R733 IonicContact OE1-CZ 3.71Å; E623-R733 IonicContact OE1-NH1 3.37Å; E623-R733 PolarHBondContact OE1-NH1 3.34Å; E623-R733 IonicContact OE1-NH2 3.97Å
624	F	45.5	Very low	42.8	Very low	106 Å²	106	105.3 Å²	105.3	47%	0.465	51%	0.512	S	S	.	.	H	α-helix	trans	-58.8	-25.1	174.3	179.7	-100	0	0	0	114	N620 R628	N620-F624 VanDerWaalsContact O-CB 3.26Å; N620-F624 WeakPolarHBondContact O-CB 3.29Å; N620-F624 PolarHBondContact O-N 3.26Å; F624-R628 VanDerWaalsContact CE2-CZ 3.44Å; F624-R628 WeakPolarHBondContact O-CD 3.09Å; F624-R628 WeakPolarHBondContact O-CG 3.48Å
625	R	43.5	Very low	42.7	Very low	146 Å²	146	105.5 Å²	105.5	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-88.6	-38.3	175.5	-70	173.5	-171.8	-147	5.2	112.3	E621 I622 E623 E627 R628 T629	E621-R625 VanDerWaalsContact O-CG 3.26Å; E621-R625 WeakPolarHBondContact O-CG 3.47Å; E621-R625 PolarHBondContact O-N 3.01Å; E621-R625 IonicContact OE1-CZ 2.86Å; E621-R625 IonicContact OE1-NE 3.61Å; E621-R625 PolarHBondContact OE1-NE 2.62Å; E621-R625 IonicContact OE1-NH2 2.96Å; E621-R625 PolarHBondContact OE1-NH2 2.83Å; I622-R625 PolarHBondContact O-N 2.84Å; E623-R625 PolarHBondContact O-N 2.85Å; E623-R625 VanDerWaalsContact O-N 3.14Å; R625-E627 VanDerWaalsContact C-N 3.32Å; R625-E627 PolarHBondContact O-N 2.93Å; R625-R628 CarbonylContact O-C 3.38Å; R625-R628 PolarHBondContact O-N 2.88Å; R625-T629 PolarHBondContact O-N 2.88Å; R625-T629 PolarHBondContact O-OG1 3.24Å
626	L	45.8	Very low	42.4	Very low	73 Å²	73	109.8 Å²	109.8	38%	0.382	54%	0.544	S	S	.	.	H	α-helix	trans	-65.5	-32.4	175.9	-75.1	170	0	0	0	112.7	I622 E623 R628 M726	I622-L626 HydrophobicContact CG2-CD1 3.69Å; I622-L626 HydrophobicContact CG2-CG 4.25Å; I622-L626 WeakPolarHBondContact O-CB 3.33Å; I622-L626 WeakPolarHBondContact O-CG 3.25Å; I622-L626 PolarHBondContact O-N 2.88Å; E623-L626 PolarHBondContact O-N 3.09Å; E623-L626 VanDerWaalsContact O-N 3.17Å; L626-R628 PolarHBondContact O-N 2.86Å; L626-M726 HydrophobicContact CD1-CE 4.48Å
627	E	42.8	Very low	42.5	Very low	158 Å²	158	115 Å²	115	74%	0.738	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-10	170.9	-71.4	-168.4	143.1	0	0	114	E623 R625	E623-E627 PolarHBondContact O-N 2.89Å; R625-E627 VanDerWaalsContact C-N 3.32Å; R625-E627 PolarHBondContact O-N 2.93Å
628	R	38.3	Very low	42.1	Very low	171 Å²	171	113.1 Å²	113.1	65%	0.645	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.7	-11	-168	-67.5	-173.8	175.4	-149.8	-4.1	115.4	F624 R625 L626 P630	F624-R628 VanDerWaalsContact CE2-CZ 3.44Å; F624-R628 WeakPolarHBondContact O-CD 3.09Å; F624-R628 WeakPolarHBondContact O-CG 3.48Å; R625-R628 CarbonylContact O-C 3.38Å; R625-R628 PolarHBondContact O-N 2.88Å; L626-R628 PolarHBondContact O-N 2.86Å; R628-P630 WeakPolarHBondContact O-CD 3.42Å
629	T	34.9	Very low	41.6	Very low	87 Å²	87	119.2 Å²	119.2	53%	0.534	60%	0.598	S	S	.	*	S	Bend	trans	-75.8	115.4	162.3	44.5	0	0	0	0	108.8	R625 V631	R625-T629 PolarHBondContact O-N 2.88Å; R625-T629 PolarHBondContact O-OG1 3.24Å; T629-V631 PolarHBondContact O-N 3.34Å
630	P	35.4	Very low	41.4	Very low	121 Å²	121	127 Å²	127	79%	0.786	63%	0.634	S	S	*	*			trans	-58.8	140.1	167.6	27.4	-33.6	0	0	0	108.7	R628 D632	R628-P630 WeakPolarHBondContact O-CD 3.42Å; P630-D632 PolarHBondContact O-N 2.84Å
631	V	37.6	Very low	40.9	Very low	121 Å²	121	129 Å²	129	73%	0.733	64%	0.644	S	S	*	*			trans	-72.1	114.6	175.9	179.1	0	0	0	0	107.6	T629 E633	T629-V631 PolarHBondContact O-N 3.34Å; V631-E633 HydrophobicContact CG1-CG 4.09Å; V631-E633 PolarHBondContact O-N 2.93Å; V631-E633 VanDerWaalsContact O-N 3.12Å
632	D	33.6	Very low	40.6	Very low	153 Å²	153	134 Å²	134	82%	0.818	67%	0.668	S	S	*	*			trans	-72.8	98.3	168.4	-126	-23.1	0	0	0	107.3	P630 S634	P630-D632 PolarHBondContact O-N 2.84Å; D632-S634 PolarHBondContact O-N 2.85Å
633	E	44.9	Very low	40	Very low	183 Å²	183	140.7 Å²	140.7	86%	0.855	70%	0.702	S	S	*	*			trans	-75.4	85.4	-178.2	-68.3	-173.9	150.3	0	0	110.3	V631	V631-E633 HydrophobicContact CG1-CG 4.09Å; V631-E633 PolarHBondContact O-N 2.93Å; V631-E633 VanDerWaalsContact O-N 3.12Å
634	S	39.6	Very low	39.5	Very low	78 Å²	78	141.6 Å²	141.6	55%	0.545	72%	0.715	S	S	.	*			trans	-146	117.5	164.1	46.7	0	0	0	0	112.7	D632	D632-S634 PolarHBondContact O-N 2.85Å
635	D	37.6	Very low	39.5	Very low	139 Å²	139	144 Å²	144	74%	0.743	74%	0.739	S	S	*	*			trans	48	104.8	153.8	-49.7	-22.2	0	0	0	119.5
636	D	36.2	Very low	39.9	Very low	147 Å²	147	139.4 Å²	139.4	79%	0.786	74%	0.737	S	S	*	*				-159.9	110.5	111.5	-88.5	-37.6	0	0	0	108.5	I638	D636-I638 PolarHBondContact O-N 2.87Å
637	E	43.8	Very low	40.1	Very low	203 Å²	203	144.9 Å²	144.9	95%	0.949	76%	0.757	S	S	*	*			trans	-72.2	121.8	172.6	-71.3	-172	119.5	0	0	110.8
638	I	38.3	Very low	40.7	Very low	153 Å²	153	140.6 Å²	140.6	79%	0.785	74%	0.744	S	S	*	*			trans	-134.8	139.6	159	-60.3	-176.1	0	0	0	108.5	D636	D636-I638 PolarHBondContact O-N 2.87Å
639	Q	37.2	Very low	41.8	Very low	160 Å²	160	136 Å²	136	75%	0.748	73%	0.732	S	S	*	*			trans	-56.8	147.4	-160.7	-69.5	144.7	-71.7	0	0	115.8	D641	Q639-D641 PolarHBondContact O-N 2.82Å
640	H	42.9	Very low	42.8	Very low	202 Å²	202	133.9 Å²	133.9	94%	0.935	72%	0.723	S	S	*	*			trans	-72.7	77.2	159.7	-92.9	-84.2	0	0	0	109.9
641	D	35.9	Very low	44.3	Very low	132 Å²	132	128.2 Å²	128.2	71%	0.706	69%	0.686	S	S	*	*			trans	-68.5	151.6	164.2	-72.4	-24.5	0	0	0	110.5	Q639	Q639-D641 PolarHBondContact O-N 2.82Å
642	E	41.1	Very low	45.4	Very low	184 Å²	184	125.8 Å²	125.8	86%	0.86	67%	0.668	S	S	*	*			trans	-62.6	147.7	-164.7	-58	-177.3	135.5	0	0	113.5	P644	E642-P644 WeakPolarHBondContact O-CD 3.41Å; E642-P644 VanDerWaalsContact O-N 3.13Å
643	I	36.3	Very low	46.8	Very low	158 Å²	158	120.1 Å²	120.1	81%	0.81	64%	0.637	S	S	*	*			trans	-63.6	112.1	175.9	-58.3	173.4	0	0	0	108.6	T645	I643-T645 PolarHBondContact O-N 2.92Å
644	P	39.1	Very low	47.4	Very low	98 Å²	98	116.1 Å²	116.1	64%	0.636	62%	0.621	S	S	*	*			trans	-70	127	179.8	-16.4	32.4	0	0	0	109	E642 G646	E642-P644 WeakPolarHBondContact O-CD 3.41Å; E642-P644 VanDerWaalsContact O-N 3.13Å; P644-G646 PolarHBondContact O-N 3.01Å
645	T	44	Very low	48.4	Very low	157 Å²	157	117.9 Å²	117.9	96%	0.963	62%	0.619	S	S	*	*	S	Bend	trans	-74.6	34.9	-179.9	45.1	0	0	0	0	113.2	I643	I643-T645 PolarHBondContact O-N 2.92Å
646	G	52.5	Low	50	Low	50 Å²	50	116.1 Å²	116.1	52%	0.515	60%	0.602	S	S	.	*	S	Bend	trans	-109.3	178.1	-177.5	0	0	0	0	0	113.8	P644 C648	P644-G646 PolarHBondContact O-N 3.01Å; G646-C648 PolarHBondContact O-N 2.84Å
647	K	50.5	Low	51.3	Low	187 Å²	187	109.9 Å²	109.9	81%	0.813	57%	0.568	S	S	*	*			trans	-68.7	117.7	179.5	-65.5	174	-178.3	171.5	0	110.6
648	C	55.2	Low	52	Low	69 Å²	69	107.2 Å²	107.2	47%	0.466	55%	0.554	S	S	.	*			trans	-68.3	144.8	168.2	-56.1	0	0	0	0	110.6	G646 I677 Q731	G646-C648 PolarHBondContact O-N 2.84Å; C648-I677 CarbonylContact C-O 3.56Å; C648-I677 WeakPolarHBondContact CA-O 3.24Å; C648-Q731 HydrophobicContact CB-CG 3.6Å
649	I	61.6	Low	53.1	Low	74 Å²	74	105.8 Å²	105.8	38%	0.379	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	126.9	-175.4	-52.1	-177.8	0	0	0	108.8	I677 N729	I649-I677 HydrophobicContact CB-CB 4.2Å; I649-I677 HydrophobicContact CB-CG1 4.35Å; I649-I677 HydrophobicContact CD1-CD1 3.77Å; I649-I677 HydrophobicContact CD1-CG1 4.23Å; I649-I677 HydrophobicContact CG1-CB 4.27Å; I649-I677 HydrophobicContact CG1-CD1 4.16Å; I649-I677 HydrophobicContact CG1-CG1 4.28Å; I649-I677 PolarHBondContact N-O 2.9Å; I649-I677 PolarHBondContact O-N 2.86Å; I649-I677 VanDerWaalsContact O-O 3.09Å; I649-N729 PolarHBondContact O-ND2 3.04Å
650	A	55.6	Low	53.9	Low	42 Å²	42	101.3 Å²	101.3	35%	0.347	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	149.8	173.1	0	0	0	0	0	111.5	I652 Q731	A650-I652 PolarHBondContact O-N 3.4Å; A650-Q731 HydrophobicContact CB-CB 4.08Å
651	P	67.1	Low	55.1	Low	3 Å²	3	99.1 Å²	99.1	2%	0.019	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	132.8	-178	28.8	-35.6	0	0	0	111	I674 V675 P680 A727 N729 G732 I734	P651-I674 HydrophobicContact CB-CG2 4.34Å; P651-V675 CarbonylContact C-O 3.55Å; P651-V675 VanDerWaalsContact CA-O 3.31Å; P651-V675 WeakPolarHBondContact CA-O 3.5Å; P651-P680 HydrophobicContact CB-CB 3.96Å; P651-P680 HydrophobicContact CB-CG 4.03Å; P651-A727 HydrophobicContact CB-CB 4.26Å; P651-N729 WeakPolarHBondContact CD-OD1 3.49Å; P651-G732 WeakPolarHBondContact CD-O 3.36Å; P651-G732 WeakPolarHBondContact CG-O 3.39Å; P651-I734 VanDerWaalsContact C-CD1 3.45Å; P651-I734 HydrophobicContact CB-CD1 3.94Å; P651-I734 HydrophobicContact CB-CG1 3.91Å; P651-I734 HydrophobicContact CG-CG1 4Å; P651-I734 VanDerWaalsContact O-CD1 3.29Å; P651-I734 WeakPolarHBondContact O-CD1 3.27Å; P651-I734 WeakPolarHBondContact O-CG2 3.36Å
652	I	61	Low	56.7	Low	69 Å²	69	94 Å²	94	35%	0.354	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.9	176.1	60.1	172	0	0	0	111	A650 D654 I674 V675 I734	A650-I652 PolarHBondContact O-N 3.4Å; I652-D654 PolarHBondContact O-N 2.9Å; I652-I674 WeakPolarHBondContact O-CA 3.31Å; I652-V675 HydrophobicContact CG1-CB 4.06Å; I652-V675 PolarHBondContact N-O 3.37Å; I652-V675 PolarHBondContact O-N 2.89Å; I652-I734 VanDerWaalsContact C-CD1 3.49Å
653	F	62	Low	58.3	Low	35 Å²	35	88.5 Å²	88.5	15%	0.154	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	106.3	170.8	-68.8	-68	0	0	0	110.4	K655 R656 I674 I725 I734 S735 C736	F653-K655 VanDerWaalsContact C-N 3.33Å; F653-R656 HydrophobicContact CB-CG 3.76Å; F653-R656 HydrophobicContact CD2-CG 4.42Å; F653-R656 HydrophobicContact CG-CG 4.09Å; F653-I674 HydrophobicContact CD1-CD1 4.45Å; F653-I674 HydrophobicContact CD1-CG1 3.7Å; F653-I674 HydrophobicContact CE1-CD1 3.98Å; F653-I674 HydrophobicContact CE1-CG1 3.72Å; F653-I725 HydrophobicContact CE1-CG2 3.8Å; F653-I725 HydrophobicContact CZ-CG2 4.03Å; F653-I734 HydrophobicContact CD1-CD1 4.13Å; F653-I734 HydrophobicContact CD2-CB 4.35Å; F653-I734 HydrophobicContact CD2-CD1 3.62Å; F653-I734 HydrophobicContact CD2-CG1 4.35Å; F653-I734 HydrophobicContact CE1-CD1 4.08Å; F653-I734 HydrophobicContact CE2-CB 3.8Å; F653-I734 HydrophobicContact CE2-CD1 3.55Å; F653-I734 HydrophobicContact CE2-CG1 3.83Å; F653-I734 HydrophobicContact CG-CD1 3.9Å; F653-I734 HydrophobicContact CZ-CB 4.39Å; F653-I734 HydrophobicContact CZ-CD1 3.78Å; F653-I734 HydrophobicContact CZ-CG1 4.02Å; F653-S735 WeakPolarHBondContact CE2-O 3.41Å; F653-C736 HydrophobicContact CD2-CB 4.16Å; F653-C736 HydrophobicContact CE1-CB 4.49Å; F653-C736 WeakPolarHBondContact CE1-SG 3.34Å; F653-C736 HydrophobicContact CE2-CB 3.73Å; F653-C736 HydrophobicContact CZ-CB 3.92Å; F653-C736 WeakPolarHBondContact CZ-SG 3.18Å
654	D	58.6	Low	60.4	Low	98 Å²	98	84.4 Å²	84.4	52%	0.524	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-32.1	166.3	-177.2	48.4	0	0	0	110.7	I652 K673 V675	I652-D654 PolarHBondContact O-N 2.9Å; D654-K673 HydrophobicContact CB-CB 4.24Å; D654-K673 HydrophobicContact CB-CG 4.17Å; D654-K673 PolarHBondContact N-O 3.06Å; D654-K673 VanDerWaalsContact OD2-CD 3.26Å; D654-K673 WeakPolarHBondContact OD2-CD 3.42Å; D654-K673 WeakPolarHBondContact OD2-CE 3.31Å; D654-K673 IonicContact OD2-NZ 2.66Å; D654-K673 PolarHBondContact OD2-NZ 3.39Å; D654-V675 HydrophobicContact CB-CG2 4.15Å
655	K	60.6	Low	62.1	Low	115 Å²	115	81.9 Å²	81.9	50%	0.5	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	121.7	174	-171.6	177.5	179.5	-177.9	0	110	F653 C672 K673	F653-K655 VanDerWaalsContact C-N 3.33Å; K655-C672 CarbonylContact O-C 3.59Å; K655-C672 VanDerWaalsContact O-CA 3.22Å; K655-C672 WeakPolarHBondContact O-CA 3.22Å; K655-C672 WeakPolarHBondContact O-CB 3.31Å; K655-K673 HydrophobicContact CB-CB 3.79Å; K655-K673 PolarHBondContact N-O 2.85Å; K655-K673 VanDerWaalsContact N-O 3.15Å; K655-K673 PolarHBondContact O-N 3.42Å
656	R	70.8	Confident	63.4	Low	102 Å²	102	75.8 Å²	75.8	39%	0.385	39%	0.39	S	S	.	.			trans	-85.8	164.9	178.6	-65.4	-174	-176.7	-142.5	4.3	112.1	Y609 F653 C736	Y609-R656 VanDerWaalsContact CZ-NH2 3.26Å; F653-R656 HydrophobicContact CB-CG 3.76Å; F653-R656 HydrophobicContact CD2-CG 4.42Å; F653-R656 HydrophobicContact CG-CG 4.09Å; R656-C736 HydrophobicContact CG-CB 4.4Å
657	L	62.6	Low	64.5	Low	17 Å²	17	77.3 Å²	77.3	9%	0.089	39%	0.391	C	S	.	.			trans	-62.1	158.6	173.7	-62.5	179.5	0	0	0	112.2	F670 C672 W684 I725	L657-F670 HydrophobicContact CD2-CB 4.12Å; L657-F670 HydrophobicContact CD2-CD1 4.33Å; L657-C672 HydrophobicContact CD2-CB 3.84Å; L657-C672 HydrophobicContact CG-CB 4.39Å; L657-W684 HydrophobicContact CD1-CZ3 3.92Å; L657-W684 HydrophobicContact CD2-CH2 3.63Å; L657-W684 HydrophobicContact CD2-CZ3 3.84Å; L657-I725 HydrophobicContact CD1-CB 4.24Å; L657-I725 HydrophobicContact CD1-CG2 3.9Å; L657-I725 HydrophobicContact CG-CG2 4.14Å
658	K	59.8	Low	66	Low	146 Å²	146	68.7 Å²	68.7	64%	0.635	35%	0.354	S	S	*	.			trans	-118.5	158	173.3	-65.3	-170.3	175.8	-169.2	0	110.3	F670	K658-F670 VanDerWaalsContact O-CE1 3.29Å; K658-F670 WeakPolarHBondContact O-CE1 3.43Å
659	H	59.8	Low	67.4	Low	124 Å²	124	68 Å²	68	57%	0.574	35%	0.348	S	S	*	.			trans	-80.5	148.9	169.2	-48.7	-93.6	0	0	0	110.2	H739	H659-H739 CarbonylContact C-O 3.59Å; H659-H739 VanDerWaalsContact CA-O 3.28Å; H659-H739 WeakPolarHBondContact CA-O 3.28Å; H659-H739 WeakPolarHBondContact ND1-CB 3.47Å; H659-H739 PolarHBondContact ND1-N 2.92Å
660	F	55.8	Low	68.1	Low	66 Å²	66	64.4 Å²	64.4	29%	0.289	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	149.6	178.3	-74.6	-83.3	0	0	0	111.2	V668 T669 F670 H739 L740 M741	F660-V668 HydrophobicContact CB-CG2 3.87Å; F660-V668 HydrophobicContact CD1-CG2 3.79Å; F660-V668 HydrophobicContact CD2-CG2 3.85Å; F660-V668 HydrophobicContact CE1-CG2 4.25Å; F660-V668 HydrophobicContact CE2-CG2 4.3Å; F660-V668 HydrophobicContact CG-CG2 3.57Å; F660-V668 HydrophobicContact CZ-CG2 4.48Å; F660-T669 WeakPolarHBondContact CZ-O 3.26Å; F660-F670 HydrophobicContact CD2-CD1 4.04Å; F660-F670 AromaticContact CD2-CE1 3.81Å; F660-F670 HydrophobicContact CD2-CE1 3.81Å; F660-F670 HydrophobicContact CD2-CZ 4.13Å; F660-F670 HydrophobicContact CE2-CD1 4.07Å; F660-F670 HydrophobicContact CE2-CE1 4.31Å; F660-F670 HydrophobicContact CE2-CG 4.46Å; F660-H739 PolarHBondContact N-O 2.72Å; F660-L740 HydrophobicContact CB-CD1 3.75Å; F660-M741 PolarHBondContact O-N 2.74Å
661	R	67.6	Low	69.1	Low	156 Å²	156	64.9 Å²	64.9	59%	0.589	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	124	167.8	-171.7	-179.2	-139.3	-151.5	3.4	108	M741 Q743	R661-M741 WeakPolarHBondContact CA-O 3.47Å; R661-M741 HydrophobicContact CB-CB 4.27Å; R661-M741 HydrophobicContact CB-CE 4.32Å; R661-M741 HydrophobicContact CG-CB 3.92Å; R661-Q743 VanDerWaalsContact CD-OE1 3.25Å; R661-Q743 HydrophobicContact CG-CG 4.26Å
662	V	68.4	Low	69.5	Low	23 Å²	23	64.8 Å²	64.8	14%	0.139	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	159.7	-174.5	-62.1	0	0	0	0	110.6	V668 T715 L740 M741 V742 Q743	V662-V668 HydrophobicContact CG1-CB 4.33Å; V662-V668 HydrophobicContact CG1-CG2 4.37Å; V662-T715 HydrophobicContact CG2-CG2 3.97Å; V662-T715 VanDerWaalsContact CG2-OG1 3.31Å; V662-T715 WeakPolarHBondContact CG2-OG1 3.28Å; V662-L740 HydrophobicContact CG2-CD1 3.87Å; V662-M741 PolarHBondContact N-O 2.63Å; V662-V742 HydrophobicContact CG2-CG2 4.25Å; V662-V742 WeakPolarHBondContact O-CA 3.27Å; V662-Q743 PolarHBondContact O-N 2.7Å
663	T	75	Confident	70.4	Confident	69 Å²	69	64.1 Å²	64.1	42%	0.423	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	149	169.5	33.1	0	0	0	0	111.2	G665 S666 T715 Q743	T663-G665 PolarHBondContact O-N 3.22Å; T663-S666 WeakPolarHBondContact O-CB 3.35Å; T663-S666 PolarHBondContact O-N 3.49Å; T663-S666 VanDerWaalsContact O-N 3.08Å; T663-S666 PolarHBondContact O-OG 3.36Å; T663-S666 PolarHBondContact OG1-OG 3.44Å; T663-T715 PolarHBondContact O-OG1 2.64Å; T663-Q743 WeakPolarHBondContact CA-O 3.29Å; T663-Q743 HydrophobicContact CG2-CB 4.45Å
664	E	81.3	Confident	71.3	Confident	73 Å²	73	62.8 Å²	62.8	34%	0.341	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	134.6	173.7	-172.3	168	-146.5	0	0	111.4	T715 S717 V742 Q743 S744	E664-T715 CarbonylContact C-O 3.55Å; E664-T715 WeakPolarHBondContact CA-O 3.36Å; E664-S717 PolarHBondContact OE1-N 2.88Å; E664-V742 HydrophobicContact CB-CG1 4.11Å; E664-Q743 PolarHBondContact N-O 2.78Å; E664-S744 WeakPolarHBondContact OE2-CA 3.4Å; E664-S744 WeakPolarHBondContact OE2-CB 3.41Å
665	G	74.3	Confident	72.3	Confident	45 Å²	45	61 Å²	61	46%	0.464	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-2.5	-171.2	0	0	0	0	0	116	T663 T715	T663-G665 PolarHBondContact O-N 3.22Å; G665-T715 PolarHBondContact N-O 2.85Å
666	S	71.4	Confident	72.9	Confident	28 Å²	28	56 Å²	56	20%	0.196	29%	0.289	C	S	.	.			trans	-89.5	148	-178.1	-43.5	0	0	0	0	112.5	T663 S714 T715	T663-S666 WeakPolarHBondContact O-CB 3.35Å; T663-S666 PolarHBondContact O-N 3.49Å; T663-S666 VanDerWaalsContact O-N 3.08Å; T663-S666 PolarHBondContact O-OG 3.36Å; T663-S666 PolarHBondContact OG1-OG 3.44Å; S666-S714 WeakPolarHBondContact O-CA 3.38Å; S666-T715 PolarHBondContact O-N 2.88Å; S666-T715 PolarHBondContact O-OG1 2.83Å
667	P	75.1	Confident	72.8	Confident	82 Å²	82	54.8 Å²	54.8	53%	0.532	29%	0.29	S	S	.	.			trans	-74	149.5	168.9	29.3	-33.6	0	0	0	112	I712 E713	P667-I712 CarbonylContact C-O 3.57Å; P667-I712 VanDerWaalsContact CA-O 3.27Å; P667-I712 WeakPolarHBondContact CA-O 3.25Å; P667-E713 WeakPolarHBondContact CA-O 3.21Å; P667-E713 WeakPolarHBondContact CB-O 3.08Å
668	V	81.6	Confident	73.4	Confident	7 Å²	7	57 Å²	57	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.3	169.9	68	0	0	0	0	111.2	F660 V662 H711 I712 T715 L740	F660-V668 HydrophobicContact CB-CG2 3.87Å; F660-V668 HydrophobicContact CD1-CG2 3.79Å; F660-V668 HydrophobicContact CD2-CG2 3.85Å; F660-V668 HydrophobicContact CE1-CG2 4.25Å; F660-V668 HydrophobicContact CE2-CG2 4.3Å; F660-V668 HydrophobicContact CG-CG2 3.57Å; F660-V668 HydrophobicContact CZ-CG2 4.48Å; V662-V668 HydrophobicContact CG1-CB 4.33Å; V662-V668 HydrophobicContact CG1-CG2 4.37Å; V668-H711 WeakPolarHBondContact O-CA 3.45Å; V668-H711 PolarHBondContact O-ND1 3.01Å; V668-I712 HydrophobicContact CG1-CB 3.97Å; V668-I712 HydrophobicContact CG1-CD1 4.02Å; V668-I712 HydrophobicContact CG1-CG1 4.23Å; V668-I712 PolarHBondContact N-O 3.49Å; V668-I712 PolarHBondContact O-N 2.81Å; V668-T715 HydrophobicContact CB-CG2 4.32Å; V668-T715 HydrophobicContact CG1-CG2 3.52Å; V668-L740 HydrophobicContact CB-CD1 4.45Å; V668-L740 HydrophobicContact CG1-CD1 4.07Å; V668-L740 HydrophobicContact CG1-CD2 3.97Å; V668-L740 HydrophobicContact CG2-CD1 4.13Å
669	T	84.8	Confident	74.2	Confident	53 Å²	53	55.4 Å²	55.4	33%	0.325	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	108	177.6	-46.9	0	0	0	0	110.8	F660 T671 L710 H711	F660-T669 WeakPolarHBondContact CZ-O 3.26Å; T669-T671 HydrophobicContact CG2-CG2 3.86Å; T669-L710 CarbonylContact C-O 3.54Å; T669-L710 WeakPolarHBondContact CA-O 3.5Å; T669-H711 HydrophobicContact CG2-CB 4.24Å; T669-H711 PolarHBondContact OG1-ND1 3.36Å
670	F	76.1	Confident	75.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.9	165.4	-76.6	-81.5	0	0	0	109.4	L657 K658 F660 W684 S709 L710 Y723 L740	L657-F670 HydrophobicContact CD2-CB 4.12Å; L657-F670 HydrophobicContact CD2-CD1 4.33Å; K658-F670 VanDerWaalsContact O-CE1 3.29Å; K658-F670 WeakPolarHBondContact O-CE1 3.43Å; F660-F670 HydrophobicContact CD2-CD1 4.04Å; F660-F670 AromaticContact CD2-CE1 3.81Å; F660-F670 HydrophobicContact CD2-CE1 3.81Å; F660-F670 HydrophobicContact CD2-CZ 4.13Å; F660-F670 HydrophobicContact CE2-CD1 4.07Å; F660-F670 HydrophobicContact CE2-CE1 4.31Å; F660-F670 HydrophobicContact CE2-CG 4.46Å; F670-W684 HydrophobicContact CB-CH2 3.77Å; F670-W684 HydrophobicContact CB-CZ3 3.86Å; F670-S709 CarbonylContact O-C 3.6Å; F670-S709 VanDerWaalsContact O-CA 3.28Å; F670-S709 WeakPolarHBondContact O-CA 3.34Å; F670-L710 HydrophobicContact CB-CB 4.24Å; F670-L710 PolarHBondContact N-O 2.72Å; F670-L710 PolarHBondContact O-N 2.83Å; F670-Y723 HydrophobicContact CD2-CD2 4.42Å; F670-Y723 HydrophobicContact CD2-CG 4.15Å; F670-Y723 HydrophobicContact CE2-CD1 4.3Å; F670-Y723 AromaticContact CE2-CD2 3.48Å; F670-Y723 HydrophobicContact CE2-CD2 3.48Å; F670-Y723 VanDerWaalsContact CE2-CD2 3.48Å; F670-Y723 HydrophobicContact CE2-CE2 4.05Å; F670-Y723 AromaticContact CE2-CG 3.62Å; F670-Y723 HydrophobicContact CE2-CG 3.62Å; F670-Y723 AromaticContact CZ-CD2 3.66Å; F670-Y723 HydrophobicContact CZ-CD2 3.66Å; F670-Y723 HydrophobicContact CZ-CE2 4.48Å; F670-Y723 AromaticContact CZ-CG 3.96Å; F670-Y723 HydrophobicContact CZ-CG 3.96Å; F670-L740 HydrophobicContact CE2-CB 4.21Å; F670-L740 HydrophobicContact CE2-CD2 4.45Å; F670-L740 HydrophobicContact CZ-CB 3.95Å
671	T	77.8	Confident	76	Confident	52 Å²	52	53.6 Å²	53.6	32%	0.319	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.2	179.4	57.4	0	0	0	0	110.7	T669	T669-T671 HydrophobicContact CG2-CG2 3.86Å
672	C	75.2	Confident	76.7	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	165.4	172.9	66.6	0	0	0	0	109.2	K655 L657 T707 C708 I725	K655-C672 CarbonylContact O-C 3.59Å; K655-C672 VanDerWaalsContact O-CA 3.22Å; K655-C672 WeakPolarHBondContact O-CA 3.22Å; K655-C672 WeakPolarHBondContact O-CB 3.31Å; L657-C672 HydrophobicContact CD2-CB 3.84Å; L657-C672 HydrophobicContact CG-CB 4.39Å; C672-T707 WeakPolarHBondContact O-CA 3.34Å; C672-C708 PolarHBondContact N-O 2.83Å; C672-C708 PolarHBondContact O-N 3.49Å; C672-C708 PolarHBondContact SG-O 2.9Å; C672-I725 WeakPolarHBondContact SG-CD1 3.48Å
673	K	79.4	Confident	77.1	Confident	56 Å²	56	50.2 Å²	50.2	24%	0.243	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.1	175.8	-172.4	164.9	170.6	-114.2	0	109.7	D654 K655 D705	D654-K673 HydrophobicContact CB-CB 4.24Å; D654-K673 HydrophobicContact CB-CG 4.17Å; D654-K673 PolarHBondContact N-O 3.06Å; D654-K673 VanDerWaalsContact OD2-CD 3.26Å; D654-K673 WeakPolarHBondContact OD2-CD 3.42Å; D654-K673 WeakPolarHBondContact OD2-CE 3.31Å; D654-K673 IonicContact OD2-NZ 2.66Å; D654-K673 PolarHBondContact OD2-NZ 3.39Å; K655-K673 HydrophobicContact CB-CB 3.79Å; K655-K673 PolarHBondContact N-O 2.85Å; K655-K673 VanDerWaalsContact N-O 3.15Å; K655-K673 PolarHBondContact O-N 3.42Å; K673-D705 WeakPolarHBondContact CE-O 3.15Å; K673-D705 WeakPolarHBondContact CE-OD2 3.36Å
674	I	81.9	Confident	77.4	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.036	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.5	-170.7	-64.1	155.3	0	0	0	109	P651 I652 F653 P680 V682 G706 C708 I725 A727 I734	P651-I674 HydrophobicContact CB-CG2 4.34Å; I652-I674 WeakPolarHBondContact O-CA 3.31Å; F653-I674 HydrophobicContact CD1-CD1 4.45Å; F653-I674 HydrophobicContact CD1-CG1 3.7Å; F653-I674 HydrophobicContact CE1-CD1 3.98Å; F653-I674 HydrophobicContact CE1-CG1 3.72Å; I674-P680 HydrophobicContact CG2-CG 3.62Å; I674-V682 HydrophobicContact CD1-CG2 3.72Å; I674-G706 PolarHBondContact N-O 3.05Å; I674-G706 WeakPolarHBondContact O-CA 3.23Å; I674-C708 HydrophobicContact CD1-CB 4.27Å; I674-I725 HydrophobicContact CD1-CD1 3.99Å; I674-A727 HydrophobicContact CD1-CB 3.93Å; I674-A727 HydrophobicContact CG1-CB 4.49Å; I674-A727 HydrophobicContact CG2-CB 3.88Å; I674-I734 HydrophobicContact CG2-CD1 4.41Å
675	V	80.2	Confident	76.8	Confident	60 Å²	60	44 Å²	44	36%	0.364	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	139.2	177.5	-179	0	0	0	0	108.8	P651 I652 D654	P651-V675 CarbonylContact C-O 3.55Å; P651-V675 VanDerWaalsContact CA-O 3.31Å; P651-V675 WeakPolarHBondContact CA-O 3.5Å; I652-V675 HydrophobicContact CG1-CB 4.06Å; I652-V675 PolarHBondContact N-O 3.37Å; I652-V675 PolarHBondContact O-N 2.89Å; D654-V675 HydrophobicContact CB-CG2 4.15Å
676	G	72.9	Confident	76.9	Confident	9 Å²	9	43.9 Å²	43.9	9%	0.093	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.6	151.7	177.2	0	0	0	0	0	112.2	P678	G676-P678 CarbonylContact C-O 3.45Å; G676-P678 CarbonylContact O-C 3.56Å
677	I	68.3	Low	76.3	Confident	77 Å²	77	47 Å²	47	40%	0.395	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	118.1	-175.8	-55.3	-178.2	0	0	0	109.3	C648 I649 N729	C648-I677 CarbonylContact C-O 3.56Å; C648-I677 WeakPolarHBondContact CA-O 3.24Å; I649-I677 HydrophobicContact CB-CB 4.2Å; I649-I677 HydrophobicContact CB-CG1 4.35Å; I649-I677 HydrophobicContact CD1-CD1 3.77Å; I649-I677 HydrophobicContact CD1-CG1 4.23Å; I649-I677 HydrophobicContact CG1-CB 4.27Å; I649-I677 HydrophobicContact CG1-CD1 4.16Å; I649-I677 HydrophobicContact CG1-CG1 4.28Å; I649-I677 PolarHBondContact N-O 2.9Å; I649-I677 PolarHBondContact O-N 2.86Å; I649-I677 VanDerWaalsContact O-O 3.09Å; I677-N729 PolarHBondContact N-ND2 2.85Å; I677-N729 PolarHBondContact O-ND2 2.94Å
678	P	74.4	Confident	75.1	Confident	63 Å²	63	44.5 Å²	44.5	41%	0.409	24%	0.244	S	C	.	.	S	Bend	cis	-59.9	161.9	-6.8	-23.3	34.6	0	0	0	113.6	G676 N729	G676-P678 CarbonylContact C-O 3.45Å; G676-P678 CarbonylContact O-C 3.56Å; P678-N729 WeakPolarHBondContact O-CB 3.41Å; P678-N729 PolarHBondContact O-ND2 2.83Å
679	V	78	Confident	74.1	Confident	113 Å²	113	52 Å²	52	69%	0.685	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-55.7	120.6	-177.8	-178.5	0	0	0	0	110.3
680	P	78.6	Confident	73.5	Confident	4 Å²	4	53.6 Å²	53.6	3%	0.026	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-70.4	145.1	-171.1	25.3	-33.2	0	0	0	113	P651 I674 R702 A727 A728 N729	P651-P680 HydrophobicContact CB-CB 3.96Å; P651-P680 HydrophobicContact CB-CG 4.03Å; I674-P680 HydrophobicContact CG2-CG 3.62Å; P680-R702 PolarHBondContact O-NH1 2.89Å; P680-R702 PolarHBondContact O-NH2 3.25Å; P680-A727 HydrophobicContact CB-CB 4.23Å; P680-A727 HydrophobicContact CG-CB 4.47Å; P680-A728 CarbonylContact C-O 3.45Å; P680-A728 VanDerWaalsContact CA-O 3.28Å; P680-A728 WeakPolarHBondContact CA-O 3.41Å; P680-A728 WeakPolarHBondContact CB-O 3.49Å; P680-N729 HydrophobicContact CB-CB 4.1Å
681	K	73.6	Confident	73.6	Confident	149 Å²	149	54.2 Å²	54.2	65%	0.648	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	140.8	165.7	-64.5	-176.2	179.3	-177.6	0	108.8	Y683 A727 A728	K681-Y683 HydrophobicContact CB-CE2 3.88Å; K681-A727 CarbonylContact O-C 3.58Å; K681-A727 WeakPolarHBondContact O-CA 3.39Å; K681-A728 PolarHBondContact N-O 3.11Å; K681-A728 PolarHBondContact O-N 3.34Å
682	V	83	Confident	73.3	Confident	37 Å²	37	55.7 Å²	55.7	22%	0.224	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.1	-176	155.1	0	0	0	0	111.3	I674 R702 I725 M726 A727	I674-V682 HydrophobicContact CD1-CG2 3.72Å; V682-R702 VanDerWaalsContact CB-NH2 3.34Å; V682-I725 HydrophobicContact CG1-CD1 3.62Å; V682-I725 HydrophobicContact CG1-CG1 3.76Å; V682-M726 CarbonylContact C-O 3.58Å; V682-M726 WeakPolarHBondContact CA-O 3.16Å; V682-A727 HydrophobicContact CG2-CB 3.75Å
683	Y	77.4	Confident	72.6	Confident	71 Å²	71	64.8 Å²	64.8	28%	0.278	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136	-176.2	-52.3	-94.8	0	0	0	108.5	K681 I725 M726 A728	K681-Y683 HydrophobicContact CB-CE2 3.88Å; Y683-I725 WeakPolarHBondContact O-CA 3.17Å; Y683-M726 HydrophobicContact CD2-CE 3.67Å; Y683-M726 HydrophobicContact CE2-CE 4.33Å; Y683-M726 HydrophobicContact CG-CE 4Å; Y683-M726 PolarHBondContact N-O 3.36Å; Y683-M726 PolarHBondContact O-N 2.73Å; Y683-A728 HydrophobicContact CE2-CB 4.49Å
684	W	80.5	Confident	71.9	Confident	5 Å²	5	72.4 Å²	72.4	2%	0.019	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	149	174.7	-70.2	87.2	0	0	0	110.5	L657 F670 Q690 I691 M700 L710 T724 I725	L657-W684 HydrophobicContact CD1-CZ3 3.92Å; L657-W684 HydrophobicContact CD2-CH2 3.63Å; L657-W684 HydrophobicContact CD2-CZ3 3.84Å; F670-W684 HydrophobicContact CB-CH2 3.77Å; F670-W684 HydrophobicContact CB-CZ3 3.86Å; W684-Q690 WeakPolarHBondContact O-CA 3.37Å; W684-Q690 WeakPolarHBondContact O-CG 3.27Å; W684-I691 HydrophobicContact CB-CB 4.3Å; W684-I691 HydrophobicContact CB-CD1 4.1Å; W684-I691 HydrophobicContact CB-CG1 4.39Å; W684-I691 PolarHBondContact O-N 2.99Å; W684-M700 HydrophobicContact CB-SD 4.1Å; W684-M700 HydrophobicContact CG-CG 4.34Å; W684-M700 HydrophobicContact CG-SD 4.06Å; W684-L710 HydrophobicContact CD2-CB 3.8Å; W684-L710 HydrophobicContact CD2-CD2 4.01Å; W684-L710 HydrophobicContact CD2-CG 4.35Å; W684-L710 HydrophobicContact CE3-CB 3.84Å; W684-L710 HydrophobicContact CE3-CD2 3.61Å; W684-L710 HydrophobicContact CE3-CG 4.3Å; W684-L710 HydrophobicContact CG-CD2 4.5Å; W684-L710 HydrophobicContact CH2-CB 3.56Å; W684-L710 HydrophobicContact CZ2-CB 3.53Å; W684-L710 HydrophobicContact CZ3-CB 3.72Å; W684-L710 HydrophobicContact CZ3-CD2 3.96Å; W684-L710 HydrophobicContact CZ3-CG 4.5Å; W684-T724 CarbonylContact C-O 3.45Å; W684-T724 WeakPolarHBondContact CA-O 3.16Å; W684-I725 HydrophobicContact CD2-CB 4.04Å; W684-I725 HydrophobicContact CD2-CD1 4.02Å; W684-I725 HydrophobicContact CD2-CG1 3.8Å; W684-I725 VanDerWaalsContact CE2-CD1 3.41Å; W684-I725 HydrophobicContact CE3-CB 3.87Å; W684-I725 HydrophobicContact CE3-CD1 4.48Å; W684-I725 HydrophobicContact CE3-CG1 4.17Å; W684-I725 HydrophobicContact CG-CG1 4.24Å; W684-I725 HydrophobicContact CH2-CB 4.34Å; W684-I725 HydrophobicContact CH2-CD1 3.97Å; W684-I725 HydrophobicContact CH2-CG1 4.48Å; W684-I725 HydrophobicContact CZ2-CB 4.45Å; W684-I725 HydrophobicContact CZ2-CD1 3.4Å; W684-I725 VanDerWaalsContact CZ2-CD1 3.4Å; W684-I725 HydrophobicContact CZ2-CG1 4.11Å; W684-I725 HydrophobicContact CZ3-CB 4.03Å; W684-I725 HydrophobicContact CZ3-CD1 4.46Å; W684-I725 HydrophobicContact CZ3-CG1 4.49Å
685	F	69.5	Low	71.6	Confident	7 Å²	7	74.9 Å²	74.9	3%	0.031	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.9	179.5	-58	-105	0	0	0	109.4	I622 K689 Q690 Y723 T724 M726	I622-F685 HydrophobicContact CD1-CD1 4.16Å; I622-F685 HydrophobicContact CD1-CE1 3.71Å; I622-F685 HydrophobicContact CD1-CE2 4.38Å; I622-F685 HydrophobicContact CD1-CZ 3.85Å; I622-F685 HydrophobicContact CG1-CE1 3.9Å; I622-F685 HydrophobicContact CG1-CZ 4.3Å; I622-F685 HydrophobicContact CG2-CE1 4.34Å; I622-F685 HydrophobicContact CG2-CZ 4.09Å; F685-K689 CarbonylContact C-O 3.57Å; F685-K689 WeakPolarHBondContact CA-O 3.29Å; F685-Q690 VanDerWaalsContact CD1-CA 3.49Å; F685-Q690 HydrophobicContact CD1-CB 3.78Å; F685-Q690 HydrophobicContact CD1-CG 4.29Å; F685-Q690 HydrophobicContact CE1-CB 3.67Å; F685-Q690 HydrophobicContact CE1-CG 3.99Å; F685-Q690 HydrophobicContact CZ-CB 4.39Å; F685-Q690 HydrophobicContact CZ-CG 4.22Å; F685-Y723 CarbonylContact O-C 3.56Å; F685-Y723 WeakPolarHBondContact O-CA 3.11Å; F685-T724 PolarHBondContact N-O 2.8Å; F685-T724 PolarHBondContact O-N 2.94Å; F685-M726 HydrophobicContact CE2-CB 3.97Å; F685-M726 HydrophobicContact CE2-CE 4.26Å; F685-M726 HydrophobicContact CZ-CE 4.2Å
686	K	76.4	Confident	71.1	Confident	41 Å²	41	80.7 Å²	80.7	18%	0.178	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.3	163.9	-171.6	-172.1	-172.9	-80.8	0	108.1	G688 K689 I691 D718 D719 D720 N722 Y723	K686-G688 PolarHBondContact O-N 3.42Å; K686-G688 VanDerWaalsContact O-N 3.1Å; K686-K689 PolarHBondContact N-O 3.22Å; K686-K689 WeakPolarHBondContact O-CB 3.34Å; K686-K689 PolarHBondContact O-N 2.87Å; K686-I691 HydrophobicContact CB-CD1 4.24Å; K686-I691 HydrophobicContact CB-CG1 4.36Å; K686-D718 WeakPolarHBondContact CE-O 3.21Å; K686-D718 PolarHBondContact NZ-O 3.25Å; K686-D719 WeakPolarHBondContact CE-O 3.28Å; K686-D720 PolarHBondContact NZ-O 2.78Å; K686-N722 WeakPolarHBondContact CA-O 3.4Å; K686-Y723 HydrophobicContact CB-CD1 4.32Å; K686-Y723 HydrophobicContact CB-CE1 4.12Å; K686-Y723 HydrophobicContact CD-CE1 4.1Å; K686-Y723 HydrophobicContact CD-CE2 4.26Å; K686-Y723 WeakPolarHBondContact CD-OH 3.29Å; K686-Y723 VanDerWaalsContact CE-OH 3.28Å; K686-Y723 WeakPolarHBondContact CE-OH 3.13Å; K686-Y723 HydrophobicContact CG-CD1 4.4Å; K686-Y723 HydrophobicContact CG-CE1 4.01Å; K686-Y723 HydrophobicContact CG-CE2 4.17Å
687	D	57.1	Low	71.4	Confident	94 Å²	94	83.6 Å²	83.6	50%	0.503	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	36.2	178.5	-53	-48.4	0	0	0	113.5	K689 G721 N722	D687-K689 VanDerWaalsContact C-N 3.29Å; D687-K689 PolarHBondContact O-N 2.98Å; D687-G721 WeakPolarHBondContact OD1-CA 3.4Å; D687-N722 PolarHBondContact N-O 2.79Å; D687-N722 PolarHBondContact OD1-N 2.77Å
688	G	50.3	Low	71.9	Confident	29 Å²	29	80.1 Å²	80.1	30%	0.299	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	-5.3	-177	0	0	0	0	0	115.7	K686	K686-G688 PolarHBondContact O-N 3.42Å; K686-G688 VanDerWaalsContact O-N 3.1Å
689	K	61.5	Low	72.1	Confident	164 Å²	164	81.5 Å²	81.5	71%	0.713	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.7	173	-174.6	-177.8	177.5	-174.3	0	110.3	F685 K686 D687	F685-K689 CarbonylContact C-O 3.57Å; F685-K689 WeakPolarHBondContact CA-O 3.29Å; K686-K689 PolarHBondContact N-O 3.22Å; K686-K689 WeakPolarHBondContact O-CB 3.34Å; K686-K689 PolarHBondContact O-N 2.87Å; D687-K689 VanDerWaalsContact C-N 3.29Å; D687-K689 PolarHBondContact O-N 2.98Å
690	Q	71	Confident	72.5	Confident	88 Å²	88	78.9 Å²	78.9	41%	0.411	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	137.2	179.5	-166.4	178.8	-36	0	0	111.7	W684 F685	W684-Q690 WeakPolarHBondContact O-CA 3.37Å; W684-Q690 WeakPolarHBondContact O-CG 3.27Å; F685-Q690 VanDerWaalsContact CD1-CA 3.49Å; F685-Q690 HydrophobicContact CD1-CB 3.78Å; F685-Q690 HydrophobicContact CD1-CG 4.29Å; F685-Q690 HydrophobicContact CE1-CB 3.67Å; F685-Q690 HydrophobicContact CE1-CG 3.99Å; F685-Q690 HydrophobicContact CZ-CB 4.39Å; F685-Q690 HydrophobicContact CZ-CG 4.22Å
691	I	77.9	Confident	72.6	Confident	13 Å²	13	87.4 Å²	87.4	7%	0.067	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-85.8	120.7	174.2	-53.2	-177.8	0	0	0	108.2	W684 K686 N695 C698 M700 L710 Y723	W684-I691 HydrophobicContact CB-CB 4.3Å; W684-I691 HydrophobicContact CB-CD1 4.1Å; W684-I691 HydrophobicContact CB-CG1 4.39Å; W684-I691 PolarHBondContact O-N 2.99Å; K686-I691 HydrophobicContact CB-CD1 4.24Å; K686-I691 HydrophobicContact CB-CG1 4.36Å; I691-N695 HydrophobicContact CG2-CB 4.11Å; I691-C698 HydrophobicContact CG2-CB 3.94Å; I691-M700 HydrophobicContact CB-CE 4.45Å; I691-M700 HydrophobicContact CG2-CE 3.83Å; I691-L710 HydrophobicContact CD1-CD1 4.44Å; I691-L710 HydrophobicContact CD1-CD2 3.91Å; I691-Y723 HydrophobicContact CD1-CD1 4.02Å; I691-Y723 HydrophobicContact CD1-CE1 4.06Å
692	S	72	Confident	72.8	Confident	82 Å²	82	85.7 Å²	85.7	57%	0.573	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-65.4	140.3	178.8	-55.1	0	0	0	0	111.9	R694 N695 M700	S692-R694 PolarHBondContact O-N 3.03Å; S692-R694 VanDerWaalsContact O-N 3.12Å; S692-N695 VanDerWaalsContact O-CB 3.3Å; S692-N695 WeakPolarHBondContact O-CB 3.34Å; S692-N695 PolarHBondContact O-N 3.39Å; S692-N695 VanDerWaalsContact O-N 3.12Å; S692-M700 WeakPolarHBondContact O-CE 3.32Å
693	K	61	Low	72.6	Confident	192 Å²	192	88.6 Å²	88.6	84%	0.835	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-35.3	177.4	-75.8	-174.3	176.3	-178	0	113.7	N695	K693-N695 PolarHBondContact O-N 2.85Å
694	R	64.6	Low	72.2	Confident	215 Å²	215	89.6 Å²	89.6	81%	0.811	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	38.5	-179.7	-57.2	-174.2	-175.3	-173.5	3.7	112.5	S692	S692-R694 PolarHBondContact O-N 3.03Å; S692-R694 VanDerWaalsContact O-N 3.12Å
695	N	75.7	Confident	71.9	Confident	59 Å²	59	93.3 Å²	93.3	32%	0.316	46%	0.457	S	S	.	.			trans	-85.5	116.7	175.7	-174.5	-25.5	0	0	0	110.3	I691 S692 K693 H697 C698	I691-N695 HydrophobicContact CG2-CB 4.11Å; S692-N695 VanDerWaalsContact O-CB 3.3Å; S692-N695 WeakPolarHBondContact O-CB 3.34Å; S692-N695 PolarHBondContact O-N 3.39Å; S692-N695 VanDerWaalsContact O-N 3.12Å; K693-N695 PolarHBondContact O-N 2.85Å; N695-H697 VanDerWaalsContact C-N 3.3Å; N695-H697 PolarHBondContact O-N 2.81Å; N695-H697 WeakPolarHBondContact OD1-CB 3.27Å; N695-H697 PolarHBondContact OD1-N 3.03Å; N695-C698 HydrophobicContact CB-CB 4.17Å; N695-C698 PolarHBondContact O-N 2.77Å; N695-C698 PolarHBondContact OD1-N 3.03Å
696	E	69.9	Low	72.2	Confident	182 Å²	182	93.8 Å²	93.8	85%	0.85	46%	0.464	S	S	*	.	S	Bend	trans	-66.3	-30.7	-177.2	-58	-176.1	153.3	0	0	113.3
697	H	78.2	Confident	72.4	Confident	70 Å²	70	93 Å²	93	32%	0.324	46%	0.462	S	S	.	.	S	Bend	trans	-86	-26.6	-177.6	-170.4	66.2	0	0	0	113.2	N695 S714 D719	N695-H697 VanDerWaalsContact C-N 3.3Å; N695-H697 PolarHBondContact O-N 2.81Å; N695-H697 WeakPolarHBondContact OD1-CB 3.27Å; N695-H697 PolarHBondContact OD1-N 3.03Å; H697-S714 PolarHBondContact CE1-O 2.81Å; H697-D719 IonicContact CD2-OD1 3.2Å; H697-D719 PolarHBondContact CD2-OD1 2.86Å; H697-D719 VanDerWaalsContact CD2-OD1 3.29Å; H697-D719 IonicContact CD2-OD2 3.71Å; H697-D719 IonicContact CE1-OD2 2.68Å; H697-D719 IonicContact NE2-OD1 2.7Å; H697-D719 PolarHBondContact NE2-OD1 2.83Å; H697-D719 IonicContact NE2-OD2 2.92Å; H697-D719 PolarHBondContact NE2-OD2 3.35Å
698	C	79	Confident	73.6	Confident	5 Å²	5	88.6 Å²	88.6	3%	0.034	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	87.3	-173.2	-79.7	0	0	0	0	111.1	I691 N695 M700 L710 H711	I691-C698 HydrophobicContact CG2-CB 3.94Å; N695-C698 HydrophobicContact CB-CB 4.17Å; N695-C698 PolarHBondContact O-N 2.77Å; N695-C698 PolarHBondContact OD1-N 3.03Å; C698-M700 PolarHBondContact O-N 3.48Å; C698-L710 HydrophobicContact CB-CD1 3.99Å; C698-H711 CarbonylContact C-O 3.41Å
699	K	79.4	Confident	75.4	Confident	91 Å²	91	87.8 Å²	87.8	40%	0.396	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	108.5	-174.4	-62.6	172.7	-172.7	171.4	0	110.7	H711 E713	K699-H711 HydrophobicContact CB-CB 4.42Å; K699-H711 PolarHBondContact N-O 3.33Å; K699-H711 PolarHBondContact O-N 2.86Å; K699-E713 IonicContact NZ-OE2 3.01Å; K699-E713 PolarHBondContact NZ-OE2 3.41Å
700	M	86.4	Confident	76.6	Confident	58 Å²	58	80 Å²	80	29%	0.286	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	139.9	175.5	-73.2	167.3	-87.6	0	0	111.7	W684 I691 S692 C698 S709 L710	W684-M700 HydrophobicContact CB-SD 4.1Å; W684-M700 HydrophobicContact CG-CG 4.34Å; W684-M700 HydrophobicContact CG-SD 4.06Å; I691-M700 HydrophobicContact CB-CE 4.45Å; I691-M700 HydrophobicContact CG2-CE 3.83Å; S692-M700 WeakPolarHBondContact O-CE 3.32Å; C698-M700 PolarHBondContact O-N 3.48Å; M700-S709 CarbonylContact C-O 3.55Å; M700-S709 WeakPolarHBondContact CA-O 3.36Å; M700-L710 HydrophobicContact CG-CD1 3.47Å; M700-L710 VanDerWaalsContact CG-CD1 3.47Å; M700-L710 HydrophobicContact SD-CD1 4.46Å
701	R	79.1	Confident	77.4	Confident	184 Å²	184	77.8 Å²	77.8	69%	0.694	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	154.1	172.8	-67.4	-173.3	179.8	-83.7	0.7	111.4	S709	R701-S709 PolarHBondContact N-O 2.83Å; R701-S709 PolarHBondContact O-N 2.95Å
702	R	78.7	Confident	77.9	Confident	113 Å²	113	77.2 Å²	77.2	43%	0.426	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.6	167.9	169.1	176.1	-69.6	-167.5	-9.1	108.5	P680 V682 T707	P680-R702 PolarHBondContact O-NH1 2.89Å; P680-R702 PolarHBondContact O-NH2 3.25Å; V682-R702 VanDerWaalsContact CB-NH2 3.34Å; R702-T707 WeakPolarHBondContact CA-O 3.4Å
703	E	80	Confident	78.3	Confident	97 Å²	97	78.4 Å²	78.4	45%	0.453	38%	0.378	S	S	.	.			trans	-109.1	158.1	174.7	-71.8	149.5	-123.7	0	0	109.8	D705 G706 T707	E703-D705 WeakPolarHBondContact CB-OD1 3.36Å; E703-D705 PolarHBondContact O-N 3.3Å; E703-G706 PolarHBondContact O-N 3.29Å; E703-T707 PolarHBondContact N-O 3.01Å
704	G	67.6	Low	79.2	Confident	93 Å²	93	71.9 Å²	71.9	96%	0.959	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.5	-171.8	0	0	0	0	0	115	G706	G704-G706 VanDerWaalsContact C-N 3.31Å
705	D	74.9	Confident	80	Confident	82 Å²	82	61.7 Å²	61.7	44%	0.439	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-3.3	176.7	75.7	-42.9	0	0	0	113.6	K673 E703 T707	K673-D705 WeakPolarHBondContact CE-O 3.15Å; K673-D705 WeakPolarHBondContact CE-OD2 3.36Å; E703-D705 WeakPolarHBondContact CB-OD1 3.36Å; E703-D705 PolarHBondContact O-N 3.3Å; D705-T707 WeakPolarHBondContact OD1-CB 3.18Å; D705-T707 PolarHBondContact OD1-N 2.83Å; D705-T707 PolarHBondContact OD1-OG1 3.45Å; D705-T707 WeakPolarHBondContact OD2-CB 3.11Å; D705-T707 PolarHBondContact OD2-OG1 2.8Å
706	G	74.9	Confident	80.3	Confident	17 Å²	17	61.2 Å²	61.2	18%	0.175	32%	0.318	C	S	.	.	S	Bend	trans	94.1	-0.4	-172.4	0	0	0	0	0	114.6	I674 E703 G704 C708	I674-G706 PolarHBondContact N-O 3.05Å; I674-G706 WeakPolarHBondContact O-CA 3.23Å; E703-G706 PolarHBondContact O-N 3.29Å; G704-G706 VanDerWaalsContact C-N 3.31Å; G706-C708 PolarHBondContact O-N 2.89Å
707	T	81.2	Confident	80.5	Confident	24 Å²	24	55.6 Å²	55.6	15%	0.147	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	130.9	174.1	-68.7	0	0	0	0	110.3	C672 R702 E703 D705	C672-T707 WeakPolarHBondContact O-CA 3.34Å; R702-T707 WeakPolarHBondContact CA-O 3.4Å; E703-T707 PolarHBondContact N-O 3.01Å; D705-T707 WeakPolarHBondContact OD1-CB 3.18Å; D705-T707 PolarHBondContact OD1-N 2.83Å; D705-T707 PolarHBondContact OD1-OG1 3.45Å; D705-T707 WeakPolarHBondContact OD2-CB 3.11Å; D705-T707 PolarHBondContact OD2-OG1 2.8Å
708	C	83	Confident	80.5	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.02	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.7	179.9	-70.2	0	0	0	0	109.4	C672 I674 G706 I725	C672-C708 PolarHBondContact N-O 2.83Å; C672-C708 PolarHBondContact O-N 3.49Å; C672-C708 PolarHBondContact SG-O 2.9Å; I674-C708 HydrophobicContact CD1-CB 4.27Å; G706-C708 PolarHBondContact O-N 2.89Å; C708-I725 HydrophobicContact CB-CD1 4Å
709	S	87.1	Confident	80.5	Confident	12 Å²	12	58.5 Å²	58.5	8%	0.084	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141.6	-166.4	-59.5	0	0	0	0	111.4	F670 M700 R701	F670-S709 CarbonylContact O-C 3.6Å; F670-S709 VanDerWaalsContact O-CA 3.28Å; F670-S709 WeakPolarHBondContact O-CA 3.34Å; M700-S709 CarbonylContact C-O 3.55Å; M700-S709 WeakPolarHBondContact CA-O 3.36Å; R701-S709 PolarHBondContact N-O 2.83Å; R701-S709 PolarHBondContact O-N 2.95Å
710	L	87.4	Confident	80.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	115.8	172.9	175.2	75.5	0	0	0	108.3	T669 F670 W684 I691 C698 M700 Y723	T669-L710 CarbonylContact C-O 3.54Å; T669-L710 WeakPolarHBondContact CA-O 3.5Å; F670-L710 HydrophobicContact CB-CB 4.24Å; F670-L710 PolarHBondContact N-O 2.72Å; F670-L710 PolarHBondContact O-N 2.83Å; W684-L710 HydrophobicContact CD2-CB 3.8Å; W684-L710 HydrophobicContact CD2-CD2 4.01Å; W684-L710 HydrophobicContact CD2-CG 4.35Å; W684-L710 HydrophobicContact CE3-CB 3.84Å; W684-L710 HydrophobicContact CE3-CD2 3.61Å; W684-L710 HydrophobicContact CE3-CG 4.3Å; W684-L710 HydrophobicContact CG-CD2 4.5Å; W684-L710 HydrophobicContact CH2-CB 3.56Å; W684-L710 HydrophobicContact CZ2-CB 3.53Å; W684-L710 HydrophobicContact CZ3-CB 3.72Å; W684-L710 HydrophobicContact CZ3-CD2 3.96Å; W684-L710 HydrophobicContact CZ3-CG 4.5Å; I691-L710 HydrophobicContact CD1-CD1 4.44Å; I691-L710 HydrophobicContact CD1-CD2 3.91Å; C698-L710 HydrophobicContact CB-CD1 3.99Å; M700-L710 HydrophobicContact CG-CD1 3.47Å; M700-L710 VanDerWaalsContact CG-CD1 3.47Å; M700-L710 HydrophobicContact SD-CD1 4.46Å; L710-Y723 HydrophobicContact CD2-CD1 3.44Å; L710-Y723 VanDerWaalsContact CD2-CD1 3.44Å; L710-Y723 HydrophobicContact CD2-CE1 3.92Å; L710-Y723 HydrophobicContact CD2-CG 4.39Å
711	H	87.3	Confident	78.9	Confident	42 Å²	42	54.9 Å²	54.9	19%	0.194	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.7	-177.5	-179.7	74.1	0	0	0	111.3	V668 T669 C698 K699 E713	V668-H711 WeakPolarHBondContact O-CA 3.45Å; V668-H711 PolarHBondContact O-ND1 3.01Å; T669-H711 HydrophobicContact CG2-CB 4.24Å; T669-H711 PolarHBondContact OG1-ND1 3.36Å; C698-H711 CarbonylContact C-O 3.41Å; K699-H711 HydrophobicContact CB-CB 4.42Å; K699-H711 PolarHBondContact N-O 3.33Å; K699-H711 PolarHBondContact O-N 2.86Å; H711-E713 IonicContact CD2-OE2 2.81Å; H711-E713 IonicContact NE2-OE2 2.67Å
712	I	88.6	Confident	77.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.2	171.4	-50.6	174	0	0	0	106.3	P667 V668 T715 Y723 L740	P667-I712 CarbonylContact C-O 3.57Å; P667-I712 VanDerWaalsContact CA-O 3.27Å; P667-I712 WeakPolarHBondContact CA-O 3.25Å; V668-I712 HydrophobicContact CG1-CB 3.97Å; V668-I712 HydrophobicContact CG1-CD1 4.02Å; V668-I712 HydrophobicContact CG1-CG1 4.23Å; V668-I712 PolarHBondContact N-O 3.49Å; V668-I712 PolarHBondContact O-N 2.81Å; I712-T715 HydrophobicContact CB-CG2 4.3Å; I712-T715 HydrophobicContact CG2-CG2 4.01Å; I712-Y723 HydrophobicContact CD1-CE1 3.98Å; I712-Y723 HydrophobicContact CD1-CE2 4.48Å; I712-Y723 WeakPolarHBondContact CD1-OH 3.35Å; I712-L740 HydrophobicContact CD1-CD2 4.03Å
713	E	79.6	Confident	77.7	Confident	108 Å²	108	42.1 Å²	42.1	51%	0.505	26%	0.258	S	S	.	.	S	Bend	trans	-74.1	-32.3	-171.1	-161.3	87.1	-145	0	0	112.5	P667 K699 H711	P667-E713 WeakPolarHBondContact CA-O 3.21Å; P667-E713 WeakPolarHBondContact CB-O 3.08Å; K699-E713 IonicContact NZ-OE2 3.01Å; K699-E713 PolarHBondContact NZ-OE2 3.41Å; H711-E713 IonicContact CD2-OE2 2.81Å; H711-E713 IonicContact NE2-OE2 2.67Å
714	S	79.8	Confident	77	Confident	55 Å²	55	38.2 Å²	38.2	39%	0.385	24%	0.24	S	C	.	.	S	Bend	trans	-157.1	98.9	-175.9	158.4	0	0	0	0	109.4	S666 H697	S666-S714 WeakPolarHBondContact O-CA 3.38Å; H697-S714 PolarHBondContact CE1-O 2.81Å
715	T	82.4	Confident	77.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.195	C	C	.	.			trans	-69.3	132.3	-175.9	55.5	0	0	0	0	112.9	V662 T663 E664 G665 S666 V668 I712 D719 L740 V742	V662-T715 HydrophobicContact CG2-CG2 3.97Å; V662-T715 VanDerWaalsContact CG2-OG1 3.31Å; V662-T715 WeakPolarHBondContact CG2-OG1 3.28Å; T663-T715 PolarHBondContact O-OG1 2.64Å; E664-T715 CarbonylContact C-O 3.55Å; E664-T715 WeakPolarHBondContact CA-O 3.36Å; G665-T715 PolarHBondContact N-O 2.85Å; S666-T715 PolarHBondContact O-N 2.88Å; S666-T715 PolarHBondContact O-OG1 2.83Å; V668-T715 HydrophobicContact CB-CG2 4.32Å; V668-T715 HydrophobicContact CG1-CG2 3.52Å; I712-T715 HydrophobicContact CB-CG2 4.3Å; I712-T715 HydrophobicContact CG2-CG2 4.01Å; T715-D719 HydrophobicContact CG2-CB 4.43Å; T715-L740 HydrophobicContact CG2-CD2 3.92Å; T715-V742 HydrophobicContact CG2-CG2 4.49Å
716	T	81.2	Confident	77.3	Confident	50 Å²	50	30.3 Å²	30.3	31%	0.307	18%	0.176	S	C	.	.			trans	-101.7	171.6	174.5	64.1	0	0	0	0	111	D718 D719 V742	T716-D718 PolarHBondContact O-N 2.8Å; T716-D718 VanDerWaalsContact O-N 3.11Å; T716-D718 PolarHBondContact OG1-N 2.84Å; T716-D719 PolarHBondContact N-OD2 3.15Å; T716-D719 WeakPolarHBondContact O-CB 3.47Å; T716-D719 PolarHBondContact O-N 2.95Å; T716-D719 VanDerWaalsContact O-N 3.12Å; T716-D719 PolarHBondContact OG1-OD2 2.96Å; T716-V742 WeakPolarHBondContact O-CG1 3.38Å; T716-V742 WeakPolarHBondContact O-CG2 3.49Å
717	S	75.6	Confident	77.3	Confident	64 Å²	64	29.5 Å²	29.5	45%	0.448	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-51.6	-30.6	169.1	56.4	0	0	0	0	114.2	E664 D719 D720	E664-S717 PolarHBondContact OE1-N 2.88Å; S717-D719 VanDerWaalsContact C-N 3.28Å; S717-D719 PolarHBondContact O-N 2.77Å; S717-D720 WeakPolarHBondContact O-CB 3.28Å; S717-D720 PolarHBondContact O-N 3.29Å
718	D	77.5	Confident	76.6	Confident	128 Å²	128	29.2 Å²	29.2	68%	0.684	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-82.5	-11	-173.3	-62.4	7.5	0	0	0	112.1	K686 T716	K686-D718 WeakPolarHBondContact CE-O 3.21Å; K686-D718 PolarHBondContact NZ-O 3.25Å; T716-D718 PolarHBondContact O-N 2.8Å; T716-D718 VanDerWaalsContact O-N 3.11Å; T716-D718 PolarHBondContact OG1-N 2.84Å
719	D	78.5	Confident	75.9	Confident	7 Å²	7	30 Å²	30	4%	0.037	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-79.3	-16.6	171.2	-66.2	-69.3	0	0	0	112.9	K686 H697 T715 T716 S717 G721 Y723 L740 V742	K686-D719 WeakPolarHBondContact CE-O 3.28Å; H697-D719 IonicContact CD2-OD1 3.2Å; H697-D719 PolarHBondContact CD2-OD1 2.86Å; H697-D719 VanDerWaalsContact CD2-OD1 3.29Å; H697-D719 IonicContact CD2-OD2 3.71Å; H697-D719 IonicContact CE1-OD2 2.68Å; H697-D719 IonicContact NE2-OD1 2.7Å; H697-D719 PolarHBondContact NE2-OD1 2.83Å; H697-D719 IonicContact NE2-OD2 2.92Å; H697-D719 PolarHBondContact NE2-OD2 3.35Å; T715-D719 HydrophobicContact CG2-CB 4.43Å; T716-D719 PolarHBondContact N-OD2 3.15Å; T716-D719 WeakPolarHBondContact O-CB 3.47Å; T716-D719 PolarHBondContact O-N 2.95Å; T716-D719 VanDerWaalsContact O-N 3.12Å; T716-D719 PolarHBondContact OG1-OD2 2.96Å; S717-D719 VanDerWaalsContact C-N 3.28Å; S717-D719 PolarHBondContact O-N 2.77Å; D719-G721 PolarHBondContact O-N 2.77Å; D719-Y723 VanDerWaalsContact O-CE2 3.29Å; D719-Y723 WeakPolarHBondContact O-CE2 3.35Å; D719-Y723 PolarHBondContact O-OH 2.78Å; D719-Y723 PolarHBondContact OD1-OH 3.28Å; D719-L740 HydrophobicContact CB-CD2 3.98Å; D719-V742 HydrophobicContact CB-CG2 4.14Å
720	D	75.5	Confident	75.1	Confident	67 Å²	67	34.7 Å²	34.7	36%	0.358	20%	0.202	S	C	.	.			trans	-59.5	126.8	175.4	-164.8	-76.2	0	0	0	110.9	K686 S717 L740 M741 V742	K686-D720 PolarHBondContact NZ-O 2.78Å; S717-D720 WeakPolarHBondContact O-CB 3.28Å; S717-D720 PolarHBondContact O-N 3.29Å; D720-L740 WeakPolarHBondContact CA-O 3.38Å; D720-M741 VanDerWaalsContact OD2-CA 3.26Å; D720-M741 WeakPolarHBondContact OD2-CA 3.43Å; D720-V742 HydrophobicContact CB-CB 4.43Å; D720-V742 HydrophobicContact CB-CG2 4.38Å; D720-V742 PolarHBondContact OD2-N 3.31Å
721	G	56.7	Low	74	Confident	6 Å²	6	39.7 Å²	39.7	6%	0.062	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-169.9	-176.6	0	0	0	0	0	116.1	D687 D719 H739 L740	D687-G721 WeakPolarHBondContact OD1-CA 3.4Å; D719-G721 PolarHBondContact O-N 2.77Å; G721-H739 PolarHBondContact O-ND1 2.75Å; G721-L740 PolarHBondContact N-O 2.79Å; G721-L740 PolarHBondContact O-N 2.87Å
722	N	58.1	Low	72.1	Confident	30 Å²	30	38.8 Å²	38.8	16%	0.16	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	111.5	-172.8	-78	-9.9	0	0	0	112.3	K686 D687 H739 E831	K686-N722 WeakPolarHBondContact CA-O 3.4Å; D687-N722 PolarHBondContact N-O 2.79Å; D687-N722 PolarHBondContact OD1-N 2.77Å; N722-H739 WeakPolarHBondContact OD1-CB 3.42Å; N722-H739 PolarHBondContact OD1-ND1 2.78Å; N722-E831 PolarHBondContact ND2-OE2 3.44Å
723	Y	74.3	Confident	70.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.6	173.5	-69.5	-96.2	0	0	0	109.8	F670 F685 K686 I691 L710 I712 D719 S737 G738 L740	F670-Y723 HydrophobicContact CD2-CD2 4.42Å; F670-Y723 HydrophobicContact CD2-CG 4.15Å; F670-Y723 HydrophobicContact CE2-CD1 4.3Å; F670-Y723 AromaticContact CE2-CD2 3.48Å; F670-Y723 HydrophobicContact CE2-CD2 3.48Å; F670-Y723 VanDerWaalsContact CE2-CD2 3.48Å; F670-Y723 HydrophobicContact CE2-CE2 4.05Å; F670-Y723 AromaticContact CE2-CG 3.62Å; F670-Y723 HydrophobicContact CE2-CG 3.62Å; F670-Y723 AromaticContact CZ-CD2 3.66Å; F670-Y723 HydrophobicContact CZ-CD2 3.66Å; F670-Y723 HydrophobicContact CZ-CE2 4.48Å; F670-Y723 AromaticContact CZ-CG 3.96Å; F670-Y723 HydrophobicContact CZ-CG 3.96Å; F685-Y723 CarbonylContact O-C 3.56Å; F685-Y723 WeakPolarHBondContact O-CA 3.11Å; K686-Y723 HydrophobicContact CB-CD1 4.32Å; K686-Y723 HydrophobicContact CB-CE1 4.12Å; K686-Y723 HydrophobicContact CD-CE1 4.1Å; K686-Y723 HydrophobicContact CD-CE2 4.26Å; K686-Y723 WeakPolarHBondContact CD-OH 3.29Å; K686-Y723 VanDerWaalsContact CE-OH 3.28Å; K686-Y723 WeakPolarHBondContact CE-OH 3.13Å; K686-Y723 HydrophobicContact CG-CD1 4.4Å; K686-Y723 HydrophobicContact CG-CE1 4.01Å; K686-Y723 HydrophobicContact CG-CE2 4.17Å; I691-Y723 HydrophobicContact CD1-CD1 4.02Å; I691-Y723 HydrophobicContact CD1-CE1 4.06Å; L710-Y723 HydrophobicContact CD2-CD1 3.44Å; L710-Y723 VanDerWaalsContact CD2-CD1 3.44Å; L710-Y723 HydrophobicContact CD2-CE1 3.92Å; L710-Y723 HydrophobicContact CD2-CG 4.39Å; I712-Y723 HydrophobicContact CD1-CE1 3.98Å; I712-Y723 HydrophobicContact CD1-CE2 4.48Å; I712-Y723 WeakPolarHBondContact CD1-OH 3.35Å; D719-Y723 VanDerWaalsContact O-CE2 3.29Å; D719-Y723 WeakPolarHBondContact O-CE2 3.35Å; D719-Y723 PolarHBondContact O-OH 2.78Å; D719-Y723 PolarHBondContact OD1-OH 3.28Å; Y723-S737 CarbonylContact O-C 3.18Å; Y723-S737 VanDerWaalsContact O-CA 3.27Å; Y723-S737 WeakPolarHBondContact O-CA 3.46Å; Y723-G738 PolarHBondContact N-O 2.85Å; Y723-G738 PolarHBondContact O-N 2.88Å; Y723-L740 HydrophobicContact CD2-CB 3.97Å; Y723-L740 HydrophobicContact CE2-CB 3.74Å; Y723-L740 HydrophobicContact CE2-CD2 3.8Å; Y723-L740 HydrophobicContact CE2-CG 4.44Å
724	T	64.9	Low	69.8	Low	14 Å²	14	41.9 Å²	41.9	9%	0.086	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.5	-179.4	-58.4	0	0	0	0	109.6	W684 F685 C736 S737	W684-T724 CarbonylContact C-O 3.45Å; W684-T724 WeakPolarHBondContact CA-O 3.16Å; F685-T724 PolarHBondContact N-O 2.8Å; F685-T724 PolarHBondContact O-N 2.94Å; T724-C736 WeakPolarHBondContact CA-O 3.28Å; T724-S737 WeakPolarHBondContact CG2-OG 3.34Å; T724-S737 PolarHBondContact OG1-OG 3.02Å
725	I	76.9	Confident	68.9	Low	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.2	170.2	-160.5	178.8	0	0	0	109.8	F653 L657 C672 I674 V682 Y683 W684 C708 S735 C736	F653-I725 HydrophobicContact CE1-CG2 3.8Å; F653-I725 HydrophobicContact CZ-CG2 4.03Å; L657-I725 HydrophobicContact CD1-CB 4.24Å; L657-I725 HydrophobicContact CD1-CG2 3.9Å; L657-I725 HydrophobicContact CG-CG2 4.14Å; C672-I725 WeakPolarHBondContact SG-CD1 3.48Å; I674-I725 HydrophobicContact CD1-CD1 3.99Å; V682-I725 HydrophobicContact CG1-CD1 3.62Å; V682-I725 HydrophobicContact CG1-CG1 3.76Å; Y683-I725 WeakPolarHBondContact O-CA 3.17Å; W684-I725 HydrophobicContact CD2-CB 4.04Å; W684-I725 HydrophobicContact CD2-CD1 4.02Å; W684-I725 HydrophobicContact CD2-CG1 3.8Å; W684-I725 VanDerWaalsContact CE2-CD1 3.41Å; W684-I725 HydrophobicContact CE3-CB 3.87Å; W684-I725 HydrophobicContact CE3-CD1 4.48Å; W684-I725 HydrophobicContact CE3-CG1 4.17Å; W684-I725 HydrophobicContact CG-CG1 4.24Å; W684-I725 HydrophobicContact CH2-CB 4.34Å; W684-I725 HydrophobicContact CH2-CD1 3.97Å; W684-I725 HydrophobicContact CH2-CG1 4.48Å; W684-I725 HydrophobicContact CZ2-CB 4.45Å; W684-I725 HydrophobicContact CZ2-CD1 3.4Å; W684-I725 VanDerWaalsContact CZ2-CD1 3.4Å; W684-I725 HydrophobicContact CZ2-CG1 4.11Å; W684-I725 HydrophobicContact CZ3-CB 4.03Å; W684-I725 HydrophobicContact CZ3-CD1 4.46Å; W684-I725 HydrophobicContact CZ3-CG1 4.49Å; C708-I725 HydrophobicContact CB-CD1 4Å; I725-S735 CarbonylContact O-C 3.53Å; I725-S735 WeakPolarHBondContact O-CA 3.49Å; I725-C736 PolarHBondContact N-O 3.47Å; I725-C736 PolarHBondContact O-N 3.33Å
726	M	72.7	Confident	67.8	Low	10 Å²	10	40.8 Å²	40.8	5%	0.049	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.4	172.9	-176	-178.3	68.8	0	0	109.5	I622 L626 V682 Y683 F685 I734	I622-M726 HydrophobicContact CG2-CE 4.35Å; I622-M726 HydrophobicContact CG2-SD 4.44Å; L626-M726 HydrophobicContact CD1-CE 4.48Å; V682-M726 CarbonylContact C-O 3.58Å; V682-M726 WeakPolarHBondContact CA-O 3.16Å; Y683-M726 HydrophobicContact CD2-CE 3.67Å; Y683-M726 HydrophobicContact CE2-CE 4.33Å; Y683-M726 HydrophobicContact CG-CE 4Å; Y683-M726 PolarHBondContact N-O 3.36Å; Y683-M726 PolarHBondContact O-N 2.73Å; F685-M726 HydrophobicContact CE2-CB 3.97Å; F685-M726 HydrophobicContact CE2-CE 4.26Å; F685-M726 HydrophobicContact CZ-CE 4.2Å; M726-I734 CarbonylContact C-O 3.53Å; M726-I734 VanDerWaalsContact CA-O 3.27Å; M726-I734 WeakPolarHBondContact CA-O 3.29Å; M726-I734 WeakPolarHBondContact CG-O 3.32Å
727	A	75.8	Confident	66.8	Low	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.3	175	0	0	0	0	0	110.7	P651 I674 P680 K681 V682 R733 I734	P651-A727 HydrophobicContact CB-CB 4.26Å; I674-A727 HydrophobicContact CD1-CB 3.93Å; I674-A727 HydrophobicContact CG1-CB 4.49Å; I674-A727 HydrophobicContact CG2-CB 3.88Å; P680-A727 HydrophobicContact CB-CB 4.23Å; P680-A727 HydrophobicContact CG-CB 4.47Å; K681-A727 CarbonylContact O-C 3.58Å; K681-A727 WeakPolarHBondContact O-CA 3.39Å; V682-A727 HydrophobicContact CG2-CB 3.75Å; A727-R733 CarbonylContact O-C 3.52Å; A727-R733 VanDerWaalsContact O-CA 3.26Å; A727-R733 WeakPolarHBondContact O-CA 3.27Å; A727-I734 HydrophobicContact CB-CD1 4.28Å; A727-I734 HydrophobicContact CB-CG1 3.9Å; A727-I734 PolarHBondContact N-O 3.46Å; A727-I734 PolarHBondContact O-N 3.12Å
728	A	66.7	Low	65.9	Low	17 Å²	17	37.8 Å²	37.8	14%	0.14	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	132.6	-174.7	0	0	0	0	0	112.5	P680 K681 Y683 G732 R733	P680-A728 CarbonylContact C-O 3.45Å; P680-A728 VanDerWaalsContact CA-O 3.28Å; P680-A728 WeakPolarHBondContact CA-O 3.41Å; P680-A728 WeakPolarHBondContact CB-O 3.49Å; K681-A728 PolarHBondContact N-O 3.11Å; K681-A728 PolarHBondContact O-N 3.34Å; Y683-A728 HydrophobicContact CE2-CB 4.49Å; A728-G732 WeakPolarHBondContact CA-O 3.45Å; A728-R733 HydrophobicContact CB-CB 4.47Å; A728-R733 HydrophobicContact CB-CG 3.83Å
729	N	68.3	Low	65.4	Low	20 Å²	20	33.3 Å²	33.3	11%	0.107	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	178.6	164.6	80.1	5.9	0	0	0	109.5	I649 P651 I677 P678 P680 Q731 G732	I649-N729 PolarHBondContact O-ND2 3.04Å; P651-N729 WeakPolarHBondContact CD-OD1 3.49Å; I677-N729 PolarHBondContact N-ND2 2.85Å; I677-N729 PolarHBondContact O-ND2 2.94Å; P678-N729 WeakPolarHBondContact O-CB 3.41Å; P678-N729 PolarHBondContact O-ND2 2.83Å; P680-N729 HydrophobicContact CB-CB 4.1Å; N729-Q731 PolarHBondContact O-N 2.7Å; N729-Q731 WeakPolarHBondContact OD1-CA 3.48Å; N729-Q731 WeakPolarHBondContact OD1-CB 3.44Å; N729-Q731 PolarHBondContact OD1-N 2.72Å; N729-G732 PolarHBondContact N-O 3.43Å; N729-G732 PolarHBondContact O-N 3.01Å; N729-G732 VanDerWaalsContact O-O 3.06Å; N729-G732 PolarHBondContact OD1-N 3.09Å
730	P	69.6	Low	64.9	Low	110 Å²	110	33 Å²	33	71%	0.714	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-11.7	179.9	-26.1	36.2	0	0	0	116
731	Q	64.3	Low	64.3	Low	105 Å²	105	33 Å²	33	49%	0.491	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-11.6	180	-54.1	-60.8	-69.5	0	0	113.4	C648 A650 N729	C648-Q731 HydrophobicContact CB-CG 3.6Å; A650-Q731 HydrophobicContact CB-CB 4.08Å; N729-Q731 PolarHBondContact O-N 2.7Å; N729-Q731 WeakPolarHBondContact OD1-CA 3.48Å; N729-Q731 WeakPolarHBondContact OD1-CB 3.44Å; N729-Q731 PolarHBondContact OD1-N 2.72Å
732	G	47.4	Very low	65.2	Low	24 Å²	24	33.4 Å²	33.4	25%	0.247	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.7	176.3	179	0	0	0	0	0	115.5	P651 A728 N729	P651-G732 WeakPolarHBondContact CD-O 3.36Å; P651-G732 WeakPolarHBondContact CG-O 3.39Å; A728-G732 WeakPolarHBondContact CA-O 3.45Å; N729-G732 PolarHBondContact N-O 3.43Å; N729-G732 PolarHBondContact O-N 3.01Å; N729-G732 VanDerWaalsContact O-O 3.06Å; N729-G732 PolarHBondContact OD1-N 3.09Å
733	R	55	Low	65.9	Low	134 Å²	134	36 Å²	36	51%	0.506	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.5	175.4	-53.7	-173.9	-173.4	147.6	1.5	110.3	E623 A727 A728	E623-R733 IonicContact OE1-CZ 3.71Å; E623-R733 IonicContact OE1-NH1 3.37Å; E623-R733 PolarHBondContact OE1-NH1 3.34Å; E623-R733 IonicContact OE1-NH2 3.97Å; A727-R733 CarbonylContact O-C 3.52Å; A727-R733 VanDerWaalsContact O-CA 3.26Å; A727-R733 WeakPolarHBondContact O-CA 3.27Å; A728-R733 HydrophobicContact CB-CB 4.47Å; A728-R733 HydrophobicContact CB-CG 3.83Å
734	I	64.1	Low	64.9	Low	39 Å²	39	39.9 Å²	39.9	20%	0.2	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	155.4	175.7	54.1	166.6	0	0	0	111.1	P651 I652 F653 I674 M726 A727	P651-I734 VanDerWaalsContact C-CD1 3.45Å; P651-I734 HydrophobicContact CB-CD1 3.94Å; P651-I734 HydrophobicContact CB-CG1 3.91Å; P651-I734 HydrophobicContact CG-CG1 4Å; P651-I734 VanDerWaalsContact O-CD1 3.29Å; P651-I734 WeakPolarHBondContact O-CD1 3.27Å; P651-I734 WeakPolarHBondContact O-CG2 3.36Å; I652-I734 VanDerWaalsContact C-CD1 3.49Å; F653-I734 HydrophobicContact CD1-CD1 4.13Å; F653-I734 HydrophobicContact CD2-CB 4.35Å; F653-I734 HydrophobicContact CD2-CD1 3.62Å; F653-I734 HydrophobicContact CD2-CG1 4.35Å; F653-I734 HydrophobicContact CE1-CD1 4.08Å; F653-I734 HydrophobicContact CE2-CB 3.8Å; F653-I734 HydrophobicContact CE2-CD1 3.55Å; F653-I734 HydrophobicContact CE2-CG1 3.83Å; F653-I734 HydrophobicContact CG-CD1 3.9Å; F653-I734 HydrophobicContact CZ-CB 4.39Å; F653-I734 HydrophobicContact CZ-CD1 3.78Å; F653-I734 HydrophobicContact CZ-CG1 4.02Å; I674-I734 HydrophobicContact CG2-CD1 4.41Å; M726-I734 CarbonylContact C-O 3.53Å; M726-I734 VanDerWaalsContact CA-O 3.27Å; M726-I734 WeakPolarHBondContact CA-O 3.29Å; M726-I734 WeakPolarHBondContact CG-O 3.32Å; A727-I734 HydrophobicContact CB-CD1 4.28Å; A727-I734 HydrophobicContact CB-CG1 3.9Å; A727-I734 PolarHBondContact N-O 3.46Å; A727-I734 PolarHBondContact O-N 3.12Å
735	S	62.3	Low	64.1	Low	26 Å²	26	44.5 Å²	44.5	18%	0.182	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149.4	173.2	55.8	0	0	0	0	112.8	F653 I725	F653-S735 WeakPolarHBondContact CE2-O 3.41Å; I725-S735 CarbonylContact O-C 3.53Å; I725-S735 WeakPolarHBondContact O-CA 3.49Å
736	C	58.3	Low	62.6	Low	6 Å²	6	50.5 Å²	50.5	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	160.8	164.8	72	0	0	0	0	111	F653 R656 T724 I725	F653-C736 HydrophobicContact CD2-CB 4.16Å; F653-C736 HydrophobicContact CE1-CB 4.49Å; F653-C736 WeakPolarHBondContact CE1-SG 3.34Å; F653-C736 HydrophobicContact CE2-CB 3.73Å; F653-C736 HydrophobicContact CZ-CB 3.92Å; F653-C736 WeakPolarHBondContact CZ-SG 3.18Å; R656-C736 HydrophobicContact CG-CB 4.4Å; T724-C736 WeakPolarHBondContact CA-O 3.28Å; I725-C736 PolarHBondContact N-O 3.47Å; I725-C736 PolarHBondContact O-N 3.33Å
737	S	61.5	Low	61.2	Low	50 Å²	50	57.7 Å²	57.7	35%	0.35	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	154.3	-170.5	-51.8	0	0	0	0	112.3	Y723 T724	Y723-S737 CarbonylContact O-C 3.18Å; Y723-S737 VanDerWaalsContact O-CA 3.27Å; Y723-S737 WeakPolarHBondContact O-CA 3.46Å; T724-S737 WeakPolarHBondContact CG2-OG 3.34Å; T724-S737 PolarHBondContact OG1-OG 3.02Å
738	G	56	Low	59.5	Low	1 Å²	1	67.4 Å²	67.4	1%	0.01	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	144.7	168.4	0	0	0	0	0	110	Y723	Y723-G738 PolarHBondContact N-O 2.85Å; Y723-G738 PolarHBondContact O-N 2.88Å
739	H	66.3	Low	58	Low	33 Å²	33	71.9 Å²	71.9	15%	0.153	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.1	-177.3	-176.1	65.3	0	0	0	110.7	H659 F660 G721 N722 M741	H659-H739 CarbonylContact C-O 3.59Å; H659-H739 VanDerWaalsContact CA-O 3.28Å; H659-H739 WeakPolarHBondContact CA-O 3.28Å; H659-H739 WeakPolarHBondContact ND1-CB 3.47Å; H659-H739 PolarHBondContact ND1-N 2.92Å; F660-H739 PolarHBondContact N-O 2.72Å; G721-H739 PolarHBondContact O-ND1 2.75Å; N722-H739 WeakPolarHBondContact OD1-CB 3.42Å; N722-H739 PolarHBondContact OD1-ND1 2.78Å; H739-M741 WeakPolarHBondContact NE2-CG 3.42Å
740	L	67.9	Low	56.5	Low	0 Å²	0	82 Å²	82	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.9	171.1	-175.7	59.3	0	0	0	109.3	F660 V662 V668 F670 I712 T715 D719 D720 G721 Y723 V742	F660-L740 HydrophobicContact CB-CD1 3.75Å; V662-L740 HydrophobicContact CG2-CD1 3.87Å; V668-L740 HydrophobicContact CB-CD1 4.45Å; V668-L740 HydrophobicContact CG1-CD1 4.07Å; V668-L740 HydrophobicContact CG1-CD2 3.97Å; V668-L740 HydrophobicContact CG2-CD1 4.13Å; F670-L740 HydrophobicContact CE2-CB 4.21Å; F670-L740 HydrophobicContact CE2-CD2 4.45Å; F670-L740 HydrophobicContact CZ-CB 3.95Å; I712-L740 HydrophobicContact CD1-CD2 4.03Å; T715-L740 HydrophobicContact CG2-CD2 3.92Å; D719-L740 HydrophobicContact CB-CD2 3.98Å; D720-L740 WeakPolarHBondContact CA-O 3.38Å; G721-L740 PolarHBondContact N-O 2.79Å; G721-L740 PolarHBondContact O-N 2.87Å; Y723-L740 HydrophobicContact CD2-CB 3.97Å; Y723-L740 HydrophobicContact CE2-CB 3.74Å; Y723-L740 HydrophobicContact CE2-CD2 3.8Å; Y723-L740 HydrophobicContact CE2-CG 4.44Å; L740-V742 HydrophobicContact CD2-CG2 4.08Å; L740-V742 HydrophobicContact CG-CG2 3.92Å
741	M	64.4	Low	55	Low	69 Å²	69	84.7 Å²	84.7	34%	0.34	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.2	166.3	-78.6	176.2	-83.1	0	0	110.4	F660 R661 V662 D720 H739	F660-M741 PolarHBondContact O-N 2.74Å; R661-M741 WeakPolarHBondContact CA-O 3.47Å; R661-M741 HydrophobicContact CB-CB 4.27Å; R661-M741 HydrophobicContact CB-CE 4.32Å; R661-M741 HydrophobicContact CG-CB 3.92Å; V662-M741 PolarHBondContact N-O 2.63Å; D720-M741 VanDerWaalsContact OD2-CA 3.26Å; D720-M741 WeakPolarHBondContact OD2-CA 3.43Å; H739-M741 WeakPolarHBondContact NE2-CG 3.42Å
742	V	75.7	Confident	53.7	Low	14 Å²	14	85.9 Å²	85.9	9%	0.085	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.2	177.5	-170.6	0	0	0	0	110.8	V662 E664 T715 T716 D719 D720 L740 S744	V662-V742 HydrophobicContact CG2-CG2 4.25Å; V662-V742 WeakPolarHBondContact O-CA 3.27Å; E664-V742 HydrophobicContact CB-CG1 4.11Å; T715-V742 HydrophobicContact CG2-CG2 4.49Å; T716-V742 WeakPolarHBondContact O-CG1 3.38Å; T716-V742 WeakPolarHBondContact O-CG2 3.49Å; D719-V742 HydrophobicContact CB-CG2 4.14Å; D720-V742 HydrophobicContact CB-CB 4.43Å; D720-V742 HydrophobicContact CB-CG2 4.38Å; D720-V742 PolarHBondContact OD2-N 3.31Å; L740-V742 HydrophobicContact CD2-CG2 4.08Å; L740-V742 HydrophobicContact CG-CG2 3.92Å; V742-S744 PolarHBondContact O-N 3.04Å
743	Q	71.3	Confident	53.1	Low	85 Å²	85	90 Å²	90	40%	0.397	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	104.1	179.8	-60.6	-166.6	-111.1	0	0	110.5	R661 V662 T663 E664	R661-Q743 VanDerWaalsContact CD-OE1 3.25Å; R661-Q743 HydrophobicContact CG-CG 4.26Å; V662-Q743 PolarHBondContact O-N 2.7Å; T663-Q743 WeakPolarHBondContact CA-O 3.29Å; T663-Q743 HydrophobicContact CG2-CB 4.45Å; E664-Q743 PolarHBondContact N-O 2.78Å
744	S	52.8	Low	52.2	Low	80 Å²	80	88.4 Å²	88.4	56%	0.559	49%	0.488	S	S	*	.			trans	-68.3	141.1	172.8	48	0	0	0	0	112.2	E664 V742	E664-S744 WeakPolarHBondContact OE2-CA 3.4Å; E664-S744 WeakPolarHBondContact OE2-CB 3.41Å; V742-S744 PolarHBondContact O-N 3.04Å
745	L	49.3	Very low	50.9	Low	112 Å²	112	90.3 Å²	90.3	59%	0.586	52%	0.517	S	S	*	.			trans	-79.5	143.2	178	-68.8	172.6	0	0	0	110.2	I747	L745-I747 PolarHBondContact O-N 3.2Å
746	P	45.1	Very low	49.8	Very low	126 Å²	126	98.5 Å²	98.5	82%	0.818	55%	0.552	S	S	*	*			trans	-67.4	102.9	-170.9	25.3	-34.3	0	0	0	112.8	R748	P746-R748 PolarHBondContact O-N 3.04Å
747	I	43.3	Very low	48.9	Very low	161 Å²	161	103.3 Å²	103.3	83%	0.826	59%	0.586	S	S	*	*			trans	-60	121.6	175.7	-60	177.2	0	0	0	109.8	L745 S749	L745-I747 PolarHBondContact O-N 3.2Å; I747-S749 PolarHBondContact O-N 2.87Å
748	R	39.4	Very low	47.9	Very low	204 Å²	204	108.8 Å²	108.8	77%	0.77	61%	0.606	S	S	*	*			trans	-81.6	78.4	-173	-165.1	178.8	-174.6	-163.6	-0.9	112	P746 R750	P746-R748 PolarHBondContact O-N 3.04Å; R748-R750 PolarHBondContact O-N 2.91Å
749	S	36.4	Very low	47.2	Very low	110 Å²	110	120.5 Å²	120.5	77%	0.769	65%	0.649	S	S	*	*			trans	-54.3	129.2	177.6	59.7	0	0	0	0	113	I747	I747-S749 PolarHBondContact O-N 2.87Å
750	R	37	Very low	45.7	Very low	234 Å²	234	122.8 Å²	122.8	88%	0.883	68%	0.682	S	S	*	*			trans	-110.8	114.6	163.7	-70.2	-165.7	-168.4	-160.1	7.5	110.2	R748	R748-R750 PolarHBondContact O-N 2.91Å
751	L	37.5	Very low	44.4	Very low	165 Å²	165	134.2 Å²	134.2	86%	0.864	73%	0.725	S	S	*	*			trans	-147.7	144.1	161.9	-72.9	176.9	0	0	0	108
752	T	36.5	Very low	43.1	Very low	130 Å²	130	135.3 Å²	135.3	80%	0.798	74%	0.74	S	S	*	*			cis	-98.8	-119.2	-9.7	51.7	0	0	0	0	110.3
753	S	34.4	Very low	41.7	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	78%	0.781	S	S	*	*			cis	-143.7	-167.4	1.3	71.6	0	0	0	0	111.4
754	A	35.9	Very low	39.8	Very low	102 Å²	102	148.7 Å²	148.7	84%	0.843	80%	0.799	S	S	*	*			trans	-95.9	140.4	-174.1	0	0	0	0	0	114.3
755	G	37	Very low	39.1	Very low	78 Å²	78	152.1 Å²	152.1	80%	0.804	81%	0.806	S	S	*	*			trans	177.3	135.1	171.3	0	0	0	0	0	110.3
756	Q	40.7	Very low	38.9	Very low	198 Å²	198	156.1 Å²	156.1	93%	0.925	82%	0.822	S	S	*	*			trans	-86.7	155.1	-169.7	-71.5	176.6	-25.1	0	0	114.1
757	S	38.6	Very low	38.7	Very low	108 Å²	108	159.2 Å²	159.2	76%	0.755	82%	0.817	S	S	*	*			trans	100.6	136.9	146.2	-147.3	0	0	0	0	120.7
758	H	41.4	Very low	38.9	Very low	165 Å²	165	158.6 Å²	158.6	76%	0.764	82%	0.816	S	S	*	*			trans	-1.6	132.1	174.2	-60.7	-61.8	0	0	0	124.6
759	R	40.3	Very low	39	Very low	246 Å²	246	156.8 Å²	156.8	93%	0.928	81%	0.813	S	S	*	*			trans	36.3	114.3	132.7	-64.3	-179	172.9	-176	-1.4	118.9
760	G	35.3	Very low	39	Very low	82 Å²	82	159.8 Å²	159.8	85%	0.845	82%	0.815	S	S	*	*			trans	-171.6	98.1	165	0	0	0	0	0	116.9
761	R	40.8	Very low	39.2	Very low	239 Å²	239	154 Å²	154	90%	0.902	81%	0.808	S	S	*	*			trans	-48	145.7	171.4	-171.2	-165.8	-169.5	172.1	2.6	115.3
762	S	35.6	Very low	39.2	Very low	92 Å²	92	154.5 Å²	154.5	64%	0.643	81%	0.811	S	S	*	*			trans	126.4	119.1	141.1	-56	0	0	0	0	118.1
763	R	47.9	Very low	39.3	Very low	251 Å²	251	157 Å²	157	95%	0.947	81%	0.813	S	S	*	*			trans	24.9	105.3	130.2	-170.6	-172.6	-169.3	-170.8	4.4	117.8
764	V	31.3	Very low	39.8	Very low	129 Å²	129	158.6 Å²	158.6	78%	0.782	81%	0.809	S	S	*	*			trans	-130.5	150	155.4	-179.8	0	0	0	0	108.9
765	Q	37.4	Very low	40.6	Very low	152 Å²	152	164.4 Å²	164.4	71%	0.71	81%	0.809	S	S	*	*			trans	-60.7	153	-169.4	-63.6	142.6	-45.1	0	0	114.5
766	E	44.8	Very low	41.6	Very low	196 Å²	196	164.9 Å²	164.9	92%	0.916	79%	0.789	S	S	*	*			trans	-60	132.7	150.9	-65.4	170.5	122.4	0	0	109.3
767	R	42.1	Very low	42.3	Very low	191 Å²	191	160 Å²	160	72%	0.721	77%	0.765	S	S	*	*			trans	-140.4	118.9	157.3	-91	-171.2	-78.6	-174.8	-4.6	108.4
768	D	47.2	Very low	43	Very low	149 Å²	149	162.9 Å²	162.9	80%	0.797	76%	0.759	S	S	*	*			trans	42.3	99.6	139.3	-40.1	-42.5	0	0	0	116.1
769	K	41	Very low	44.4	Very low	165 Å²	165	155 Å²	155	72%	0.717	72%	0.723	S	S	*	*			trans	-104.5	115.6	160.1	-76.9	-176.8	177.3	177.8	0	109.5
770	E	37.5	Very low	45.6	Very low	173 Å²	173	148.4 Å²	148.4	81%	0.808	70%	0.702	S	S	*	*			trans	-47.7	143.1	160	-78.2	-72.3	114	0	0	111.5
771	P	39.3	Very low	47	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	67%	0.667	S	S	*	*			trans	-68.9	135.9	-178.7	28.4	-34.2	0	0	0	111.8	Q773	P771-Q773 PolarHBondContact O-N 3.37Å; P771-Q773 VanDerWaalsContact O-N 3.16Å
772	L	39.5	Very low	48.4	Very low	175 Å²	175	139.3 Å²	139.3	92%	0.916	65%	0.65	S	S	*	*			trans	-74.3	106.2	176.1	-73.5	172.9	0	0	0	110.5	E774	L772-E774 PolarHBondContact O-N 2.86Å
773	Q	37.9	Very low	49.8	Very low	182 Å²	182	140.3 Å²	140.3	85%	0.85	65%	0.645	S	S	*	*			trans	-66.4	125.7	178.1	-162.4	170.7	37.7	0	0	111.6	P771 R775	P771-Q773 PolarHBondContact O-N 3.37Å; P771-Q773 VanDerWaalsContact O-N 3.16Å; Q773-R775 PolarHBondContact O-N 2.78Å
774	E	43.7	Very low	50.9	Low	144 Å²	144	130.5 Å²	130.5	67%	0.673	62%	0.617	S	S	*	*			trans	-63.3	129	-177.8	-63.7	-170.3	144	0	0	112.3	L772 F776	L772-E774 PolarHBondContact O-N 2.86Å; E774-F776 HydrophobicContact CB-CE1 4.13Å; E774-F776 HydrophobicContact CB-CZ 3.96Å; E774-F776 PolarHBondContact O-N 2.88Å; E774-F776 VanDerWaalsContact O-N 3.14Å
775	R	53.6	Low	53	Low	225 Å²	225	125.8 Å²	125.8	85%	0.849	59%	0.589	S	S	*	*			trans	-84.4	86.9	179	-70.5	-174.5	175.9	-174.8	-1.7	111.5	Q773	Q773-R775 PolarHBondContact O-N 2.78Å
776	F	57.7	Low	54.4	Low	87 Å²	87	121 Å²	121	38%	0.382	58%	0.581	S	S	.	*			trans	-61.8	144.6	166.8	-53.8	-57	0	0	0	111.2	E774 L805 P806 K857 T858	E774-F776 HydrophobicContact CB-CE1 4.13Å; E774-F776 HydrophobicContact CB-CZ 3.96Å; E774-F776 PolarHBondContact O-N 2.88Å; E774-F776 VanDerWaalsContact O-N 3.14Å; F776-L805 CarbonylContact C-O 3.51Å; F776-L805 VanDerWaalsContact CA-O 3.23Å; F776-L805 WeakPolarHBondContact CA-O 3.49Å; F776-L805 VanDerWaalsContact CB-O 3.29Å; F776-L805 WeakPolarHBondContact CB-O 3.45Å; F776-P806 HydrophobicContact CD1-CG 4.27Å; F776-K857 VanDerWaalsContact CE2-NZ 3.29Å; F776-T858 HydrophobicContact CB-CG2 3.51Å
777	F	55.3	Low	55.8	Low	96 Å²	96	117.7 Å²	117.7	42%	0.421	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-148.2	147.5	178.2	65.9	-100.8	0	0	0	113.1	G804 L805 N856 T858	F777-G804 VanDerWaalsContact CE2-CA 3.45Å; F777-L805 HydrophobicContact CD1-CB 3.87Å; F777-L805 HydrophobicContact CD1-CD1 4.03Å; F777-L805 HydrophobicContact CD1-CG 4.04Å; F777-L805 HydrophobicContact CE1-CB 3.87Å; F777-L805 HydrophobicContact CE1-CD1 3.51Å; F777-L805 HydrophobicContact CE1-CG 3.5Å; F777-L805 VanDerWaalsContact CE1-CG 3.5Å; F777-L805 HydrophobicContact CG-CB 4.45Å; F777-L805 HydrophobicContact CZ-CB 4.41Å; F777-L805 HydrophobicContact CZ-CD1 4.35Å; F777-L805 HydrophobicContact CZ-CG 3.94Å; F777-L805 PolarHBondContact N-O 2.81Å; F777-L805 PolarHBondContact O-N 2.84Å; F777-N856 PolarHBondContact O-ND2 3.37Å; F777-T858 PolarHBondContact O-OG1 2.68Å
778	R	54.4	Low	57.3	Low	169 Å²	169	111.5 Å²	111.5	64%	0.638	55%	0.55	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	160.9	-171	77	177.1	-178.3	-178.6	0.2	113.2	T858	R778-T858 VanDerWaalsContact CA-OG1 3.27Å; R778-T858 WeakPolarHBondContact CA-OG1 3.46Å; R778-T858 WeakPolarHBondContact CB-O 3.28Å; R778-T858 PolarHBondContact N-OG1 3.38Å
779	P	69.9	Low	58.7	Low	0 Å²	0	109.1 Å²	109.1	0%	0	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	142.6	-177.9	-21.2	34.9	0	0	0	112.7	V802 S803 P808 A854 N856 G859 N861	P779-V802 HydrophobicContact CB-CG2 4.33Å; P779-S803 CarbonylContact C-O 3.57Å; P779-S803 VanDerWaalsContact CA-O 3.27Å; P779-S803 WeakPolarHBondContact CA-O 3.34Å; P779-P808 HydrophobicContact CB-CB 3.88Å; P779-P808 HydrophobicContact CB-CG 4.38Å; P779-P808 HydrophobicContact CG-CB 3.84Å; P779-A854 HydrophobicContact CB-CB 3.63Å; P779-A854 HydrophobicContact CG-CB 4.39Å; P779-A854 WeakPolarHBondContact CG-O 3.37Å; P779-N856 HydrophobicContact CG-CB 4.25Å; P779-G859 WeakPolarHBondContact CD-O 3.32Å; P779-G859 WeakPolarHBondContact CG-O 3.44Å; P779-N861 HydrophobicContact CB-CB 4.16Å; P779-N861 WeakPolarHBondContact O-CB 3.46Å; P779-N861 PolarHBondContact O-ND2 2.8Å
780	H	65.5	Low	60.4	Low	107 Å²	107	102.1 Å²	102.1	50%	0.495	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	118.5	178.5	-173.1	55	0	0	0	111.4	L782 V802 S803	H780-L782 PolarHBondContact O-N 2.78Å; H780-V802 CarbonylContact O-C 3.55Å; H780-V802 WeakPolarHBondContact O-CA 3.47Å; H780-V802 WeakPolarHBondContact O-CG2 3.46Å; H780-S803 PolarHBondContact N-O 2.88Å; H780-S803 PolarHBondContact O-N 3.47Å; H780-S803 PolarHBondContact O-OG 3.13Å
781	F	64.7	Low	62.3	Low	26 Å²	26	99.4 Å²	99.4	11%	0.114	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	116.5	176.7	-72.7	-79.1	0	0	0	110.3	C800 K801 V802 L810 C852 A854 N861 F863	F781-C800 HydrophobicContact CD1-CB 4.38Å; F781-C800 HydrophobicContact CE1-CB 4.41Å; F781-K801 CarbonylContact C-O 3.59Å; F781-K801 WeakPolarHBondContact CA-O 3.25Å; F781-V802 HydrophobicContact CD1-CB 3.86Å; F781-V802 HydrophobicContact CD1-CG2 4.04Å; F781-V802 HydrophobicContact CE1-CB 3.99Å; F781-V802 HydrophobicContact CE1-CG2 4.14Å; F781-V802 HydrophobicContact CG-CG2 4.28Å; F781-V802 HydrophobicContact CZ-CG2 4.47Å; F781-L810 HydrophobicContact CE1-CD2 3.6Å; F781-L810 HydrophobicContact CZ-CD2 3.58Å; F781-C852 HydrophobicContact CZ-CB 4.4Å; F781-A854 HydrophobicContact CE1-CB 4.32Å; F781-A854 HydrophobicContact CE2-CB 3.69Å; F781-A854 HydrophobicContact CZ-CB 3.53Å; F781-N861 HydrophobicContact CD2-CB 4.43Å; F781-N861 HydrophobicContact CE2-CB 4.46Å; F781-F863 HydrophobicContact CB-CD1 4.49Å; F781-F863 AromaticContact CD1-CD1 3.66Å; F781-F863 HydrophobicContact CD1-CD1 3.66Å; F781-F863 AromaticContact CD1-CE1 3.63Å; F781-F863 HydrophobicContact CD1-CE1 3.63Å; F781-F863 AromaticContact CD2-CD1 3.93Å; F781-F863 HydrophobicContact CD2-CD1 3.93Å; F781-F863 AromaticContact CE1-CD1 3.71Å; F781-F863 HydrophobicContact CE1-CD1 3.71Å; F781-F863 AromaticContact CE1-CE1 3.45Å; F781-F863 HydrophobicContact CE1-CE1 3.45Å; F781-F863 VanDerWaalsContact CE1-CE1 3.45Å; F781-F863 AromaticContact CE2-CD1 3.98Å; F781-F863 HydrophobicContact CE2-CD1 3.98Å; F781-F863 HydrophobicContact CE2-CE1 4.49Å; F781-F863 AromaticContact CG-CD1 3.76Å; F781-F863 HydrophobicContact CG-CD1 3.76Å; F781-F863 HydrophobicContact CG-CE1 4.22Å; F781-F863 AromaticContact CZ-CD1 3.85Å; F781-F863 HydrophobicContact CZ-CD1 3.85Å; F781-F863 AromaticContact CZ-CE1 3.9Å; F781-F863 HydrophobicContact CZ-CE1 3.9Å
782	L	69.4	Low	64.4	Low	104 Å²	104	96.9 Å²	96.9	55%	0.545	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-24.8	174	-56.4	179.2	0	0	0	111.5	H780 K801	H780-L782 PolarHBondContact O-N 2.78Å; L782-K801 HydrophobicContact CB-CG 4.33Å; L782-K801 HydrophobicContact CD1-CG 4.37Å; L782-K801 PolarHBondContact N-O 2.91Å
783	Q	66.1	Low	65.7	Low	113 Å²	113	90.4 Å²	90.4	53%	0.528	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	139.6	175.1	-172.9	176.7	-4.1	0	0	109.5	C800 K801	Q783-C800 CarbonylContact O-C 3.54Å; Q783-C800 VanDerWaalsContact O-CA 3.28Å; Q783-C800 WeakPolarHBondContact O-CA 3.24Å; Q783-C800 WeakPolarHBondContact O-CB 3.38Å; Q783-K801 HydrophobicContact CB-CB 3.98Å; Q783-K801 PolarHBondContact N-O 3.12Å; Q783-K801 VanDerWaalsContact N-O 3.13Å; Q783-K801 PolarHBondContact O-N 2.85Å
784	A	71.2	Confident	67.5	Low	44 Å²	44	90 Å²	90	36%	0.364	45%	0.445	S	S	.	.			trans	-136.2	151.3	170.7	0	0	0	0	0	109.2	F863	A784-F863 HydrophobicContact CB-CB 4.14Å; A784-F863 HydrophobicContact CB-CD1 3.53Å; A784-F863 HydrophobicContact CB-CD2 3.81Å; A784-F863 HydrophobicContact CB-CE1 3.76Å; A784-F863 HydrophobicContact CB-CE2 4.07Å; A784-F863 HydrophobicContact CB-CG 3.55Å; A784-F863 HydrophobicContact CB-CZ 4.04Å
785	P	75.3	Confident	69.1	Low	30 Å²	30	88 Å²	88	20%	0.195	44%	0.438	C	S	.	.			trans	-76	152.3	166.7	19.1	-5.7	0	0	0	110.2	L798 D799 W812 F863 L865	P785-L798 HydrophobicContact CG-CB 4.01Å; P785-L798 HydrophobicContact CG-CD2 4.48Å; P785-D799 VanDerWaalsContact CD-O 3.24Å; P785-D799 WeakPolarHBondContact CD-O 3.48Å; P785-D799 WeakPolarHBondContact CG-O 3.46Å; P785-W812 HydrophobicContact CG-CH2 4.33Å; P785-F863 HydrophobicContact CG-CE2 4.3Å; P785-F863 HydrophobicContact CG-CZ 4.39Å; P785-L865 HydrophobicContact CB-CD2 3.79Å; P785-L865 HydrophobicContact CG-CD2 3.56Å; P785-L865 WeakPolarHBondContact O-CD2 3.32Å
786	G	66.2	Low	70.4	Confident	52 Å²	52	77.4 Å²	77.4	54%	0.536	40%	0.398	S	S	.	.			trans	-98	-172	168.5	0	0	0	0	0	112
787	D	75.3	Confident	71.6	Confident	126 Å²	126	76.7 Å²	76.7	67%	0.674	39%	0.393	S	S	*	.			trans	-58.6	145.9	-179.3	-51.1	-26.7	0	0	0	112.3	L865 E866	D787-L865 VanDerWaalsContact OD1-CA 3.31Å; D787-L865 WeakPolarHBondContact OD1-CA 3.48Å; D787-E866 CarbonylContact C-O 3.44Å; D787-E866 VanDerWaalsContact CA-O 3.27Å; D787-E866 WeakPolarHBondContact CA-O 3.26Å; D787-E866 HydrophobicContact CB-CB 4.32Å; D787-E866 PolarHBondContact OD1-N 3.06Å
788	M	72	Confident	72.8	Confident	62 Å²	62	72.1 Å²	72.1	31%	0.305	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	149.7	-172.3	-178.5	162.3	48.8	0	0	113.5	C796 L798 E866 L867 S868	M788-C796 WeakPolarHBondContact CE-SG 3.37Å; M788-L798 HydrophobicContact CE-CD2 3.39Å; M788-E866 PolarHBondContact N-O 2.77Å; M788-L867 HydrophobicContact CB-CD1 4.1Å; M788-L867 HydrophobicContact CE-CD1 4.12Å; M788-L867 HydrophobicContact CG-CD1 4.24Å; M788-S868 PolarHBondContact O-N 2.81Å; M788-S868 PolarHBondContact O-OG 2.75Å
789	V	76.4	Confident	73.9	Confident	99 Å²	99	65.8 Å²	65.8	60%	0.6	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.8	166.9	-167.3	0	0	0	0	108.3	S868 V870	V789-S868 WeakPolarHBondContact CA-O 3.33Å; V789-S868 WeakPolarHBondContact CA-OG 3.2Å; V789-S868 WeakPolarHBondContact CG2-OG 3.29Å; V789-V870 HydrophobicContact CG1-CG2 3.63Å
790	A	78.4	Confident	74	Confident	17 Å²	17	65.8 Å²	65.8	14%	0.14	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	160	178	0	0	0	0	0	111.9	L842 L867 S868 V869 V870	A790-L842 HydrophobicContact CB-CD2 3.4Å; A790-L867 HydrophobicContact CB-CD1 4.25Å; A790-S868 PolarHBondContact N-O 2.62Å; A790-V869 CarbonylContact O-C 3.6Å; A790-V869 WeakPolarHBondContact O-CA 2.96Å; A790-V870 PolarHBondContact O-N 3.35Å
791	H	77.4	Confident	74.4	Confident	116 Å²	116	64.1 Å²	64.1	54%	0.537	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.1	-175.5	-69.1	-79.1	0	0	0	112.4	R794	H791-R794 HydrophobicContact CB-CG 4.14Å; H791-R794 WeakPolarHBondContact O-CB 3.46Å; H791-R794 WeakPolarHBondContact O-CG 3.39Å; H791-R794 PolarHBondContact O-N 2.84Å
792	E	81.9	Confident	74.7	Confident	60 Å²	60	63.6 Å²	63.6	28%	0.28	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	138.3	176.6	-179.7	176.1	-125.6	0	0	112.5	L842 V869 V870 A871 K872	E792-L842 CarbonylContact C-O 3.17Å; E792-L842 WeakPolarHBondContact CA-O 3.48Å; E792-V869 HydrophobicContact CB-CG1 4.15Å; E792-V870 PolarHBondContact N-O 3.14Å; E792-A871 WeakPolarHBondContact OE2-CA 3.34Å; E792-K872 HydrophobicContact CB-CB 4.14Å; E792-K872 HydrophobicContact CG-CB 4.36Å; E792-K872 PolarHBondContact OE2-N 3.48Å
793	G	67.4	Low	74.7	Confident	39 Å²	39	60.2 Å²	60.2	40%	0.402	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	25.4	-175.1	0	0	0	0	0	114.2	L842	G793-L842 PolarHBondContact N-O 3.31Å
794	R	76.3	Confident	74.3	Confident	175 Å²	175	55.3 Å²	55.3	66%	0.66	31%	0.307	S	S	*	.	S	Bend	trans	-119.6	158.8	170.3	-61.1	-60.7	-167.4	167.8	3.3	111	H791 C796 L842	H791-R794 HydrophobicContact CB-CG 4.14Å; H791-R794 WeakPolarHBondContact O-CB 3.46Å; H791-R794 WeakPolarHBondContact O-CG 3.39Å; H791-R794 PolarHBondContact O-N 2.84Å; R794-C796 PolarHBondContact O-N 3.04Å; R794-L842 WeakPolarHBondContact O-CB 3.47Å; R794-L842 PolarHBondContact O-N 2.92Å
795	L	76.9	Confident	73.5	Confident	100 Å²	100	57 Å²	57	52%	0.524	31%	0.309	S	S	.	.			trans	-67.1	118.9	164.7	170.9	66.1	0	0	0	109.9	L838 I839 D840	L795-L838 HydrophobicContact CD1-CB 4.05Å; L795-L838 HydrophobicContact CD1-CD1 4.27Å; L795-L838 HydrophobicContact CD1-CD2 4.16Å; L795-L838 HydrophobicContact CD1-CG 4.4Å; L795-I839 WeakPolarHBondContact CA-O 3.45Å; L795-D840 HydrophobicContact CB-CB 4.35Å; L795-D840 HydrophobicContact CD1-CB 3.71Å
796	C	81.6	Confident	73	Confident	4 Å²	4	57.4 Å²	57.4	3%	0.027	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	153.2	163.8	-163.2	0	0	0	0	110.5	M788 R794 L838 I839 L842	M788-C796 WeakPolarHBondContact CE-SG 3.37Å; R794-C796 PolarHBondContact O-N 3.04Å; C796-L838 WeakPolarHBondContact O-CA 3.19Å; C796-I839 HydrophobicContact CB-CB 3.97Å; C796-I839 HydrophobicContact CB-CD1 4.34Å; C796-I839 HydrophobicContact CB-CG1 4.21Å; C796-I839 PolarHBondContact N-O 3.39Å; C796-I839 PolarHBondContact O-N 3.33Å; C796-L842 HydrophobicContact CB-CB 4.33Å; C796-L842 HydrophobicContact CB-CD1 3.89Å; C796-L842 HydrophobicContact CB-CD2 4.16Å; C796-L842 HydrophobicContact CB-CG 4.37Å
797	R	82.5	Confident	72.7	Confident	72 Å²	72	60 Å²	60	27%	0.272	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	118.7	-178.5	177.5	164.1	-177	97.5	27.9	111.8	D799 S836 L837 L838	R797-D799 VanDerWaalsContact CG-OD1 3.3Å; R797-D799 WeakPolarHBondContact CG-OD1 3.39Å; R797-D799 IonicContact CZ-OD1 2.62Å; R797-D799 IonicContact CZ-OD2 3.93Å; R797-D799 IonicContact NE-OD1 3.53Å; R797-D799 PolarHBondContact NE-OD1 3.28Å; R797-D799 IonicContact NE-OD2 3.66Å; R797-D799 PolarHBondContact NE-OD2 3.2Å; R797-D799 IonicContact NH2-OD1 2.73Å; R797-D799 PolarHBondContact NH2-OD1 2.99Å; R797-D799 IonicContact NH2-OD2 3.79Å; R797-D799 PolarHBondContact NH2-OD2 2.79Å; R797-S836 PolarHBondContact NH2-OG 3.31Å; R797-L837 WeakPolarHBondContact CA-O 3.34Å; R797-L838 HydrophobicContact CB-CD2 3.65Å; R797-L838 HydrophobicContact CG-CD2 3.5Å
798	L	79.8	Confident	72.3	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	107.3	174.9	-55.1	177.8	0	0	0	109.3	P785 M788 W812 S836 L837 Y850 L865	P785-L798 HydrophobicContact CG-CB 4.01Å; P785-L798 HydrophobicContact CG-CD2 4.48Å; M788-L798 HydrophobicContact CE-CD2 3.39Å; L798-W812 HydrophobicContact CB-CH2 3.64Å; L798-W812 HydrophobicContact CB-CZ2 4.23Å; L798-W812 HydrophobicContact CB-CZ3 4.19Å; L798-W812 HydrophobicContact CD1-CE3 4.44Å; L798-W812 HydrophobicContact CD1-CH2 4.12Å; L798-W812 HydrophobicContact CD1-CZ3 3.78Å; L798-S836 CarbonylContact O-C 3.55Å; L798-S836 WeakPolarHBondContact O-CA 2.83Å; L798-L837 HydrophobicContact CB-CB 4.36Å; L798-L837 HydrophobicContact CD1-CD2 4.37Å; L798-L837 PolarHBondContact N-O 3.44Å; L798-L837 PolarHBondContact O-N 3.29Å; L798-Y850 HydrophobicContact CD1-CD1 3.97Å; L798-Y850 HydrophobicContact CD1-CD2 4.3Å; L798-Y850 HydrophobicContact CD1-CE1 4.39Å; L798-Y850 HydrophobicContact CD1-CG 3.92Å; L798-L865 HydrophobicContact CD1-CD1 4.32Å; L798-L865 HydrophobicContact CD1-CD2 4.45Å; L798-L865 HydrophobicContact CD2-CD1 4.11Å; L798-L865 HydrophobicContact CD2-CD2 4.07Å
799	D	78.2	Confident	72.2	Confident	36 Å²	36	59 Å²	59	19%	0.193	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.9	-178	-79.3	4.1	0	0	0	112.3	P785 R797 R830 V834 H835	P785-D799 VanDerWaalsContact CD-O 3.24Å; P785-D799 WeakPolarHBondContact CD-O 3.48Å; P785-D799 WeakPolarHBondContact CG-O 3.46Å; R797-D799 VanDerWaalsContact CG-OD1 3.3Å; R797-D799 WeakPolarHBondContact CG-OD1 3.39Å; R797-D799 IonicContact CZ-OD1 2.62Å; R797-D799 IonicContact CZ-OD2 3.93Å; R797-D799 IonicContact NE-OD1 3.53Å; R797-D799 PolarHBondContact NE-OD1 3.28Å; R797-D799 IonicContact NE-OD2 3.66Å; R797-D799 PolarHBondContact NE-OD2 3.2Å; R797-D799 IonicContact NH2-OD1 2.73Å; R797-D799 PolarHBondContact NH2-OD1 2.99Å; R797-D799 IonicContact NH2-OD2 3.79Å; R797-D799 PolarHBondContact NH2-OD2 2.79Å; D799-R830 IonicContact OD2-CZ 2.64Å; D799-R830 IonicContact OD2-NH1 4Å; D799-R830 PolarHBondContact OD2-NH1 3.01Å; D799-V834 HydrophobicContact CB-CG1 3.93Å; D799-H835 WeakPolarHBondContact CA-O 3.21Å
800	C	71.3	Confident	72.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	159	173.7	67.7	0	0	0	0	111.9	F781 Q783 V834 H835 F863	F781-C800 HydrophobicContact CD1-CB 4.38Å; F781-C800 HydrophobicContact CE1-CB 4.41Å; Q783-C800 CarbonylContact O-C 3.54Å; Q783-C800 VanDerWaalsContact O-CA 3.28Å; Q783-C800 WeakPolarHBondContact O-CA 3.24Å; Q783-C800 WeakPolarHBondContact O-CB 3.38Å; C800-V834 CarbonylContact O-C 3.59Å; C800-H835 PolarHBondContact N-O 3.46Å; C800-H835 PolarHBondContact O-N 3.3Å; C800-H835 VanDerWaalsContact O-O 3.14Å; C800-F863 HydrophobicContact CB-CE1 3.55Å; C800-F863 HydrophobicContact CB-CZ 3.69Å
801	K	74.6	Confident	72.2	Confident	72 Å²	72	57.1 Å²	57.1	31%	0.313	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	133.2	175	179.6	151.4	-175.6	169.6	0	109.3	F781 L782 Q783 T832 G833 V834	F781-K801 CarbonylContact C-O 3.59Å; F781-K801 WeakPolarHBondContact CA-O 3.25Å; L782-K801 HydrophobicContact CB-CG 4.33Å; L782-K801 HydrophobicContact CD1-CG 4.37Å; L782-K801 PolarHBondContact N-O 2.91Å; Q783-K801 HydrophobicContact CB-CB 3.98Å; Q783-K801 PolarHBondContact N-O 3.12Å; Q783-K801 VanDerWaalsContact N-O 3.13Å; Q783-K801 PolarHBondContact O-N 2.85Å; K801-T832 PolarHBondContact NZ-O 2.78Å; K801-G833 WeakPolarHBondContact CD-O 3.49Å; K801-G833 VanDerWaalsContact CG-O 3.24Å; K801-G833 WeakPolarHBondContact CG-O 3.49Å; K801-V834 HydrophobicContact CD-CG2 4.27Å
802	V	69.8	Low	72.4	Confident	14 Å²	14	51.8 Å²	51.8	9%	0.085	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.2	-174.6	68.7	0	0	0	0	110.4	P779 H780 F781 P808 L810 A854	P779-V802 HydrophobicContact CB-CG2 4.33Å; H780-V802 CarbonylContact O-C 3.55Å; H780-V802 WeakPolarHBondContact O-CA 3.47Å; H780-V802 WeakPolarHBondContact O-CG2 3.46Å; F781-V802 HydrophobicContact CD1-CB 3.86Å; F781-V802 HydrophobicContact CD1-CG2 4.04Å; F781-V802 HydrophobicContact CE1-CB 3.99Å; F781-V802 HydrophobicContact CE1-CG2 4.14Å; F781-V802 HydrophobicContact CG-CG2 4.28Å; F781-V802 HydrophobicContact CZ-CG2 4.47Å; V802-P808 HydrophobicContact CB-CG 4.39Å; V802-P808 HydrophobicContact CG1-CG 3.64Å; V802-P808 HydrophobicContact CG2-CG 3.89Å; V802-L810 HydrophobicContact CG1-CD1 3.88Å; V802-L810 HydrophobicContact CG1-CD2 4.27Å; V802-L810 HydrophobicContact CG1-CG 4.33Å; V802-A854 HydrophobicContact CG2-CB 3.75Å
803	S	71.1	Confident	72.1	Confident	34 Å²	34	50.3 Å²	50.3	24%	0.238	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	158.7	169.2	63.8	0	0	0	0	110.8	P779 H780	P779-S803 CarbonylContact C-O 3.57Å; P779-S803 VanDerWaalsContact CA-O 3.27Å; P779-S803 WeakPolarHBondContact CA-O 3.34Å; H780-S803 PolarHBondContact N-O 2.88Å; H780-S803 PolarHBondContact O-N 3.47Å; H780-S803 PolarHBondContact O-OG 3.13Å
804	G	57.8	Low	73.1	Confident	9 Å²	9	49.8 Å²	49.8	9%	0.093	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.8	150.6	178	0	0	0	0	0	110.2	F777 P806	F777-G804 VanDerWaalsContact CE2-CA 3.45Å; G804-P806 CarbonylContact C-O 3.46Å; G804-P806 CarbonylContact O-C 3.53Å
805	L	52.6	Low	73.3	Confident	81 Å²	81	46.2 Å²	46.2	42%	0.424	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.6	169	-74.4	-176.5	0	0	0	109.9	F776 F777 N856	F776-L805 CarbonylContact C-O 3.51Å; F776-L805 VanDerWaalsContact CA-O 3.23Å; F776-L805 WeakPolarHBondContact CA-O 3.49Å; F776-L805 VanDerWaalsContact CB-O 3.29Å; F776-L805 WeakPolarHBondContact CB-O 3.45Å; F777-L805 HydrophobicContact CD1-CB 3.87Å; F777-L805 HydrophobicContact CD1-CD1 4.03Å; F777-L805 HydrophobicContact CD1-CG 4.04Å; F777-L805 HydrophobicContact CE1-CB 3.87Å; F777-L805 HydrophobicContact CE1-CD1 3.51Å; F777-L805 HydrophobicContact CE1-CG 3.5Å; F777-L805 VanDerWaalsContact CE1-CG 3.5Å; F777-L805 HydrophobicContact CG-CB 4.45Å; F777-L805 HydrophobicContact CZ-CB 4.41Å; F777-L805 HydrophobicContact CZ-CD1 4.35Å; F777-L805 HydrophobicContact CZ-CG 3.94Å; F777-L805 PolarHBondContact N-O 2.81Å; F777-L805 PolarHBondContact O-N 2.84Å; L805-N856 PolarHBondContact N-ND2 3.48Å
806	P	64.8	Low	73	Confident	38 Å²	38	43.8 Å²	43.8	25%	0.247	25%	0.248	C	C	.	.	S	Bend	cis	-59.6	162.7	-4	-20.9	34.1	0	0	0	113	F776 G804 N856 K857	F776-P806 HydrophobicContact CD1-CG 4.27Å; G804-P806 CarbonylContact C-O 3.46Å; G804-P806 CarbonylContact O-C 3.53Å; P806-N856 WeakPolarHBondContact O-CB 3.34Å; P806-N856 PolarHBondContact O-ND2 3.12Å; P806-K857 HydrophobicContact CG-CD 3.73Å; P806-K857 HydrophobicContact CG-CG 3.88Å
807	P	61.3	Low	72.3	Confident	107 Å²	107	50.1 Å²	50.1	70%	0.695	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-49.9	132.7	176	-27.4	35.9	0	0	0	111.2
808	P	65.7	Low	71.3	Confident	20 Å²	20	50.2 Å²	50.2	13%	0.13	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-84.3	138.4	-173.6	33.5	-35.3	0	0	0	112.5	P779 V802 A854 T855 N856	P779-P808 HydrophobicContact CB-CB 3.88Å; P779-P808 HydrophobicContact CB-CG 4.38Å; P779-P808 HydrophobicContact CG-CB 3.84Å; V802-P808 HydrophobicContact CB-CG 4.39Å; V802-P808 HydrophobicContact CG1-CG 3.64Å; V802-P808 HydrophobicContact CG2-CG 3.89Å; P808-A854 HydrophobicContact CB-CB 4.25Å; P808-T855 CarbonylContact C-O 3.6Å; P808-T855 VanDerWaalsContact CA-O 3.25Å; P808-T855 WeakPolarHBondContact CA-O 3.35Å; P808-N856 HydrophobicContact CB-CB 4.41Å
809	E	71.3	Confident	70.7	Confident	146 Å²	146	51 Å²	51	68%	0.682	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	150.4	167	-172.7	177.2	-176.2	0	0	110	A854 T855	E809-A854 CarbonylContact O-C 3.55Å; E809-A854 VanDerWaalsContact O-CA 3.25Å; E809-A854 WeakPolarHBondContact O-CA 3.28Å; E809-T855 PolarHBondContact N-O 3.02Å; E809-T855 PolarHBondContact O-N 2.84Å
810	L	77.1	Confident	70.4	Confident	20 Å²	20	51.6 Å²	51.6	11%	0.105	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.3	-175.3	-75.8	152.6	0	0	0	111.8	F781 V802 M827 H835 C852 I853 A854	F781-L810 HydrophobicContact CE1-CD2 3.6Å; F781-L810 HydrophobicContact CZ-CD2 3.58Å; V802-L810 HydrophobicContact CG1-CD1 3.88Å; V802-L810 HydrophobicContact CG1-CD2 4.27Å; V802-L810 HydrophobicContact CG1-CG 4.33Å; L810-M827 WeakPolarHBondContact O-CE 3.26Å; L810-H835 HydrophobicContact CD1-CB 3.65Å; L810-H835 WeakPolarHBondContact CD1-ND1 3.3Å; L810-C852 VanDerWaalsContact CD2-SG 3.59Å; L810-I853 CarbonylContact C-O 3.48Å; L810-I853 WeakPolarHBondContact CA-O 3.27Å; L810-A854 HydrophobicContact CD2-CB 3.69Å; L810-A854 HydrophobicContact CG-CB 4.41Å
811	T	77.1	Confident	69.7	Low	57 Å²	57	55.7 Å²	55.7	35%	0.35	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.6	171.8	-41.7	0	0	0	0	108.9	L813 I853	T811-L813 HydrophobicContact CG2-CD2 4.2Å; T811-I853 PolarHBondContact N-O 3.18Å; T811-I853 PolarHBondContact O-N 2.79Å
812	W	81.8	Confident	69.2	Low	3 Å²	3	55 Å²	55	1%	0.011	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	142.1	167	-73.8	85.2	0	0	0	109.7	P785 L798 P818 V819 L837 Y850 K851 C852 F863	P785-W812 HydrophobicContact CG-CH2 4.33Å; L798-W812 HydrophobicContact CB-CH2 3.64Å; L798-W812 HydrophobicContact CB-CZ2 4.23Å; L798-W812 HydrophobicContact CB-CZ3 4.19Å; L798-W812 HydrophobicContact CD1-CE3 4.44Å; L798-W812 HydrophobicContact CD1-CH2 4.12Å; L798-W812 HydrophobicContact CD1-CZ3 3.78Å; W812-P818 WeakPolarHBondContact O-CA 3.36Å; W812-V819 HydrophobicContact CB-CB 4.03Å; W812-V819 HydrophobicContact CB-CG2 4.26Å; W812-V819 PolarHBondContact O-N 2.87Å; W812-L837 HydrophobicContact CB-CD2 4.14Å; W812-L837 HydrophobicContact CD2-CB 4.19Å; W812-L837 HydrophobicContact CD2-CD2 3.9Å; W812-L837 HydrophobicContact CE3-CD2 4.1Å; W812-L837 HydrophobicContact CG-CB 4.47Å; W812-L837 HydrophobicContact CG-CD2 3.95Å; W812-L837 HydrophobicContact CZ2-CB 4.18Å; W812-Y850 HydrophobicContact CE3-CD1 4.13Å; W812-K851 CarbonylContact C-O 3.57Å; W812-C852 HydrophobicContact CD2-CB 3.79Å; W812-C852 HydrophobicContact CE3-CB 3.76Å; W812-C852 HydrophobicContact CG-CB 4.49Å; W812-C852 HydrophobicContact CH2-CB 4.02Å; W812-C852 HydrophobicContact CZ2-CB 4.03Å; W812-C852 HydrophobicContact CZ3-CB 3.87Å; W812-F863 AromaticContact CH2-CE2 3.84Å; W812-F863 HydrophobicContact CH2-CE2 3.84Å; W812-F863 AromaticContact CH2-CZ 3.52Å; W812-F863 HydrophobicContact CH2-CZ 3.52Å; W812-F863 HydrophobicContact CZ2-CZ 4.06Å; W812-F863 AromaticContact CZ3-CE2 3.98Å; W812-F863 HydrophobicContact CZ3-CE2 3.98Å; W812-F863 HydrophobicContact CZ3-CZ 4.05Å
813	L	75.1	Confident	68.7	Low	30 Å²	30	58.6 Å²	58.6	16%	0.157	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.1	168.3	-46.2	179.7	0	0	0	109.3	T811 Q817 P818 Y850 K851 I853	T811-L813 HydrophobicContact CG2-CD2 4.2Å; L813-Q817 CarbonylContact C-O 3.44Å; L813-Q817 WeakPolarHBondContact CA-O 3.26Å; L813-Q817 WeakPolarHBondContact CB-O 3.4Å; L813-P818 HydrophobicContact CD2-CB 4.13Å; L813-Y850 CarbonylContact O-C 3.52Å; L813-Y850 VanDerWaalsContact O-CA 3.23Å; L813-Y850 WeakPolarHBondContact O-CA 3.42Å; L813-K851 HydrophobicContact CB-CB 4.32Å; L813-K851 HydrophobicContact CD1-CD 4.43Å; L813-K851 PolarHBondContact N-O 2.88Å; L813-K851 PolarHBondContact O-N 3.14Å; L813-I853 HydrophobicContact CD1-CD1 3.73Å; L813-I853 HydrophobicContact CG-CD1 4.14Å
814	L	88.3	Confident	68.1	Low	28 Å²	28	58.5 Å²	58.5	15%	0.147	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.8	165.8	168.4	58.6	0	0	0	107.7	G816 Q817 V819 Y850	L814-G816 PolarHBondContact O-N 2.79Å; L814-Q817 PolarHBondContact N-O 2.92Å; L814-Q817 PolarHBondContact O-N 2.86Å; L814-V819 HydrophobicContact CB-CG2 3.65Å; L814-Y850 HydrophobicContact CB-CD1 4.39Å; L814-Y850 HydrophobicContact CB-CE1 4.09Å; L814-Y850 HydrophobicContact CD1-CD2 3.97Å; L814-Y850 HydrophobicContact CD1-CE1 4.45Å; L814-Y850 HydrophobicContact CD1-CE2 3.64Å; L814-Y850 HydrophobicContact CD1-CG 4.49Å
815	N	81.4	Confident	68.7	Low	99 Å²	99	58.7 Å²	58.7	53%	0.529	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	30.5	-178.6	-58.2	-42.3	0	0	0	113.1	A847 G848 T849	N815-A847 PolarHBondContact ND2-O 2.88Å; N815-G848 WeakPolarHBondContact OD1-CA 3.43Å; N815-T849 PolarHBondContact N-O 3.01Å; N815-T849 PolarHBondContact OD1-N 3.1Å
816	G	70.5	Confident	69.3	Low	50 Å²	50	59 Å²	59	52%	0.515	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-7.8	-177.4	0	0	0	0	0	116.2	L814	L814-G816 PolarHBondContact O-N 2.79Å
817	Q	66.9	Low	69.5	Low	137 Å²	137	60.3 Å²	60.3	64%	0.64	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	143.7	176.1	-59.2	-54.2	-51	0	0	111.2	L813 L814 V819	L813-Q817 CarbonylContact C-O 3.44Å; L813-Q817 WeakPolarHBondContact CA-O 3.26Å; L813-Q817 WeakPolarHBondContact CB-O 3.4Å; L814-Q817 PolarHBondContact N-O 2.92Å; L814-Q817 PolarHBondContact O-N 2.86Å; Q817-V819 PolarHBondContact O-N 2.81Å
818	P	60.5	Low	69.5	Low	74 Å²	74	59.4 Å²	59.4	48%	0.481	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	132.2	-179.2	26.9	-34.2	0	0	0	112.4	W812 L813	W812-P818 WeakPolarHBondContact O-CA 3.36Å; L813-P818 HydrophobicContact CD2-CB 4.13Å
819	V	68	Low	69	Low	15 Å²	15	63.3 Å²	63.3	9%	0.091	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	111.6	168.3	-176.2	0	0	0	0	107.2	W812 L814 Q817 H825 L837 Y850	W812-V819 HydrophobicContact CB-CB 4.03Å; W812-V819 HydrophobicContact CB-CG2 4.26Å; W812-V819 PolarHBondContact O-N 2.87Å; L814-V819 HydrophobicContact CB-CG2 3.65Å; Q817-V819 PolarHBondContact O-N 2.81Å; V819-H825 HydrophobicContact CG1-CB 4.07Å; V819-L837 HydrophobicContact CG1-CD1 4.17Å; V819-L837 HydrophobicContact CG1-CD2 4.06Å; V819-Y850 HydrophobicContact CG2-CD1 4.32Å; V819-Y850 HydrophobicContact CG2-CE1 3.95Å
820	L	71.6	Confident	67.9	Low	50 Å²	50	61.7 Å²	61.7	26%	0.262	35%	0.352	S	S	.	.			trans	-87.7	153	175.4	-59.6	179.1	0	0	0	110.2	I233 D822 H825	I233-L820 HydrophobicContact CG2-CD1 3.97Å; L820-D822 PolarHBondContact O-N 2.93Å; L820-H825 WeakPolarHBondContact O-CB 3.12Å
821	P	56.8	Low	66.2	Low	86 Å²	86	66.8 Å²	66.8	56%	0.558	38%	0.375	S	S	*	.			trans	-60.9	125.9	165.3	-21.7	34.2	0	0	0	110.7	H825 M827	P821-H825 CarbonylContact C-O 3.5Å; P821-H825 VanDerWaalsContact CA-O 3.29Å; P821-H825 WeakPolarHBondContact CA-O 3.33Å; P821-M827 HydrophobicContact CG-SD 4.4Å
822	D	64.4	Low	64.7	Low	56 Å²	56	68.4 Å²	68.4	30%	0.299	39%	0.385	S	S	.	.			trans	-143	-174.6	177.6	73.8	47.6	0	0	0	111.6	L820 S824 H825	L820-D822 PolarHBondContact O-N 2.93Å; D822-S824 PolarHBondContact O-N 2.9Å; D822-S824 VanDerWaalsContact OD1-CA 3.27Å; D822-S824 WeakPolarHBondContact OD1-CA 3.44Å; D822-S824 WeakPolarHBondContact OD1-CB 3.32Å; D822-S824 PolarHBondContact OD1-N 2.82Å; D822-S824 PolarHBondContact OD1-OG 2.81Å; D822-H825 PolarHBondContact N-O 3.01Å; D822-H825 VanDerWaalsContact O-O 3.13Å; D822-H825 IonicContact OD1-CG 3.78Å; D822-H825 PolarHBondContact OD1-N 2.83Å; D822-H825 IonicContact OD1-ND1 3.68Å; D822-H825 IonicContact OD2-CE1 2.69Å; D822-H825 IonicContact OD2-CG 2.92Å; D822-H825 IonicContact OD2-ND1 3.98Å; D822-H825 PolarHBondContact OD2-ND1 2.67Å
823	A	57.9	Low	63.2	Low	91 Å²	91	69.5 Å²	69.5	75%	0.752	40%	0.397	S	S	*	.	S	Bend	trans	-60.6	-26.9	-178.9	0	0	0	0	0	113.7	K826	A823-K826 WeakPolarHBondContact O-CE 3.4Å; A823-K826 PolarHBondContact O-NZ 3.39Å
824	S	58.6	Low	62.6	Low	31 Å²	31	69 Å²	69	22%	0.217	40%	0.395	C	S	.	.	S	Bend	trans	-96.9	-50.2	174.1	21.5	0	0	0	0	112.5	D822 K826 I839 D840	D822-S824 PolarHBondContact O-N 2.9Å; D822-S824 VanDerWaalsContact OD1-CA 3.27Å; D822-S824 WeakPolarHBondContact OD1-CA 3.44Å; D822-S824 WeakPolarHBondContact OD1-CB 3.32Å; D822-S824 PolarHBondContact OD1-N 2.82Å; D822-S824 PolarHBondContact OD1-OG 2.81Å; S824-K826 PolarHBondContact O-N 2.86Å; S824-I839 WeakPolarHBondContact O-CA 3.16Å; S824-D840 WeakPolarHBondContact CA-O 3.2Å; S824-D840 PolarHBondContact O-N 2.95Å
825	H	70	Confident	61.9	Low	14 Å²	14	69.3 Å²	69.3	7%	0.065	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	105.4	-176.2	-68	99.3	0	0	0	111.7	V819 L820 P821 D822 L837 L838 D846	V819-H825 HydrophobicContact CG1-CB 4.07Å; L820-H825 WeakPolarHBondContact O-CB 3.12Å; P821-H825 CarbonylContact C-O 3.5Å; P821-H825 VanDerWaalsContact CA-O 3.29Å; P821-H825 WeakPolarHBondContact CA-O 3.33Å; D822-H825 PolarHBondContact N-O 3.01Å; D822-H825 VanDerWaalsContact O-O 3.13Å; D822-H825 IonicContact OD1-CG 3.78Å; D822-H825 PolarHBondContact OD1-N 2.83Å; D822-H825 IonicContact OD1-ND1 3.68Å; D822-H825 IonicContact OD2-CE1 2.69Å; D822-H825 IonicContact OD2-CG 2.92Å; D822-H825 IonicContact OD2-ND1 3.98Å; D822-H825 PolarHBondContact OD2-ND1 2.67Å; H825-L837 HydrophobicContact CB-CD1 4.27Å; H825-L838 CarbonylContact C-O 3.47Å; H825-L838 VanDerWaalsContact CA-O 3.28Å; H825-L838 WeakPolarHBondContact CA-O 3.31Å; H825-D846 IonicContact CE1-OD1 3.57Å; H825-D846 PolarHBondContact CE1-OD1 3.26Å; H825-D846 IonicContact NE2-OD1 3.72Å
826	K	66.5	Low	61.6	Low	86 Å²	86	64.7 Å²	64.7	37%	0.374	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	114	-178.1	-56.7	-172.7	-175.5	79.6	0	111.7	A823 S824 L838	A823-K826 WeakPolarHBondContact O-CE 3.4Å; A823-K826 PolarHBondContact O-NZ 3.39Å; S824-K826 PolarHBondContact O-N 2.86Å; K826-L838 HydrophobicContact CB-CB 4.25Å; K826-L838 PolarHBondContact N-O 2.87Å; K826-L838 PolarHBondContact O-N 2.79Å
827	M	69.2	Low	62.1	Low	67 Å²	67	62.3 Å²	62.3	33%	0.33	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.2	175	-72.6	176	54.1	0	0	110.4	L810 P821 S836 L837	L810-M827 WeakPolarHBondContact O-CE 3.26Å; P821-M827 HydrophobicContact CG-SD 4.4Å; M827-S836 CarbonylContact C-O 3.56Å; M827-S836 VanDerWaalsContact CA-O 3.27Å; M827-S836 WeakPolarHBondContact CA-O 3.41Å; M827-L837 HydrophobicContact CG-CD1 3.88Å
828	L	61.3	Low	62.2	Low	87 Å²	87	57 Å²	57	46%	0.455	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	128.5	-174.7	-64.6	176.5	0	0	0	111.4	H835 S836 L838	L828-H835 CarbonylContact O-C 3.55Å; L828-H835 WeakPolarHBondContact O-CA 3.44Å; L828-S836 PolarHBondContact N-O 2.9Å; L828-S836 WeakPolarHBondContact O-CB 3.43Å; L828-S836 PolarHBondContact O-N 2.84Å; L828-S836 PolarHBondContact O-OG 3.24Å; L828-L838 HydrophobicContact CD1-CD1 3.68Å; L828-L838 HydrophobicContact CD1-CG 4.32Å
829	V	53.8	Low	63.3	Low	103 Å²	103	53.4 Å²	53.4	62%	0.624	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.3	168.7	-168.3	0	0	0	0	108.6	H835	V829-H835 VanDerWaalsContact CG2-ND1 3.32Å; V829-H835 WeakPolarHBondContact CG2-ND1 3.46Å
830	R	48.8	Very low	64	Low	112 Å²	112	56.2 Å²	56.2	42%	0.423	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	148.7	171.1	-71.5	174.2	162.5	151.5	-2.2	110.1	D799 T832 G833 V834	D799-R830 IonicContact OD2-CZ 2.64Å; D799-R830 IonicContact OD2-NH1 4Å; D799-R830 PolarHBondContact OD2-NH1 3.01Å; R830-T832 PolarHBondContact O-N 3.34Å; R830-G833 WeakPolarHBondContact O-CA 3.27Å; R830-G833 PolarHBondContact O-N 2.7Å; R830-V834 HydrophobicContact CB-CB 4.33Å; R830-V834 WeakPolarHBondContact CB-O 3.48Å; R830-V834 PolarHBondContact N-O 2.8Å
831	E	40.9	Very low	64.1	Low	127 Å²	127	57.3 Å²	57.3	59%	0.593	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-29.8	173.3	-62.9	163.3	167.8	0	0	112.9	N722 G833	N722-E831 PolarHBondContact ND2-OE2 3.44Å; E831-G833 PolarHBondContact O-N 2.99Å; E831-G833 VanDerWaalsContact O-N 3.09Å
832	T	45.9	Very low	65.2	Low	91 Å²	91	53.2 Å²	53.2	56%	0.558	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	4.9	174	58.1	0	0	0	0	114.9	K801 R830 V834	K801-T832 PolarHBondContact NZ-O 2.78Å; R830-T832 PolarHBondContact O-N 3.34Å; T832-V834 VanDerWaalsContact C-N 3.33Å
833	G	50.2	Low	66.1	Low	25 Å²	25	52 Å²	52	26%	0.258	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	27.1	-174.7	0	0	0	0	0	113.5	K801 R830 E831	K801-G833 WeakPolarHBondContact CD-O 3.49Å; K801-G833 VanDerWaalsContact CG-O 3.24Å; K801-G833 WeakPolarHBondContact CG-O 3.49Å; R830-G833 WeakPolarHBondContact O-CA 3.27Å; R830-G833 PolarHBondContact O-N 2.7Å; E831-G833 PolarHBondContact O-N 2.99Å; E831-G833 VanDerWaalsContact O-N 3.09Å
834	V	64.2	Low	67.2	Low	20 Å²	20	52 Å²	52	12%	0.121	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	117.2	175.6	176.5	0	0	0	0	108.7	D799 C800 K801 R830 T832	D799-V834 HydrophobicContact CB-CG1 3.93Å; C800-V834 CarbonylContact O-C 3.59Å; K801-V834 HydrophobicContact CD-CG2 4.27Å; R830-V834 HydrophobicContact CB-CB 4.33Å; R830-V834 WeakPolarHBondContact CB-O 3.48Å; R830-V834 PolarHBondContact N-O 2.8Å; T832-V834 VanDerWaalsContact C-N 3.33Å
835	H	72.1	Confident	68.5	Low	34 Å²	34	58.2 Å²	58.2	16%	0.157	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	141.5	176.4	-52.9	-102.5	0	0	0	108.8	D799 C800 L810 L828 V829	D799-H835 WeakPolarHBondContact CA-O 3.21Å; C800-H835 PolarHBondContact N-O 3.46Å; C800-H835 PolarHBondContact O-N 3.3Å; C800-H835 VanDerWaalsContact O-O 3.14Å; L810-H835 HydrophobicContact CD1-CB 3.65Å; L810-H835 WeakPolarHBondContact CD1-ND1 3.3Å; L828-H835 CarbonylContact O-C 3.55Å; L828-H835 WeakPolarHBondContact O-CA 3.44Å; V829-H835 VanDerWaalsContact CG2-ND1 3.32Å; V829-H835 WeakPolarHBondContact CG2-ND1 3.46Å
836	S	75.3	Confident	69.2	Low	2 Å²	2	58.1 Å²	58.1	1%	0.014	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	134.2	-169	-18	0	0	0	0	109.1	R797 L798 M827 L828	R797-S836 PolarHBondContact NH2-OG 3.31Å; L798-S836 CarbonylContact O-C 3.55Å; L798-S836 WeakPolarHBondContact O-CA 2.83Å; M827-S836 CarbonylContact C-O 3.56Å; M827-S836 VanDerWaalsContact CA-O 3.27Å; M827-S836 WeakPolarHBondContact CA-O 3.41Å; L828-S836 PolarHBondContact N-O 2.9Å; L828-S836 WeakPolarHBondContact O-CB 3.43Å; L828-S836 PolarHBondContact O-N 2.84Å; L828-S836 PolarHBondContact O-OG 3.24Å
837	L	81.7	Confident	70.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117	155.1	175.7	58.7	0	0	0	108.1	R797 L798 W812 V819 H825 M827 Y850	R797-L837 WeakPolarHBondContact CA-O 3.34Å; L798-L837 HydrophobicContact CB-CB 4.36Å; L798-L837 HydrophobicContact CD1-CD2 4.37Å; L798-L837 PolarHBondContact N-O 3.44Å; L798-L837 PolarHBondContact O-N 3.29Å; W812-L837 HydrophobicContact CB-CD2 4.14Å; W812-L837 HydrophobicContact CD2-CB 4.19Å; W812-L837 HydrophobicContact CD2-CD2 3.9Å; W812-L837 HydrophobicContact CE3-CD2 4.1Å; W812-L837 HydrophobicContact CG-CB 4.47Å; W812-L837 HydrophobicContact CG-CD2 3.95Å; W812-L837 HydrophobicContact CZ2-CB 4.18Å; V819-L837 HydrophobicContact CG1-CD1 4.17Å; V819-L837 HydrophobicContact CG1-CD2 4.06Å; H825-L837 HydrophobicContact CB-CD1 4.27Å; M827-L837 HydrophobicContact CG-CD1 3.88Å; L837-Y850 HydrophobicContact CD2-CD1 3.95Å; L837-Y850 HydrophobicContact CD2-CE1 3.72Å
838	L	69.8	Low	70.6	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.131	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	146.9	170.7	-59.4	-170.5	0	0	0	110.2	L795 C796 R797 H825 K826 L828	L795-L838 HydrophobicContact CD1-CB 4.05Å; L795-L838 HydrophobicContact CD1-CD1 4.27Å; L795-L838 HydrophobicContact CD1-CD2 4.16Å; L795-L838 HydrophobicContact CD1-CG 4.4Å; C796-L838 WeakPolarHBondContact O-CA 3.19Å; R797-L838 HydrophobicContact CB-CD2 3.65Å; R797-L838 HydrophobicContact CG-CD2 3.5Å; H825-L838 CarbonylContact C-O 3.47Å; H825-L838 VanDerWaalsContact CA-O 3.28Å; H825-L838 WeakPolarHBondContact CA-O 3.31Å; K826-L838 HydrophobicContact CB-CB 4.25Å; K826-L838 PolarHBondContact N-O 2.87Å; K826-L838 PolarHBondContact O-N 2.79Å; L828-L838 HydrophobicContact CD1-CD1 3.68Å; L828-L838 HydrophobicContact CD1-CG 4.32Å
839	I	82.8	Confident	71.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	109.5	172.8	-38.4	178.4	0	0	0	107.7	L795 C796 S824 L842 D846 Y850 L867	L795-I839 WeakPolarHBondContact CA-O 3.45Å; C796-I839 HydrophobicContact CB-CB 3.97Å; C796-I839 HydrophobicContact CB-CD1 4.34Å; C796-I839 HydrophobicContact CB-CG1 4.21Å; C796-I839 PolarHBondContact N-O 3.39Å; C796-I839 PolarHBondContact O-N 3.33Å; S824-I839 WeakPolarHBondContact O-CA 3.16Å; I839-L842 HydrophobicContact CB-CD1 4.17Å; I839-L842 HydrophobicContact CD1-CD1 4.08Å; I839-L842 HydrophobicContact CG2-CD1 4.06Å; I839-D846 HydrophobicContact CD1-CB 4.29Å; I839-D846 HydrophobicContact CG2-CB 4.13Å; I839-Y850 HydrophobicContact CD1-CE1 4.39Å; I839-Y850 VanDerWaalsContact CD1-OH 3.25Å; I839-Y850 WeakPolarHBondContact CD1-OH 3.46Å; I839-L867 HydrophobicContact CD1-CD2 3.87Å
840	D	81.7	Confident	73.4	Confident	74 Å²	74	46.4 Å²	46.4	40%	0.396	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-148.9	112.5	-175.1	-169	29.7	0	0	0	112.8	L795 S824	L795-D840 HydrophobicContact CB-CB 4.35Å; L795-D840 HydrophobicContact CD1-CB 3.71Å; S824-D840 WeakPolarHBondContact CA-O 3.2Å; S824-D840 PolarHBondContact O-N 2.95Å
841	P	73.6	Confident	75.1	Confident	72 Å²	72	44.8 Å²	44.8	47%	0.468	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	cis	-75.2	137.6	-1.4	31	-34.2	0	0	0	112	T843	P841-T843 WeakPolarHBondContact O-CG2 3.43Å; P841-T843 PolarHBondContact O-N 3.45Å
842	L	80.9	Confident	77.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.			trans	-61.9	131.3	166.2	-178	72.6	0	0	0	110.7	A790 E792 G793 R794 C796 I839 D846 L867 V869	A790-L842 HydrophobicContact CB-CD2 3.4Å; E792-L842 CarbonylContact C-O 3.17Å; E792-L842 WeakPolarHBondContact CA-O 3.48Å; G793-L842 PolarHBondContact N-O 3.31Å; R794-L842 WeakPolarHBondContact O-CB 3.47Å; R794-L842 PolarHBondContact O-N 2.92Å; C796-L842 HydrophobicContact CB-CB 4.33Å; C796-L842 HydrophobicContact CB-CD1 3.89Å; C796-L842 HydrophobicContact CB-CD2 4.16Å; C796-L842 HydrophobicContact CB-CG 4.37Å; I839-L842 HydrophobicContact CB-CD1 4.17Å; I839-L842 HydrophobicContact CD1-CD1 4.08Å; I839-L842 HydrophobicContact CG2-CD1 4.06Å; L842-D846 HydrophobicContact CD1-CB 3.8Å; L842-L867 HydrophobicContact CD1-CD2 4.08Å; L842-V869 HydrophobicContact CD1-CG2 3.89Å; L842-V869 HydrophobicContact CD2-CG1 4.01Å; L842-V869 HydrophobicContact CD2-CG2 3.96Å; L842-V869 HydrophobicContact CG-CG1 4.06Å; L842-V869 HydrophobicContact CG-CG2 3.94Å
843	T	82.9	Confident	78.8	Confident	32 Å²	32	35.4 Å²	35.4	20%	0.196	19%	0.188	C	C	.	.			trans	-122.7	164	179.9	77.8	0	0	0	0	111.4	P841 R845 D846	P841-T843 WeakPolarHBondContact O-CG2 3.43Å; P841-T843 PolarHBondContact O-N 3.45Å; T843-R845 PolarHBondContact O-N 3.02Å; T843-R845 PolarHBondContact OG1-N 2.83Å; T843-D846 WeakPolarHBondContact CA-OD2 3.07Å; T843-D846 WeakPolarHBondContact CB-OD2 3.45Å; T843-D846 PolarHBondContact N-OD2 2.98Å; T843-D846 PolarHBondContact O-N 3.24Å; T843-D846 PolarHBondContact OG1-OD2 3.12Å
844	Q	81.5	Confident	80	Confident	89 Å²	89	34.2 Å²	34.2	42%	0.416	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-61.1	-14.4	176.7	-158.2	64	57.3	0	0	114.4	D846 V869	Q844-D846 VanDerWaalsContact C-N 3.34Å; Q844-V869 PolarHBondContact NE2-O 3.16Å; Q844-V869 PolarHBondContact OE1-O 2.92Å
845	R	85.3	Confident	80.4	Confident	163 Å²	163	35.5 Å²	35.5	62%	0.615	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-77	-20.9	175	-70	-178	-71	-159	-6.3	113.4	T843 A847	T843-R845 PolarHBondContact O-N 3.02Å; T843-R845 PolarHBondContact OG1-N 2.83Å; R845-A847 PolarHBondContact O-N 3.36Å
846	D	85.4	Confident	80.3	Confident	12 Å²	12	34.8 Å²	34.8	6%	0.064	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-91.7	19.6	-174.3	-41.7	-47.4	0	0	0	110.8	H825 I839 L842 T843 Q844 Y850 L867	H825-D846 IonicContact CE1-OD1 3.57Å; H825-D846 PolarHBondContact CE1-OD1 3.26Å; H825-D846 IonicContact NE2-OD1 3.72Å; I839-D846 HydrophobicContact CD1-CB 4.29Å; I839-D846 HydrophobicContact CG2-CB 4.13Å; L842-D846 HydrophobicContact CD1-CB 3.8Å; T843-D846 WeakPolarHBondContact CA-OD2 3.07Å; T843-D846 WeakPolarHBondContact CB-OD2 3.45Å; T843-D846 PolarHBondContact N-OD2 2.98Å; T843-D846 PolarHBondContact O-N 3.24Å; T843-D846 PolarHBondContact OG1-OD2 3.12Å; Q844-D846 VanDerWaalsContact C-N 3.34Å; D846-Y850 WeakPolarHBondContact O-CE2 3.46Å; D846-Y850 PolarHBondContact O-OH 3.17Å; D846-L867 WeakPolarHBondContact O-CD2 3.2Å
847	A	85.1	Confident	80	Confident	26 Å²	26	41.3 Å²	41.3	22%	0.215	21%	0.21	C	C	.	.			trans	-92.6	143.5	174.4	0	0	0	0	0	111	N815 R845 L867 V869	N815-A847 PolarHBondContact ND2-O 2.88Å; R845-A847 PolarHBondContact O-N 3.36Å; A847-L867 CarbonylContact C-O 3.56Å; A847-L867 VanDerWaalsContact CA-O 3.26Å; A847-L867 WeakPolarHBondContact CA-O 3.43Å; A847-V869 HydrophobicContact CB-CB 4.22Å; A847-V869 HydrophobicContact CB-CG2 3.87Å
848	G	80.1	Confident	79.3	Confident	6 Å²	6	44.1 Å²	44.1	6%	0.062	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.8	-166.4	176.2	0	0	0	0	0	113.5	N815 Y850 E866 L867	N815-G848 WeakPolarHBondContact OD1-CA 3.43Å; G848-Y850 PolarHBondContact O-N 3Å; G848-E866 VanDerWaalsContact C-CD 3.49Å; G848-E866 VanDerWaalsContact CA-OE1 3.27Å; G848-E866 WeakPolarHBondContact CA-OE1 3.06Å; G848-L867 PolarHBondContact N-O 3.34Å; G848-L867 PolarHBondContact O-N 3.47Å
849	T	86.5	Confident	79	Confident	64 Å²	64	44.5 Å²	44.5	39%	0.393	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	111	-174.4	-44.8	0	0	0	0	110.8	N815 L865 E866	N815-T849 PolarHBondContact N-O 3.01Å; N815-T849 PolarHBondContact OD1-N 3.1Å; T849-L865 CarbonylContact C-O 3.39Å; T849-L865 WeakPolarHBondContact CA-O 3.26Å; T849-E866 WeakPolarHBondContact CA-OE2 3.5Å; T849-E866 VanDerWaalsContact CB-OE2 3.32Å; T849-E866 WeakPolarHBondContact CB-OE2 3.39Å; T849-E866 PolarHBondContact N-OE2 3.41Å; T849-E866 VanDerWaalsContact N-OE2 3.14Å; T849-E866 PolarHBondContact OG1-OE2 3Å
850	Y	87.8	Confident	78.3	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	134.9	169.7	-77.2	-96.2	0	0	0	110.6	L798 W812 L813 L814 V819 L837 I839 D846 G848 S864 L865 L867	L798-Y850 HydrophobicContact CD1-CD1 3.97Å; L798-Y850 HydrophobicContact CD1-CD2 4.3Å; L798-Y850 HydrophobicContact CD1-CE1 4.39Å; L798-Y850 HydrophobicContact CD1-CG 3.92Å; W812-Y850 HydrophobicContact CE3-CD1 4.13Å; L813-Y850 CarbonylContact O-C 3.52Å; L813-Y850 VanDerWaalsContact O-CA 3.23Å; L813-Y850 WeakPolarHBondContact O-CA 3.42Å; L814-Y850 HydrophobicContact CB-CD1 4.39Å; L814-Y850 HydrophobicContact CB-CE1 4.09Å; L814-Y850 HydrophobicContact CD1-CD2 3.97Å; L814-Y850 HydrophobicContact CD1-CE1 4.45Å; L814-Y850 HydrophobicContact CD1-CE2 3.64Å; L814-Y850 HydrophobicContact CD1-CG 4.49Å; V819-Y850 HydrophobicContact CG2-CD1 4.32Å; V819-Y850 HydrophobicContact CG2-CE1 3.95Å; L837-Y850 HydrophobicContact CD2-CD1 3.95Å; L837-Y850 HydrophobicContact CD2-CE1 3.72Å; I839-Y850 HydrophobicContact CD1-CE1 4.39Å; I839-Y850 VanDerWaalsContact CD1-OH 3.25Å; I839-Y850 WeakPolarHBondContact CD1-OH 3.46Å; D846-Y850 WeakPolarHBondContact O-CE2 3.46Å; D846-Y850 PolarHBondContact O-OH 3.17Å; G848-Y850 PolarHBondContact O-N 3Å; Y850-S864 CarbonylContact O-C 3.23Å; Y850-S864 WeakPolarHBondContact O-CA 3.3Å; Y850-S864 WeakPolarHBondContact O-CB 3.38Å; Y850-L865 HydrophobicContact CD2-CD1 4.38Å; Y850-L865 PolarHBondContact N-O 2.82Å; Y850-L865 PolarHBondContact O-N 2.99Å; Y850-L867 HydrophobicContact CD2-CB 3.76Å; Y850-L867 HydrophobicContact CD2-CD2 4.38Å; Y850-L867 HydrophobicContact CE2-CB 3.7Å; Y850-L867 HydrophobicContact CE2-CD2 3.68Å; Y850-L867 HydrophobicContact CE2-CG 4.27Å
851	K	83.2	Confident	77.8	Confident	79 Å²	79	48.7 Å²	48.7	34%	0.343	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	116.7	172.3	175	171.6	-177.2	-179.9	0	110	W812 L813 I853 S862 F863 S864	W812-K851 CarbonylContact C-O 3.57Å; L813-K851 HydrophobicContact CB-CB 4.32Å; L813-K851 HydrophobicContact CD1-CD 4.43Å; L813-K851 PolarHBondContact N-O 2.88Å; L813-K851 PolarHBondContact O-N 3.14Å; K851-I853 HydrophobicContact CD-CD1 4.28Å; K851-I853 HydrophobicContact CD-CG1 4.36Å; K851-I853 HydrophobicContact CG-CD1 4.36Å; K851-I853 HydrophobicContact CG-CG1 3.98Å; K851-S862 VanDerWaalsContact CE-OG 3.25Å; K851-S862 WeakPolarHBondContact CE-OG 3.41Å; K851-F863 CarbonylContact C-O 3.6Å; K851-F863 WeakPolarHBondContact CA-O 3.24Å; K851-F863 WeakPolarHBondContact CG-O 3.42Å; K851-S864 WeakPolarHBondContact CB-OG 3.22Å; K851-S864 WeakPolarHBondContact CG-OG 3.37Å
852	C	82.8	Confident	78.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.6	173.3	-166.2	0	0	0	0	109.9	F781 L810 W812 S862 F863	F781-C852 HydrophobicContact CZ-CB 4.4Å; L810-C852 VanDerWaalsContact CD2-SG 3.59Å; W812-C852 HydrophobicContact CD2-CB 3.79Å; W812-C852 HydrophobicContact CE3-CB 3.76Å; W812-C852 HydrophobicContact CG-CB 4.49Å; W812-C852 HydrophobicContact CH2-CB 4.02Å; W812-C852 HydrophobicContact CZ2-CB 4.03Å; W812-C852 HydrophobicContact CZ3-CB 3.87Å; C852-S862 CarbonylContact O-C 3.58Å; C852-S862 WeakPolarHBondContact O-CA 3.45Å; C852-S862 WeakPolarHBondContact O-CB 3.27Å; C852-F863 HydrophobicContact CB-CD1 3.97Å; C852-F863 HydrophobicContact CB-CD2 4.31Å; C852-F863 HydrophobicContact CB-CE1 3.4Å; C852-F863 VanDerWaalsContact CB-CE1 3.4Å; C852-F863 HydrophobicContact CB-CE2 3.74Å; C852-F863 HydrophobicContact CB-CG 4.4Å; C852-F863 HydrophobicContact CB-CZ 3.25Å; C852-F863 PolarHBondContact N-O 2.81Å; C852-F863 PolarHBondContact O-N 2.84Å
853	I	81.4	Confident	78.1	Confident	20 Å²	20	48.9 Å²	48.9	10%	0.103	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	122.8	-175.4	-54.5	-174.9	0	0	0	108.2	L810 T811 L813 K851 Q860 N861	L810-I853 CarbonylContact C-O 3.48Å; L810-I853 WeakPolarHBondContact CA-O 3.27Å; T811-I853 PolarHBondContact N-O 3.18Å; T811-I853 PolarHBondContact O-N 2.79Å; L813-I853 HydrophobicContact CD1-CD1 3.73Å; L813-I853 HydrophobicContact CG-CD1 4.14Å; K851-I853 HydrophobicContact CD-CD1 4.28Å; K851-I853 HydrophobicContact CD-CG1 4.36Å; K851-I853 HydrophobicContact CG-CD1 4.36Å; K851-I853 HydrophobicContact CG-CG1 3.98Å; I853-Q860 HydrophobicContact CG2-CG 3.44Å; I853-Q860 VanDerWaalsContact CG2-CG 3.44Å; I853-N861 CarbonylContact C-O 3.55Å; I853-N861 WeakPolarHBondContact CA-O 3.44Å
854	A	75.3	Confident	78.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.4	175.8	0	0	0	0	0	110.5	P779 F781 V802 P808 E809 L810 Q860 N861	P779-A854 HydrophobicContact CB-CB 3.63Å; P779-A854 HydrophobicContact CG-CB 4.39Å; P779-A854 WeakPolarHBondContact CG-O 3.37Å; F781-A854 HydrophobicContact CE1-CB 4.32Å; F781-A854 HydrophobicContact CE2-CB 3.69Å; F781-A854 HydrophobicContact CZ-CB 3.53Å; V802-A854 HydrophobicContact CG2-CB 3.75Å; P808-A854 HydrophobicContact CB-CB 4.25Å; E809-A854 CarbonylContact O-C 3.55Å; E809-A854 VanDerWaalsContact O-CA 3.25Å; E809-A854 WeakPolarHBondContact O-CA 3.28Å; L810-A854 HydrophobicContact CD2-CB 3.69Å; L810-A854 HydrophobicContact CG-CB 4.41Å; A854-Q860 CarbonylContact O-C 3.53Å; A854-Q860 VanDerWaalsContact O-CA 3.24Å; A854-Q860 WeakPolarHBondContact O-CA 3.44Å; A854-Q860 WeakPolarHBondContact O-CG 3.22Å; A854-N861 PolarHBondContact N-O 3.17Å; A854-N861 PolarHBondContact O-N 2.94Å
855	T	73	Confident	78.4	Confident	48 Å²	48	46.4 Å²	46.4	29%	0.294	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.3	-174.1	-48	0	0	0	0	111.6	P808 E809 Q860	P808-T855 CarbonylContact C-O 3.6Å; P808-T855 VanDerWaalsContact CA-O 3.25Å; P808-T855 WeakPolarHBondContact CA-O 3.35Å; E809-T855 PolarHBondContact N-O 3.02Å; E809-T855 PolarHBondContact O-N 2.84Å; T855-Q860 HydrophobicContact CG2-CB 4.46Å; T855-Q860 PolarHBondContact OG1-NE2 3.4Å
856	N	71.4	Confident	78.3	Confident	18 Å²	18	42.5 Å²	42.5	10%	0.096	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	177.9	165	77.3	12.2	0	0	0	110.8	F777 P779 L805 P806 P808 T858 G859	F777-N856 PolarHBondContact O-ND2 3.37Å; P779-N856 HydrophobicContact CG-CB 4.25Å; L805-N856 PolarHBondContact N-ND2 3.48Å; P806-N856 WeakPolarHBondContact O-CB 3.34Å; P806-N856 PolarHBondContact O-ND2 3.12Å; P808-N856 HydrophobicContact CB-CB 4.41Å; N856-T858 PolarHBondContact O-N 3.27Å; N856-T858 WeakPolarHBondContact OD1-CA 3.22Å; N856-T858 PolarHBondContact OD1-N 2.92Å; N856-T858 PolarHBondContact OD1-OG1 3.08Å; N856-G859 PolarHBondContact N-O 2.81Å; N856-G859 PolarHBondContact O-N 2.82Å; N856-G859 VanDerWaalsContact O-O 3.07Å; N856-G859 PolarHBondContact OD1-N 2.93Å
857	K	67.1	Low	78.4	Confident	140 Å²	140	42 Å²	42	61%	0.609	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-3.5	-178.7	82.3	-175.9	-178.6	-175.2	0	116	F776 P806	F776-K857 VanDerWaalsContact CE2-NZ 3.29Å; P806-K857 HydrophobicContact CG-CD 3.73Å; P806-K857 HydrophobicContact CG-CG 3.88Å
858	T	68.3	Low	78.1	Confident	59 Å²	59	43.1 Å²	43.1	36%	0.362	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	6.2	177.2	60.9	0	0	0	0	113.8	F776 F777 R778 N856	F776-T858 HydrophobicContact CB-CG2 3.51Å; F777-T858 PolarHBondContact O-OG1 2.68Å; R778-T858 VanDerWaalsContact CA-OG1 3.27Å; R778-T858 WeakPolarHBondContact CA-OG1 3.46Å; R778-T858 WeakPolarHBondContact CB-O 3.28Å; R778-T858 PolarHBondContact N-OG1 3.38Å; N856-T858 PolarHBondContact O-N 3.27Å; N856-T858 WeakPolarHBondContact OD1-CA 3.22Å; N856-T858 PolarHBondContact OD1-N 2.92Å; N856-T858 PolarHBondContact OD1-OG1 3.08Å
859	G	62.6	Low	78.4	Confident	32 Å²	32	43.5 Å²	43.5	33%	0.33	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	139.2	-165.7	170.1	0	0	0	0	0	113.9	P779 N856	P779-G859 WeakPolarHBondContact CD-O 3.32Å; P779-G859 WeakPolarHBondContact CG-O 3.44Å; N856-G859 PolarHBondContact N-O 2.81Å; N856-G859 PolarHBondContact O-N 2.82Å; N856-G859 VanDerWaalsContact O-O 3.07Å; N856-G859 PolarHBondContact OD1-N 2.93Å
860	Q	68.8	Low	78	Confident	117 Å²	117	43.4 Å²	43.4	55%	0.547	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	157.1	-173.3	-172.2	174	85.5	0	0	111.1	I853 A854 T855	I853-Q860 HydrophobicContact CG2-CG 3.44Å; I853-Q860 VanDerWaalsContact CG2-CG 3.44Å; A854-Q860 CarbonylContact O-C 3.53Å; A854-Q860 VanDerWaalsContact O-CA 3.24Å; A854-Q860 WeakPolarHBondContact O-CA 3.44Å; A854-Q860 WeakPolarHBondContact O-CG 3.22Å; T855-Q860 HydrophobicContact CG2-CB 4.46Å; T855-Q860 PolarHBondContact OG1-NE2 3.4Å
861	N	71.4	Confident	77.2	Confident	46 Å²	46	46.1 Å²	46.1	25%	0.246	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	159.2	173.7	-158.5	-22.4	0	0	0	109.8	P779 F781 I853 A854	P779-N861 HydrophobicContact CB-CB 4.16Å; P779-N861 WeakPolarHBondContact O-CB 3.46Å; P779-N861 PolarHBondContact O-ND2 2.8Å; F781-N861 HydrophobicContact CD2-CB 4.43Å; F781-N861 HydrophobicContact CE2-CB 4.46Å; I853-N861 CarbonylContact C-O 3.55Å; I853-N861 WeakPolarHBondContact CA-O 3.44Å; A854-N861 PolarHBondContact N-O 3.17Å; A854-N861 PolarHBondContact O-N 2.94Å
862	S	81.1	Confident	76.4	Confident	48 Å²	48	49 Å²	49	34%	0.336	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	149.1	-179.5	65.2	0	0	0	0	114.1	K851 C852	K851-S862 VanDerWaalsContact CE-OG 3.25Å; K851-S862 WeakPolarHBondContact CE-OG 3.41Å; C852-S862 CarbonylContact O-C 3.58Å; C852-S862 WeakPolarHBondContact O-CA 3.45Å; C852-S862 WeakPolarHBondContact O-CB 3.27Å
863	F	79.9	Confident	75.3	Confident	27 Å²	27	56.3 Å²	56.3	12%	0.118	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	169.6	165.7	70.2	-100.7	0	0	0	110.9	F781 A784 P785 C800 W812 K851 C852 L865	F781-F863 HydrophobicContact CB-CD1 4.49Å; F781-F863 AromaticContact CD1-CD1 3.66Å; F781-F863 HydrophobicContact CD1-CD1 3.66Å; F781-F863 AromaticContact CD1-CE1 3.63Å; F781-F863 HydrophobicContact CD1-CE1 3.63Å; F781-F863 AromaticContact CD2-CD1 3.93Å; F781-F863 HydrophobicContact CD2-CD1 3.93Å; F781-F863 AromaticContact CE1-CD1 3.71Å; F781-F863 HydrophobicContact CE1-CD1 3.71Å; F781-F863 AromaticContact CE1-CE1 3.45Å; F781-F863 HydrophobicContact CE1-CE1 3.45Å; F781-F863 VanDerWaalsContact CE1-CE1 3.45Å; F781-F863 AromaticContact CE2-CD1 3.98Å; F781-F863 HydrophobicContact CE2-CD1 3.98Å; F781-F863 HydrophobicContact CE2-CE1 4.49Å; F781-F863 AromaticContact CG-CD1 3.76Å; F781-F863 HydrophobicContact CG-CD1 3.76Å; F781-F863 HydrophobicContact CG-CE1 4.22Å; F781-F863 AromaticContact CZ-CD1 3.85Å; F781-F863 HydrophobicContact CZ-CD1 3.85Å; F781-F863 AromaticContact CZ-CE1 3.9Å; F781-F863 HydrophobicContact CZ-CE1 3.9Å; A784-F863 HydrophobicContact CB-CB 4.14Å; A784-F863 HydrophobicContact CB-CD1 3.53Å; A784-F863 HydrophobicContact CB-CD2 3.81Å; A784-F863 HydrophobicContact CB-CE1 3.76Å; A784-F863 HydrophobicContact CB-CE2 4.07Å; A784-F863 HydrophobicContact CB-CG 3.55Å; A784-F863 HydrophobicContact CB-CZ 4.04Å; P785-F863 HydrophobicContact CG-CE2 4.3Å; P785-F863 HydrophobicContact CG-CZ 4.39Å; C800-F863 HydrophobicContact CB-CE1 3.55Å; C800-F863 HydrophobicContact CB-CZ 3.69Å; W812-F863 AromaticContact CH2-CE2 3.84Å; W812-F863 HydrophobicContact CH2-CE2 3.84Å; W812-F863 AromaticContact CH2-CZ 3.52Å; W812-F863 HydrophobicContact CH2-CZ 3.52Å; W812-F863 HydrophobicContact CZ2-CZ 4.06Å; W812-F863 AromaticContact CZ3-CE2 3.98Å; W812-F863 HydrophobicContact CZ3-CE2 3.98Å; W812-F863 HydrophobicContact CZ3-CZ 4.05Å; K851-F863 CarbonylContact C-O 3.6Å; K851-F863 WeakPolarHBondContact CA-O 3.24Å; K851-F863 WeakPolarHBondContact CG-O 3.42Å; C852-F863 HydrophobicContact CB-CD1 3.97Å; C852-F863 HydrophobicContact CB-CD2 4.31Å; C852-F863 HydrophobicContact CB-CE1 3.4Å; C852-F863 VanDerWaalsContact CB-CE1 3.4Å; C852-F863 HydrophobicContact CB-CE2 3.74Å; C852-F863 HydrophobicContact CB-CG 4.4Å; C852-F863 HydrophobicContact CB-CZ 3.25Å; C852-F863 PolarHBondContact N-O 2.81Å; C852-F863 PolarHBondContact O-N 2.84Å; F863-L865 HydrophobicContact CE2-CD2 4.12Å
864	S	81.9	Confident	74.4	Confident	67 Å²	67	59.7 Å²	59.7	47%	0.469	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	156.4	173	-52	0	0	0	0	111.8	Y850 K851	Y850-S864 CarbonylContact O-C 3.23Å; Y850-S864 WeakPolarHBondContact O-CA 3.3Å; Y850-S864 WeakPolarHBondContact O-CB 3.38Å; K851-S864 WeakPolarHBondContact CB-OG 3.22Å; K851-S864 WeakPolarHBondContact CG-OG 3.37Å
865	L	88.1	Confident	74.4	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	159.7	177.8	65.8	88.6	0	0	0	110.6	P785 D787 L798 T849 Y850 F863 L867	P785-L865 HydrophobicContact CB-CD2 3.79Å; P785-L865 HydrophobicContact CG-CD2 3.56Å; P785-L865 WeakPolarHBondContact O-CD2 3.32Å; D787-L865 VanDerWaalsContact OD1-CA 3.31Å; D787-L865 WeakPolarHBondContact OD1-CA 3.48Å; L798-L865 HydrophobicContact CD1-CD1 4.32Å; L798-L865 HydrophobicContact CD1-CD2 4.45Å; L798-L865 HydrophobicContact CD2-CD1 4.11Å; L798-L865 HydrophobicContact CD2-CD2 4.07Å; T849-L865 CarbonylContact C-O 3.39Å; T849-L865 WeakPolarHBondContact CA-O 3.26Å; Y850-L865 HydrophobicContact CD2-CD1 4.38Å; Y850-L865 PolarHBondContact N-O 2.82Å; Y850-L865 PolarHBondContact O-N 2.99Å; F863-L865 HydrophobicContact CE2-CD2 4.12Å; L865-L867 HydrophobicContact CD1-CB 4.4Å
866	E	82.8	Confident	74.4	Confident	81 Å²	81	67.6 Å²	67.6	38%	0.379	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.2	173	-169	65	-163.9	0	0	111.5	D787 M788 G848 T849	D787-E866 CarbonylContact C-O 3.44Å; D787-E866 VanDerWaalsContact CA-O 3.27Å; D787-E866 WeakPolarHBondContact CA-O 3.26Å; D787-E866 HydrophobicContact CB-CB 4.32Å; D787-E866 PolarHBondContact OD1-N 3.06Å; M788-E866 PolarHBondContact N-O 2.77Å; G848-E866 VanDerWaalsContact C-CD 3.49Å; G848-E866 VanDerWaalsContact CA-OE1 3.27Å; G848-E866 WeakPolarHBondContact CA-OE1 3.06Å; T849-E866 WeakPolarHBondContact CA-OE2 3.5Å; T849-E866 VanDerWaalsContact CB-OE2 3.32Å; T849-E866 WeakPolarHBondContact CB-OE2 3.39Å; T849-E866 PolarHBondContact N-OE2 3.41Å; T849-E866 VanDerWaalsContact N-OE2 3.14Å; T849-E866 PolarHBondContact OG1-OE2 3Å
867	L	87.4	Confident	74.6	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.6	171.2	179.3	55.5	0	0	0	110.1	M788 A790 I839 L842 D846 A847 G848 Y850 L865	M788-L867 HydrophobicContact CB-CD1 4.1Å; M788-L867 HydrophobicContact CE-CD1 4.12Å; M788-L867 HydrophobicContact CG-CD1 4.24Å; A790-L867 HydrophobicContact CB-CD1 4.25Å; I839-L867 HydrophobicContact CD1-CD2 3.87Å; L842-L867 HydrophobicContact CD1-CD2 4.08Å; D846-L867 WeakPolarHBondContact O-CD2 3.2Å; A847-L867 CarbonylContact C-O 3.56Å; A847-L867 VanDerWaalsContact CA-O 3.26Å; A847-L867 WeakPolarHBondContact CA-O 3.43Å; G848-L867 PolarHBondContact N-O 3.34Å; G848-L867 PolarHBondContact O-N 3.47Å; Y850-L867 HydrophobicContact CD2-CB 3.76Å; Y850-L867 HydrophobicContact CD2-CD2 4.38Å; Y850-L867 HydrophobicContact CE2-CB 3.7Å; Y850-L867 HydrophobicContact CE2-CD2 3.68Å; Y850-L867 HydrophobicContact CE2-CG 4.27Å; L865-L867 HydrophobicContact CD1-CB 4.4Å
868	S	78.9	Confident	75.6	Confident	51 Å²	51	62.4 Å²	62.4	36%	0.357	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.6	174.1	57.7	0	0	0	0	111	M788 V789 A790	M788-S868 PolarHBondContact O-N 2.81Å; M788-S868 PolarHBondContact O-OG 2.75Å; V789-S868 WeakPolarHBondContact CA-O 3.33Å; V789-S868 WeakPolarHBondContact CA-OG 3.2Å; V789-S868 WeakPolarHBondContact CG2-OG 3.29Å; A790-S868 PolarHBondContact N-O 2.62Å
869	V	86.2	Confident	76.5	Confident	13 Å²	13	63.5 Å²	63.5	8%	0.079	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128.7	-179.1	-174.6	0	0	0	0	110	A790 E792 L842 Q844 A847	A790-V869 CarbonylContact O-C 3.6Å; A790-V869 WeakPolarHBondContact O-CA 2.96Å; E792-V869 HydrophobicContact CB-CG1 4.15Å; L842-V869 HydrophobicContact CD1-CG2 3.89Å; L842-V869 HydrophobicContact CD2-CG1 4.01Å; L842-V869 HydrophobicContact CD2-CG2 3.96Å; L842-V869 HydrophobicContact CG-CG1 4.06Å; L842-V869 HydrophobicContact CG-CG2 3.94Å; Q844-V869 PolarHBondContact NE2-O 3.16Å; Q844-V869 PolarHBondContact OE1-O 2.92Å; A847-V869 HydrophobicContact CB-CB 4.22Å; A847-V869 HydrophobicContact CB-CG2 3.87Å
870	V	79.1	Confident	77.7	Confident	62 Å²	62	63.7 Å²	63.7	38%	0.376	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	111.4	176.8	180	0	0	0	0	108.7	V789 A790 E792	V789-V870 HydrophobicContact CG1-CG2 3.63Å; A790-V870 PolarHBondContact O-N 3.35Å; E792-V870 PolarHBondContact N-O 3.14Å
871	A	70.6	Confident	78.4	Confident	58 Å²	58	62.4 Å²	62.4	48%	0.479	34%	0.343	S	S	.	.			trans	-52.7	147.6	179.8	0	0	0	0	0	113.2	E792 E873	E792-A871 WeakPolarHBondContact OE2-CA 3.34Å; A871-E873 PolarHBondContact O-N 3.13Å
872	K	65.7	Low	79.1	Confident	138 Å²	138	64.7 Å²	64.7	60%	0.6	35%	0.352	S	S	*	.			trans	-85	113.2	-176	-177.8	177.6	177.3	-179	0	110.6	E792 V874	E792-K872 HydrophobicContact CB-CB 4.14Å; E792-K872 HydrophobicContact CG-CB 4.36Å; E792-K872 PolarHBondContact OE2-N 3.48Å; K872-V874 WeakPolarHBondContact O-CG2 3.5Å; K872-V874 PolarHBondContact O-N 3.25Å
873	E	61	Low	79.6	Confident	154 Å²	154	69.1 Å²	69.1	72%	0.72	37%	0.366	S	S	*	.			trans	-56.6	106.9	176.5	-67.6	-170.8	156.1	0	0	111.9	A871 K875	A871-E873 PolarHBondContact O-N 3.13Å; E873-K875 PolarHBondContact O-N 3.47Å
874	V	62.2	Low	80.1	Confident	91 Å²	91	68.4 Å²	68.4	55%	0.552	36%	0.363	S	S	*	.			trans	-79.2	89.5	179.8	-174.8	0	0	0	0	109.8	K872 K876	K872-V874 WeakPolarHBondContact O-CG2 3.5Å; K872-V874 PolarHBondContact O-N 3.25Å; V874-K876 HydrophobicContact CG1-CG 4.12Å; V874-K876 PolarHBondContact O-N 3.35Å
875	K	75	Confident	80.6	Confident	103 Å²	103	71.8 Å²	71.8	45%	0.448	37%	0.371	S	S	.	.			trans	-65.3	122.5	171.7	-58.4	170.7	-170.7	-87.9	0	109.2	E873 M904 E957 A958	E873-K875 PolarHBondContact O-N 3.47Å; K875-M904 CarbonylContact C-O 3.55Å; K875-M904 VanDerWaalsContact CA-O 3.29Å; K875-M904 WeakPolarHBondContact CA-O 3.33Å; K875-E957 HydrophobicContact CD-CG 4.38Å; K875-E957 WeakPolarHBondContact CD-OE1 3.3Å; K875-E957 WeakPolarHBondContact CG-OE1 3.27Å; K875-E957 IonicContact NZ-OE1 3.09Å; K875-E957 PolarHBondContact NZ-OE1 3.24Å; K875-E957 IonicContact NZ-OE2 2.63Å; K875-E957 PolarHBondContact NZ-OE2 3.19Å; K875-A958 HydrophobicContact CB-CB 4.13Å
876	K	72.4	Confident	80.7	Confident	112 Å²	112	76.6 Å²	76.6	49%	0.487	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.6	-179	-62.4	178.1	-173.7	168.3	0	109.5	V874 M904 N956	V874-K876 HydrophobicContact CG1-CG 4.12Å; V874-K876 PolarHBondContact O-N 3.35Å; K876-M904 HydrophobicContact CB-CB 4.05Å; K876-M904 HydrophobicContact CD-CG 4.27Å; K876-M904 HydrophobicContact CD-SD 3.76Å; K876-M904 HydrophobicContact CG-CB 4.3Å; K876-M904 HydrophobicContact CG-SD 4.37Å; K876-M904 PolarHBondContact N-O 3.48Å; K876-M904 PolarHBondContact O-N 3.43Å; K876-M904 VanDerWaalsContact O-O 3.12Å; K876-N956 PolarHBondContact O-ND2 2.99Å
877	A	76.4	Confident	81.1	Confident	46 Å²	46	74.6 Å²	74.6	38%	0.38	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	153.4	173.8	0	0	0	0	0	111	A958	A877-A958 HydrophobicContact CB-CB 4.38Å; A877-A958 WeakPolarHBondContact CB-O 3.3Å
878	P	88.3	Confident	81.3	Confident	3 Å²	3	76.7 Å²	76.7	2%	0.019	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	143.6	-177.5	-14.5	30.7	0	0	0	111	V901 I902 P907 A954 N956 G959 V961	P878-V901 HydrophobicContact CB-CG1 3.72Å; P878-I902 CarbonylContact C-O 3.57Å; P878-I902 WeakPolarHBondContact CA-O 3.22Å; P878-P907 HydrophobicContact CB-CB 3.98Å; P878-P907 HydrophobicContact CB-CG 4.33Å; P878-P907 HydrophobicContact CG-CB 3.97Å; P878-A954 HydrophobicContact CB-CB 4.45Å; P878-N956 WeakPolarHBondContact CD-OD1 3.35Å; P878-N956 HydrophobicContact CG-CB 4.38Å; P878-G959 VanDerWaalsContact CD-C 3.49Å; P878-G959 WeakPolarHBondContact CD-O 3.41Å; P878-V961 HydrophobicContact CB-CG2 3.98Å; P878-V961 WeakPolarHBondContact O-CG1 3.29Å
879	V	86.2	Confident	82	Confident	81 Å²	81	75.2 Å²	75.2	49%	0.491	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	123.9	-178	-179.5	0	0	0	0	109.7	L881 V901 I902	V879-L881 HydrophobicContact CG1-CD2 4.47Å; V879-L881 PolarHBondContact O-N 2.98Å; V879-V901 WeakPolarHBondContact O-CA 3.4Å; V879-V901 WeakPolarHBondContact O-CG1 3.33Å; V879-I902 HydrophobicContact CB-CG1 4.43Å; V879-I902 PolarHBondContact N-O 3.12Å; V879-I902 PolarHBondContact O-N 2.63Å; V879-I902 VanDerWaalsContact O-N 3.08Å
880	I	88.3	Confident	82.3	Confident	36 Å²	36	75.7 Å²	75.7	19%	0.185	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	113.3	178.6	-47.7	-175.5	0	0	0	108.7	K883 V901 V961 S962 C963	I880-K883 HydrophobicContact CG2-CG 3.89Å; I880-V901 HydrophobicContact CB-CG2 4.37Å; I880-V901 HydrophobicContact CG1-CG1 4.28Å; I880-V901 HydrophobicContact CG1-CG2 3.96Å; I880-V901 HydrophobicContact CG2-CG2 4.31Å; I880-V961 HydrophobicContact CD1-CB 4.13Å; I880-V961 HydrophobicContact CD1-CG2 3.91Å; I880-V961 HydrophobicContact CG1-CB 4.09Å; I880-V961 HydrophobicContact CG1-CG2 3.51Å; I880-S962 WeakPolarHBondContact CD1-O 3.48Å; I880-C963 HydrophobicContact CD1-CB 3.74Å
881	L	83.1	Confident	83	Confident	91 Å²	91	75.8 Å²	75.8	48%	0.476	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-46.8	176	-56.5	-178.1	0	0	0	110.8	V879 R900 I902	V879-L881 HydrophobicContact CG1-CD2 4.47Å; V879-L881 PolarHBondContact O-N 2.98Å; L881-R900 HydrophobicContact CB-CB 4.45Å; L881-R900 HydrophobicContact CD1-CG 4.44Å; L881-R900 PolarHBondContact N-O 3.14Å; L881-I902 HydrophobicContact CD1-CD1 4.13Å; L881-I902 HydrophobicContact CD1-CG1 4.09Å; L881-I902 HydrophobicContact CD1-CG2 3.77Å; L881-I902 HydrophobicContact CD2-CD1 4.07Å; L881-I902 HydrophobicContact CD2-CG1 4.14Å; L881-I902 HydrophobicContact CG-CD1 4.41Å; L881-I902 HydrophobicContact CG-CG1 4.12Å
882	E	87.1	Confident	83.9	Confident	93 Å²	93	75 Å²	75	44%	0.435	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	115	-175.8	-62.9	159.3	-143.5	0	0	106.9	C899 R900	E882-C899 WeakPolarHBondContact O-CA 3.38Å; E882-C899 PolarHBondContact O-SG 3.28Å; E882-R900 HydrophobicContact CB-CB 3.78Å; E882-R900 VanDerWaalsContact CD-CD 3.49Å; E882-R900 HydrophobicContact CG-CB 4.1Å; E882-R900 PolarHBondContact N-O 2.96Å; E882-R900 PolarHBondContact O-N 2.86Å; E882-R900 WeakPolarHBondContact OE1-CD 3.23Å; E882-R900 IonicContact OE1-CZ 3.29Å; E882-R900 IonicContact OE1-NE 3.58Å; E882-R900 IonicContact OE1-NH1 2.78Å; E882-R900 PolarHBondContact OE1-NH1 3.05Å
883	K	90.3	Very high	85.2	Confident	142 Å²	142	72.1 Å²	72.1	62%	0.617	39%	0.388	S	S	*	.			trans	-85.1	150.4	-176.5	-64.1	176.1	-177.6	175.7	0	111	I880 Q885	I880-K883 HydrophobicContact CG2-CG 3.89Å; K883-Q885 PolarHBondContact O-NE2 3.13Å
884	L	91.8	Very high	86.7	Confident	11 Å²	11	68 Å²	68	6%	0.058	38%	0.375	C	S	.	.			trans	-49.6	141.3	166.1	-62	173.4	0	0	0	111	L897 C899 W911 L952 A965	L884-L897 HydrophobicContact CD2-CB 4.24Å; L884-C899 HydrophobicContact CD2-CB 3.73Å; L884-C899 HydrophobicContact CG-CB 4.08Å; L884-W911 HydrophobicContact CD1-CZ3 4.11Å; L884-W911 HydrophobicContact CD2-CH2 3.49Å; L884-W911 VanDerWaalsContact CD2-CH2 3.49Å; L884-W911 HydrophobicContact CD2-CZ3 3.73Å; L884-L952 HydrophobicContact CD1-CB 3.94Å; L884-A965 HydrophobicContact CB-CB 3.58Å
885	Q	90.9	Very high	88.1	Confident	139 Å²	139	63.8 Å²	63.8	65%	0.65	35%	0.349	S	S	*	.			trans	-112.2	146.5	177.5	-59.3	-57.5	-39.2	0	0	110.7	K883 A965	K883-Q885 PolarHBondContact O-NE2 3.13Å; Q885-A965 WeakPolarHBondContact O-CB 3.33Å
886	N	91.8	Very high	89	Confident	104 Å²	104	66.1 Å²	66.1	56%	0.556	36%	0.355	S	S	*	.			trans	-67.7	138.1	171.1	-63.8	-16.7	0	0	0	109.4	A965 R966	N886-A965 WeakPolarHBondContact OD1-CA 3.37Å; N886-R966 CarbonylContact C-O 3.44Å; N886-R966 VanDerWaalsContact CA-O 3.27Å; N886-R966 WeakPolarHBondContact CA-O 3.45Å; N886-R966 PolarHBondContact OD1-N 2.96Å
887	C	90.3	Very high	89.9	Confident	38 Å²	38	61 Å²	61	26%	0.257	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	150.1	179.2	66.2	0	0	0	0	113.4	R966 L967 D968	C887-R966 PolarHBondContact N-O 3.19Å; C887-L967 WeakPolarHBondContact O-CA 3.09Å; C887-D968 PolarHBondContact O-N 3.12Å
888	G	91.8	Very high	90.7	Very high	44 Å²	44	62.4 Å²	62.4	45%	0.454	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.3	174.3	0	0	0	0	0	110.4	D968	G888-D968 CarbonylContact C-O 3.56Å; G888-D968 VanDerWaalsContact CA-O 3.29Å; G888-D968 WeakPolarHBondContact CA-O 3.5Å
889	V	93.1	Very high	90.7	Very high	20 Å²	20	62.4 Å²	62.4	12%	0.121	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.9	-174.3	178.4	0	0	0	0	110.5	H893 V895 L967 D968 I969 Y970	V889-H893 HydrophobicContact CG1-CB 3.77Å; V889-V895 HydrophobicContact CB-CG2 3.8Å; V889-V895 HydrophobicContact CG1-CG2 3.79Å; V889-V895 HydrophobicContact CG2-CG2 3.85Å; V889-L967 HydrophobicContact CG2-CD1 4.42Å; V889-D968 PolarHBondContact N-O 2.86Å; V889-I969 HydrophobicContact CB-CD1 4.12Å; V889-I969 WeakPolarHBondContact O-CA 3.45Å; V889-Y970 PolarHBondContact O-N 2.67Å
890	P	92.5	Very high	90.8	Very high	24 Å²	24	62.7 Å²	62.7	16%	0.156	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	148.4	176.6	0.5	11.1	0	0	0	111.1	H893 Y970	P890-H893 HydrophobicContact CG-CB 4.39Å; P890-H893 WeakPolarHBondContact O-CB 3.47Å; P890-H893 PolarHBondContact O-N 2.95Å; P890-H893 VanDerWaalsContact O-N 3.15Å; P890-Y970 CarbonylContact C-O 3.57Å; P890-Y970 WeakPolarHBondContact CA-O 3.34Å; P890-Y970 HydrophobicContact CB-CD2 3.98Å; P890-Y970 HydrophobicContact CB-CE2 3.55Å; P890-Y970 WeakPolarHBondContact CD-OH 3.32Å; P890-Y970 HydrophobicContact CG-CD2 4.47Å; P890-Y970 HydrophobicContact CG-CE2 3.57Å
891	E	94.3	Very high	90.7	Very high	63 Å²	63	61.1 Å²	61.1	29%	0.294	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	143.9	171.7	-171	160.7	-134.6	0	0	111.3	H893 K944 I969 Y970	E891-H893 VanDerWaalsContact C-N 3.26Å; E891-H893 PolarHBondContact O-N 2.82Å; E891-H893 PolarHBondContact O-ND1 2.91Å; E891-H893 VanDerWaalsContact O-ND1 3.12Å; E891-K944 WeakPolarHBondContact OE1-CG 3.44Å; E891-K944 PolarHBondContact OE1-N 2.72Å; E891-K944 WeakPolarHBondContact OE2-CE 3.23Å; E891-K944 IonicContact OE2-NZ 3.87Å; E891-I969 HydrophobicContact CB-CG2 4.1Å; E891-Y970 PolarHBondContact N-O 2.69Å
892	G	90.1	Very high	90.8	Very high	43 Å²	43	60.5 Å²	60.5	44%	0.443	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	-23.1	-174.4	0	0	0	0	0	115.6	P941 A942	G892-P941 WeakPolarHBondContact O-CB 3.43Å; G892-A942 PolarHBondContact N-O 3.47Å
893	H	92.1	Very high	90.3	Very high	77 Å²	77	56.9 Å²	56.9	36%	0.356	30%	0.3	S	S	.	.	S	Bend	trans	-83.3	161.4	-174.9	-67.1	63.7	0	0	0	112.2	V889 P890 E891 A942	V889-H893 HydrophobicContact CG1-CB 3.77Å; P890-H893 HydrophobicContact CG-CB 4.39Å; P890-H893 WeakPolarHBondContact O-CB 3.47Å; P890-H893 PolarHBondContact O-N 2.95Å; P890-H893 VanDerWaalsContact O-N 3.15Å; E891-H893 VanDerWaalsContact C-N 3.26Å; E891-H893 PolarHBondContact O-N 2.82Å; E891-H893 PolarHBondContact O-ND1 2.91Å; E891-H893 VanDerWaalsContact O-ND1 3.12Å; H893-A942 WeakPolarHBondContact O-CB 3.49Å; H893-A942 PolarHBondContact O-N 3.13Å
894	P	92.2	Very high	89.5	Confident	68 Å²	68	54.5 Å²	54.5	44%	0.442	29%	0.292	S	S	.	.			trans	-75.9	137.9	173.4	29.9	-34	0	0	0	112.1	L938 I939 Q940	P894-L938 HydrophobicContact CB-CD1 4.22Å; P894-I939 CarbonylContact C-O 3.58Å; P894-I939 WeakPolarHBondContact CA-O 3.35Å; P894-Q940 HydrophobicContact CB-CB 4.06Å; P894-Q940 HydrophobicContact CB-CG 3.98Å
895	V	93.3	Very high	89	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.6	168.7	-179.9	0	0	0	0	108.8	V889 L897 L938 I939 A942 L967 I969	V889-V895 HydrophobicContact CB-CG2 3.8Å; V889-V895 HydrophobicContact CG1-CG2 3.79Å; V889-V895 HydrophobicContact CG2-CG2 3.85Å; V895-L897 HydrophobicContact CG1-CD2 4.38Å; V895-L897 HydrophobicContact CG1-CG 4.1Å; V895-L938 WeakPolarHBondContact O-CA 3.35Å; V895-L938 WeakPolarHBondContact O-CD1 3.45Å; V895-I939 HydrophobicContact CB-CB 4.2Å; V895-I939 PolarHBondContact N-O 2.83Å; V895-I939 PolarHBondContact O-N 2.67Å; V895-A942 HydrophobicContact CG2-CB 3.8Å; V895-L967 HydrophobicContact CB-CD1 4.48Å; V895-L967 HydrophobicContact CG1-CD1 3.71Å; V895-L967 HydrophobicContact CG1-CD2 3.96Å; V895-L967 HydrophobicContact CG1-CG 4.49Å; V895-L967 HydrophobicContact CG2-CD1 3.88Å; V895-L967 HydrophobicContact CG2-CD2 4.11Å; V895-I969 HydrophobicContact CG2-CD1 4.12Å
896	R	92.9	Very high	88.6	Confident	153 Å²	153	54.7 Å²	54.7	58%	0.577	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.1	168.7	-69.9	170.7	60.8	148.5	-3.4	108.6	E898 Y934 L938	R896-E898 HydrophobicContact CB-CG 4.31Å; R896-E898 IonicContact CZ-OE1 2.68Å; R896-E898 IonicContact NE-OE1 3.61Å; R896-E898 PolarHBondContact NE-OE1 3.41Å; R896-E898 IonicContact NH2-OE1 2.67Å; R896-E898 PolarHBondContact NH2-OE1 3.47Å; R896-Y934 PolarHBondContact NH2-OH 2.85Å; R896-L938 HydrophobicContact CG-CD1 3.83Å
897	L	92.6	Very high	88.3	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.6	171.8	-65.8	176.4	0	0	0	107.8	L884 V895 W911 C936 L937 Y950	L884-L897 HydrophobicContact CD2-CB 4.24Å; V895-L897 HydrophobicContact CG1-CD2 4.38Å; V895-L897 HydrophobicContact CG1-CG 4.1Å; L897-W911 HydrophobicContact CB-CH2 4.02Å; L897-W911 HydrophobicContact CB-CZ3 4.02Å; L897-W911 VanDerWaalsContact O-CH2 3.28Å; L897-W911 WeakPolarHBondContact O-CH2 3.47Å; L897-C936 CarbonylContact O-C 3.59Å; L897-C936 VanDerWaalsContact O-CA 3.31Å; L897-C936 WeakPolarHBondContact O-CA 3.49Å; L897-L937 HydrophobicContact CB-CB 4.36Å; L897-L937 HydrophobicContact CD1-CD2 4.48Å; L897-L937 PolarHBondContact N-O 2.83Å; L897-L937 PolarHBondContact O-N 3.36Å; L897-Y950 HydrophobicContact CD1-CD1 3.71Å; L897-Y950 HydrophobicContact CD1-CD2 3.78Å; L897-Y950 HydrophobicContact CD1-CE1 4.34Å; L897-Y950 HydrophobicContact CD1-CE2 4.41Å; L897-Y950 HydrophobicContact CD1-CG 3.38Å
898	E	92.1	Very high	88.1	Confident	76 Å²	76	52.1 Å²	52.1	36%	0.355	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.6	-166.1	-63	-179.8	178.4	0	0	111.4	R896 Y934 C936	R896-E898 HydrophobicContact CB-CG 4.31Å; R896-E898 IonicContact CZ-OE1 2.68Å; R896-E898 IonicContact NE-OE1 3.61Å; R896-E898 PolarHBondContact NE-OE1 3.41Å; R896-E898 IonicContact NH2-OE1 2.67Å; R896-E898 PolarHBondContact NH2-OE1 3.47Å; E898-Y934 HydrophobicContact CB-CE2 4.28Å; E898-Y934 VanDerWaalsContact CD-OH 3.24Å; E898-Y934 HydrophobicContact CG-CE2 4.27Å; E898-Y934 PolarHBondContact OE1-OH 2.9Å; E898-Y934 VanDerWaalsContact OE1-OH 3.13Å; E898-C936 HydrophobicContact CG-CB 4.09Å
899	C	88.2	Confident	88	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	155	-177.8	179.5	0	0	0	0	109.4	E882 L884 A935 L952	E882-C899 WeakPolarHBondContact O-CA 3.38Å; E882-C899 PolarHBondContact O-SG 3.28Å; L884-C899 HydrophobicContact CD2-CB 3.73Å; L884-C899 HydrophobicContact CG-CB 4.08Å; C899-A935 PolarHBondContact N-O 3.13Å; C899-A935 PolarHBondContact O-N 2.94Å; C899-L952 HydrophobicContact CB-CD2 3.57Å
900	R	87.9	Confident	87.7	Confident	88 Å²	88	55.3 Å²	55.3	33%	0.332	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.8	178.3	-162.7	-179.5	-170.5	171.4	6.9	111.1	L881 E882 G933	L881-R900 HydrophobicContact CB-CB 4.45Å; L881-R900 HydrophobicContact CD1-CG 4.44Å; L881-R900 PolarHBondContact N-O 3.14Å; E882-R900 HydrophobicContact CB-CB 3.78Å; E882-R900 VanDerWaalsContact CD-CD 3.49Å; E882-R900 HydrophobicContact CG-CB 4.1Å; E882-R900 PolarHBondContact N-O 2.96Å; E882-R900 PolarHBondContact O-N 2.86Å; E882-R900 WeakPolarHBondContact OE1-CD 3.23Å; E882-R900 IonicContact OE1-CZ 3.29Å; E882-R900 IonicContact OE1-NE 3.58Å; E882-R900 IonicContact OE1-NH1 2.78Å; E882-R900 PolarHBondContact OE1-NH1 3.05Å; R900-G933 CarbonylContact C-O 3.52Å; R900-G933 WeakPolarHBondContact CA-O 3.4Å
901	V	87.4	Confident	87.6	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	118.2	-178.7	-165.7	0	0	0	0	110.3	P878 V879 I880 P907 F909 G933 A954 V961	P878-V901 HydrophobicContact CB-CG1 3.72Å; V879-V901 WeakPolarHBondContact O-CA 3.4Å; V879-V901 WeakPolarHBondContact O-CG1 3.33Å; I880-V901 HydrophobicContact CB-CG2 4.37Å; I880-V901 HydrophobicContact CG1-CG1 4.28Å; I880-V901 HydrophobicContact CG1-CG2 3.96Å; I880-V901 HydrophobicContact CG2-CG2 4.31Å; V901-P907 HydrophobicContact CG1-CG 4.41Å; V901-F909 HydrophobicContact CB-CE1 3.79Å; V901-F909 HydrophobicContact CB-CZ 4.12Å; V901-F909 HydrophobicContact CG2-CE1 3.82Å; V901-G933 PolarHBondContact N-O 2.73Å; V901-G933 WeakPolarHBondContact O-CA 3.33Å; V901-A954 HydrophobicContact CB-CB 4.03Å; V901-A954 HydrophobicContact CG1-CB 3.74Å; V901-A954 HydrophobicContact CG2-CB 4.06Å; V901-V961 HydrophobicContact CG1-CG2 3.9Å
902	I	84.3	Confident	87.4	Confident	79 Å²	79	54.7 Å²	54.7	41%	0.405	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	155.6	174.6	59.2	167.1	0	0	0	110.7	P878 V879 L881	P878-I902 CarbonylContact C-O 3.57Å; P878-I902 WeakPolarHBondContact CA-O 3.22Å; V879-I902 HydrophobicContact CB-CG1 4.43Å; V879-I902 PolarHBondContact N-O 3.12Å; V879-I902 PolarHBondContact O-N 2.63Å; V879-I902 VanDerWaalsContact O-N 3.08Å; L881-I902 HydrophobicContact CD1-CD1 4.13Å; L881-I902 HydrophobicContact CD1-CG1 4.09Å; L881-I902 HydrophobicContact CD1-CG2 3.77Å; L881-I902 HydrophobicContact CD2-CD1 4.07Å; L881-I902 HydrophobicContact CD2-CG1 4.14Å; L881-I902 HydrophobicContact CG-CD1 4.41Å; L881-I902 HydrophobicContact CG-CG1 4.12Å
903	G	76.7	Confident	87.5	Confident	17 Å²	17	54.8 Å²	54.8	18%	0.175	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	164.1	176.1	0	0	0	0	0	111.4	P905	G903-P905 CarbonylContact C-O 3.59Å; G903-P905 CarbonylContact O-C 3.51Å
904	M	74.5	Confident	87.3	Confident	92 Å²	92	54.9 Å²	54.9	45%	0.453	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	115.6	174.4	-65.9	-178.8	67.3	0	0	110	K875 K876 N956	K875-M904 CarbonylContact C-O 3.55Å; K875-M904 VanDerWaalsContact CA-O 3.29Å; K875-M904 WeakPolarHBondContact CA-O 3.33Å; K876-M904 HydrophobicContact CB-CB 4.05Å; K876-M904 HydrophobicContact CD-CG 4.27Å; K876-M904 HydrophobicContact CD-SD 3.76Å; K876-M904 HydrophobicContact CG-CB 4.3Å; K876-M904 HydrophobicContact CG-SD 4.37Å; K876-M904 PolarHBondContact N-O 3.48Å; K876-M904 PolarHBondContact O-N 3.43Å; K876-M904 VanDerWaalsContact O-O 3.12Å; M904-N956 PolarHBondContact N-ND2 3.12Å; M904-N956 PolarHBondContact O-ND2 3.2Å
905	P	81.3	Confident	86.8	Confident	56 Å²	56	57.3 Å²	57.3	36%	0.364	29%	0.285	S	S	.	.	S	Bend	cis	-57.9	165	-10	-22.5	34.6	0	0	0	113.2	G903 N956 E957	G903-P905 CarbonylContact C-O 3.59Å; G903-P905 CarbonylContact O-C 3.51Å; P905-N956 WeakPolarHBondContact O-CB 3.48Å; P905-N956 PolarHBondContact O-ND2 2.78Å; P905-E957 WeakPolarHBondContact CD-OE1 3.35Å; P905-E957 HydrophobicContact CG-CG 4.24Å; P905-E957 WeakPolarHBondContact CG-OE1 3.36Å
906	P	81.3	Confident	86.4	Confident	98 Å²	98	64.7 Å²	64.7	64%	0.636	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-52.3	135.4	177.1	-27.5	35.9	0	0	0	112.2
907	P	85.5	Confident	85.9	Confident	11 Å²	11	62.5 Å²	62.5	7%	0.071	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-76.8	148.5	-173.3	30.7	-35	0	0	0	113.1	P878 V901 F909 A954 K955	P878-P907 HydrophobicContact CB-CB 3.98Å; P878-P907 HydrophobicContact CB-CG 4.33Å; P878-P907 HydrophobicContact CG-CB 3.97Å; V901-P907 HydrophobicContact CG1-CG 4.41Å; P907-F909 HydrophobicContact CG-CZ 4.18Å; P907-A954 HydrophobicContact CB-CB 4.14Å; P907-K955 CarbonylContact C-O 3.57Å; P907-K955 WeakPolarHBondContact CA-O 3.49Å
908	V	85.7	Confident	85.4	Confident	76 Å²	76	63.4 Å²	63.4	46%	0.461	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	133.5	168.3	-177.9	0	0	0	0	109.2	Y910 A954 K955	V908-Y910 HydrophobicContact CB-CE2 4.12Å; V908-Y910 HydrophobicContact CG1-CE1 4.4Å; V908-Y910 HydrophobicContact CG1-CE2 3.9Å; V908-Y910 WeakPolarHBondContact O-CE2 3.07Å; V908-A954 WeakPolarHBondContact O-CA 3.41Å; V908-K955 PolarHBondContact N-O 2.87Å; V908-K955 PolarHBondContact O-N 2Å
909	F	89.4	Confident	83.9	Confident	12 Å²	12	64.2 Å²	64.2	5%	0.053	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	142.3	-176.8	-66.7	-76	0	0	0	112.8	V901 P907 Q929 A935 L952 S953 A954	V901-F909 HydrophobicContact CB-CE1 3.79Å; V901-F909 HydrophobicContact CB-CZ 4.12Å; V901-F909 HydrophobicContact CG2-CE1 3.82Å; P907-F909 HydrophobicContact CG-CZ 4.18Å; F909-Q929 HydrophobicContact CD2-CB 4.03Å; F909-Q929 HydrophobicContact CE2-CB 4.33Å; F909-A935 HydrophobicContact CD1-CB 3.73Å; F909-A935 HydrophobicContact CD2-CB 4.12Å; F909-A935 HydrophobicContact CE1-CB 3.67Å; F909-A935 HydrophobicContact CE2-CB 4.08Å; F909-A935 HydrophobicContact CG-CB 3.95Å; F909-A935 HydrophobicContact CZ-CB 3.86Å; F909-L952 HydrophobicContact CB-CD1 3.98Å; F909-L952 HydrophobicContact CD1-CD1 3.79Å; F909-L952 HydrophobicContact CD1-CD2 3.98Å; F909-L952 HydrophobicContact CD1-CG 4.16Å; F909-L952 HydrophobicContact CE1-CD2 4.27Å; F909-L952 HydrophobicContact CG-CD1 4.34Å; F909-S953 CarbonylContact C-O 3.55Å; F909-S953 WeakPolarHBondContact CA-O 2.82Å; F909-A954 HydrophobicContact CD1-CB 3.85Å; F909-A954 HydrophobicContact CE1-CB 3.82Å
910	Y	88.1	Confident	82.1	Confident	119 Å²	119	69.8 Å²	69.8	47%	0.467	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	126.3	177.8	-55.2	-91.4	0	0	0	109.7	V908 L952 S953 K955	V908-Y910 HydrophobicContact CB-CE2 4.12Å; V908-Y910 HydrophobicContact CG1-CE1 4.4Å; V908-Y910 HydrophobicContact CG1-CE2 3.9Å; V908-Y910 WeakPolarHBondContact O-CE2 3.07Å; Y910-L952 WeakPolarHBondContact O-CD1 3.49Å; Y910-S953 PolarHBondContact N-O 2.87Å; Y910-S953 PolarHBondContact O-N 2.88Å; Y910-K955 HydrophobicContact CE2-CB 4.1Å
911	W	90	Very high	80.5	Confident	11 Å²	11	70 Å²	70	4%	0.042	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.3	177.9	-69.3	84.8	0	0	0	112.2	L884 L897 I918 M927 L937 T951 L952	L884-W911 HydrophobicContact CD1-CZ3 4.11Å; L884-W911 HydrophobicContact CD2-CH2 3.49Å; L884-W911 VanDerWaalsContact CD2-CH2 3.49Å; L884-W911 HydrophobicContact CD2-CZ3 3.73Å; L897-W911 HydrophobicContact CB-CH2 4.02Å; L897-W911 HydrophobicContact CB-CZ3 4.02Å; L897-W911 VanDerWaalsContact O-CH2 3.28Å; L897-W911 WeakPolarHBondContact O-CH2 3.47Å; W911-I918 HydrophobicContact CB-CD1 3.95Å; W911-I918 HydrophobicContact CB-CG1 4.41Å; W911-I918 PolarHBondContact O-N 3.28Å; W911-M927 HydrophobicContact CB-SD 4.35Å; W911-M927 HydrophobicContact CG-SD 4.27Å; W911-L937 HydrophobicContact CD2-CB 3.89Å; W911-L937 HydrophobicContact CD2-CD2 4.26Å; W911-L937 HydrophobicContact CD2-CG 4.46Å; W911-L937 HydrophobicContact CE3-CB 3.87Å; W911-L937 HydrophobicContact CE3-CD2 3.89Å; W911-L937 HydrophobicContact CE3-CG 4.43Å; W911-L937 HydrophobicContact CG-CD1 4.46Å; W911-L937 HydrophobicContact CH2-CB 3.71Å; W911-L937 HydrophobicContact CZ2-CB 3.76Å; W911-L937 HydrophobicContact CZ3-CB 3.78Å; W911-L937 HydrophobicContact CZ3-CD2 4.3Å; W911-T951 WeakPolarHBondContact CA-O 3.36Å; W911-L952 HydrophobicContact CD2-CB 4.28Å; W911-L952 HydrophobicContact CD2-CD1 3.87Å; W911-L952 HydrophobicContact CE3-CB 4.14Å; W911-L952 HydrophobicContact CG-CD1 4.04Å; W911-L952 HydrophobicContact CH2-CB 4.31Å; W911-L952 HydrophobicContact CH2-CD2 4.28Å; W911-L952 HydrophobicContact CZ2-CB 4.4Å; W911-L952 HydrophobicContact CZ2-CD1 4.11Å; W911-L952 HydrophobicContact CZ2-CD2 3.89Å; W911-L952 HydrophobicContact CZ2-CG 4.36Å; W911-L952 HydrophobicContact CZ3-CB 4.16Å
912	K	89.8	Confident	78.9	Confident	63 Å²	63	80 Å²	80	27%	0.274	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.2	172.4	-73.6	175	163	-122.7	0	110.7	N915 E916 T917 Y950 T951	K912-N915 WeakPolarHBondContact CD-O 3.36Å; K912-N915 WeakPolarHBondContact CE-O 3.37Å; K912-N915 PolarHBondContact NZ-O 3.27Å; K912-N915 PolarHBondContact NZ-OD1 3.37Å; K912-E916 CarbonylContact C-O 3.57Å; K912-E916 WeakPolarHBondContact CA-O 3.27Å; K912-E916 VanDerWaalsContact CB-O 3.24Å; K912-E916 WeakPolarHBondContact CB-O 3.36Å; K912-T917 HydrophobicContact CG-CG2 4.34Å; K912-Y950 WeakPolarHBondContact O-CA 3.38Å; K912-T951 PolarHBondContact N-O 2.9Å; K912-T951 PolarHBondContact O-N 2.93Å
913	K	92.6	Very high	78	Confident	45 Å²	45	85.7 Å²	85.7	20%	0.196	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.2	164.7	-175.3	-170.7	-171	-73.5	0	107.8	N915 E916 I918 S945 D946 A947 W949 Y950	K913-N915 PolarHBondContact O-N 3.38Å; K913-N915 VanDerWaalsContact O-N 3.12Å; K913-E916 PolarHBondContact N-O 3.24Å; K913-E916 PolarHBondContact O-N 3.08Å; K913-I918 HydrophobicContact CB-CD1 4.21Å; K913-I918 HydrophobicContact CB-CG1 4.01Å; K913-S945 WeakPolarHBondContact CE-O 3.45Å; K913-S945 PolarHBondContact NZ-O 3.39Å; K913-D946 VanDerWaalsContact CE-C 3.47Å; K913-D946 WeakPolarHBondContact CE-O 3.26Å; K913-A947 PolarHBondContact NZ-O 2.86Å; K913-W949 CarbonylContact C-O 3.52Å; K913-W949 WeakPolarHBondContact CA-O 3.42Å; K913-Y950 HydrophobicContact CB-CD1 4.35Å; K913-Y950 HydrophobicContact CB-CE1 4.02Å; K913-Y950 HydrophobicContact CD-CE1 4.32Å; K913-Y950 HydrophobicContact CD-CE2 4.27Å; K913-Y950 WeakPolarHBondContact CD-OH 3.16Å; K913-Y950 WeakPolarHBondContact CE-OH 3.49Å; K913-Y950 HydrophobicContact CG-CE1 4.06Å; K913-Y950 HydrophobicContact CG-CE2 4Å
914	D	88.7	Confident	78.4	Confident	80 Å²	80	87.4 Å²	87.4	43%	0.428	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	39.8	-179.9	-55.6	-50	0	0	0	112.9	E916 G948 W949	D914-E916 PolarHBondContact O-N 2.78Å; D914-G948 WeakPolarHBondContact OD1-CA 3.49Å; D914-W949 PolarHBondContact N-O 2.86Å; D914-W949 PolarHBondContact OD1-N 3.12Å
915	N	81.1	Confident	79	Confident	119 Å²	119	85.7 Å²	85.7	64%	0.636	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	-7.9	-173.2	-161.9	24.1	0	0	0	116.5	K912 K913	K912-N915 WeakPolarHBondContact CD-O 3.36Å; K912-N915 WeakPolarHBondContact CE-O 3.37Å; K912-N915 PolarHBondContact NZ-O 3.27Å; K912-N915 PolarHBondContact NZ-OD1 3.37Å; K913-N915 PolarHBondContact O-N 3.38Å; K913-N915 VanDerWaalsContact O-N 3.12Å
916	E	84.4	Confident	79.2	Confident	155 Å²	155	85 Å²	85	72%	0.724	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	145	168.9	-60.5	-165.3	156.1	0	0	111.2	K912 K913 D914 I918	K912-E916 CarbonylContact C-O 3.57Å; K912-E916 WeakPolarHBondContact CA-O 3.27Å; K912-E916 VanDerWaalsContact CB-O 3.24Å; K912-E916 WeakPolarHBondContact CB-O 3.36Å; K913-E916 PolarHBondContact N-O 3.24Å; K913-E916 PolarHBondContact O-N 3.08Å; D914-E916 PolarHBondContact O-N 2.78Å; E916-I918 PolarHBondContact O-N 3.4Å
917	T	81.8	Confident	79.5	Confident	107 Å²	107	84 Å²	84	66%	0.656	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	128.2	174.9	46.9	0	0	0	0	110.3	K912 P919	K912-T917 HydrophobicContact CG-CG2 4.34Å; T917-P919 WeakPolarHBondContact O-CD 3.25Å
918	I	81.9	Confident	79.4	Confident	24 Å²	24	88.8 Å²	88.8	12%	0.123	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-66.9	119.1	176.8	-54.7	-176.9	0	0	0	108.1	W911 K913 E916 I925 L937 Y950	W911-I918 HydrophobicContact CB-CD1 3.95Å; W911-I918 HydrophobicContact CB-CG1 4.41Å; W911-I918 PolarHBondContact O-N 3.28Å; K913-I918 HydrophobicContact CB-CD1 4.21Å; K913-I918 HydrophobicContact CB-CG1 4.01Å; E916-I918 PolarHBondContact O-N 3.4Å; I918-I925 HydrophobicContact CG2-CD1 4.46Å; I918-I925 HydrophobicContact CG2-CG2 4.43Å; I918-L937 HydrophobicContact CD1-CD1 4.42Å; I918-L937 HydrophobicContact CD1-CD2 3.55Å; I918-Y950 HydrophobicContact CD1-CD1 3.9Å; I918-Y950 HydrophobicContact CD1-CE1 3.73Å
919	P	62.5	Low	79.3	Confident	92 Å²	92	90.5 Å²	90.5	60%	0.597	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-70.7	134	179.8	28.5	-33.6	0	0	0	110	T917 T921	T917-P919 WeakPolarHBondContact O-CD 3.25Å; P919-T921 PolarHBondContact O-N 3.15Å
920	C	50.2	Low	78.7	Confident	120 Å²	120	93.4 Å²	93.4	81%	0.811	47%	0.468	S	S	*	.	S	Bend	trans	-73.1	52.4	-179.1	-60	0	0	0	0	113.1
921	T	53.4	Low	77.8	Confident	92 Å²	92	94.4 Å²	94.4	56%	0.564	49%	0.487	S	S	*	.			trans	-140.6	137	-174.3	57.2	0	0	0	0	113.2	P919	P919-T921 PolarHBondContact O-N 3.15Å
922	R	53.2	Low	77	Confident	211 Å²	211	97.2 Å²	97.2	80%	0.796	51%	0.505	S	S	*	.	S	Bend	trans	90.1	143.2	171.5	-55.6	170.8	178.6	141.1	1.3	115.8	R924	R922-R924 PolarHBondContact O-N 3.03Å
923	E	66.6	Low	76.3	Confident	199 Å²	199	94.5 Å²	94.5	93%	0.93	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	9.4	-158.5	-51.5	105.4	148.8	0	0	116.5
924	R	84.9	Confident	76	Confident	53 Å²	53	95.1 Å²	95.1	20%	0.2	50%	0.497	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-17.4	-167.4	-160.8	-173.1	66.4	90.3	2.3	113.8	R922 I939 Q940 P941 D946	R922-R924 PolarHBondContact O-N 3.03Å; R924-I939 WeakPolarHBondContact O-CA 3.47Å; R924-Q940 WeakPolarHBondContact CA-O 3.34Å; R924-Q940 WeakPolarHBondContact CG-O 3.35Å; R924-Q940 PolarHBondContact O-N 3.42Å; R924-P941 WeakPolarHBondContact CD-O 3.47Å; R924-P941 PolarHBondContact NH1-O 3.1Å; R924-D946 IonicContact CZ-OD1 3.4Å; R924-D946 IonicContact CZ-OD2 2.67Å; R924-D946 IonicContact NH1-OD1 3.68Å; R924-D946 PolarHBondContact NH1-OD1 2.94Å; R924-D946 IonicContact NH1-OD2 2.69Å; R924-D946 PolarHBondContact NH1-OD2 2.79Å; R924-D946 IonicContact NH2-OD1 3.49Å; R924-D946 PolarHBondContact NH2-OD1 2.9Å; R924-D946 IonicContact NH2-OD2 3.55Å
925	I	87.1	Confident	76.1	Confident	57 Å²	57	91.3 Å²	91.3	29%	0.292	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.9	178.2	-57.6	-178.6	0	0	0	107.4	I918 L937 L938 I939	I918-I925 HydrophobicContact CG2-CD1 4.46Å; I918-I925 HydrophobicContact CG2-CG2 4.43Å; I925-L937 HydrophobicContact CG2-CD1 3.58Å; I925-L937 HydrophobicContact CG2-CG 4.29Å; I925-L938 WeakPolarHBondContact CA-O 3.43Å; I925-I939 HydrophobicContact CG1-CG1 4.29Å; I925-I939 HydrophobicContact CG1-CG2 4.22Å; I925-I939 HydrophobicContact CG2-CG1 4.43Å
926	S	85.6	Confident	76.6	Confident	40 Å²	40	85.9 Å²	85.9	28%	0.28	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140.7	176.1	55.7	0	0	0	0	110.9	H928 L938	S926-H928 WeakPolarHBondContact CB-NE2 3.33Å; S926-H928 PolarHBondContact OG-NE2 3.34Å; S926-L938 PolarHBondContact N-O 2.68Å; S926-L938 PolarHBondContact O-N 2.83Å
927	M	87.7	Confident	77	Confident	77 Å²	77	78.5 Å²	78.5	38%	0.379	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.5	174.8	-76.8	168.5	39.6	0	0	108.4	W911 C936 L937	W911-M927 HydrophobicContact CB-SD 4.35Å; W911-M927 HydrophobicContact CG-SD 4.27Å; M927-C936 WeakPolarHBondContact CA-O 3.48Å; M927-L937 HydrophobicContact CG-CD1 3.51Å; M927-L937 HydrophobicContact SD-CD1 4.44Å
928	H	83.9	Confident	77.4	Confident	112 Å²	112	75.1 Å²	75.1	52%	0.519	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135	176.7	-57.2	-85.5	0	0	0	108.4	S926 A935 C936 L938	S926-H928 WeakPolarHBondContact CB-NE2 3.33Å; S926-H928 PolarHBondContact OG-NE2 3.34Å; H928-A935 WeakPolarHBondContact O-CA 3.28Å; H928-C936 HydrophobicContact CB-CB 4.37Å; H928-C936 PolarHBondContact N-O 2.94Å; H928-C936 PolarHBondContact O-N 2.82Å; H928-L938 WeakPolarHBondContact NE2-CD2 3.42Å
929	Q	83.4	Confident	77.9	Confident	113 Å²	113	74 Å²	74	53%	0.528	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	150.7	175.8	58.7	175.7	60.8	0	0	110	F909 Y934	F909-Q929 HydrophobicContact CD2-CB 4.03Å; F909-Q929 HydrophobicContact CE2-CB 4.33Å; Q929-Y934 VanDerWaalsContact CA-O 3.23Å; Q929-Y934 WeakPolarHBondContact CA-O 3.36Å
930	D	76.7	Confident	79.3	Confident	72 Å²	72	74.7 Å²	74.7	39%	0.385	38%	0.38	S	S	.	.			trans	-130.8	175.8	179	77.2	14.7	0	0	0	113.6	T932 G933 Y934	D930-T932 PolarHBondContact O-N 2.82Å; D930-T932 VanDerWaalsContact OD1-CA 3.27Å; D930-T932 WeakPolarHBondContact OD1-CA 3.47Å; D930-T932 WeakPolarHBondContact OD1-CB 3.14Å; D930-T932 PolarHBondContact OD1-N 2.77Å; D930-T932 PolarHBondContact OD1-OG1 3.18Å; D930-T932 PolarHBondContact OD2-OG1 3Å; D930-G933 PolarHBondContact O-N 2.91Å; D930-G933 PolarHBondContact OD1-N 2.92Å; D930-G933 VanDerWaalsContact OD1-N 3.12Å; D930-Y934 PolarHBondContact N-O 2.87Å; D930-Y934 VanDerWaalsContact N-O 3.14Å; D930-Y934 PolarHBondContact OD1-N 2.95Å
931	T	68.7	Low	81.3	Confident	140 Å²	140	72 Å²	72	86%	0.859	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-7.2	178.5	50.5	0	0	0	0	114	G933	T931-G933 VanDerWaalsContact C-N 3.34Å
932	T	72.9	Confident	83.1	Confident	70 Å²	70	67.8 Å²	67.8	43%	0.429	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-5.8	174.6	86.1	0	0	0	0	112.6	D930	D930-T932 PolarHBondContact O-N 2.82Å; D930-T932 VanDerWaalsContact OD1-CA 3.27Å; D930-T932 WeakPolarHBondContact OD1-CA 3.47Å; D930-T932 WeakPolarHBondContact OD1-CB 3.14Å; D930-T932 PolarHBondContact OD1-N 2.77Å; D930-T932 PolarHBondContact OD1-OG1 3.18Å; D930-T932 PolarHBondContact OD2-OG1 3Å
933	G	75.8	Confident	85	Confident	6 Å²	6	62.6 Å²	62.6	6%	0.062	32%	0.319	C	S	.	.	S	Bend	trans	89.8	10.4	-178	0	0	0	0	0	114.1	R900 V901 D930 T931	R900-G933 CarbonylContact C-O 3.52Å; R900-G933 WeakPolarHBondContact CA-O 3.4Å; V901-G933 PolarHBondContact N-O 2.73Å; V901-G933 WeakPolarHBondContact O-CA 3.33Å; D930-G933 PolarHBondContact O-N 2.91Å; D930-G933 PolarHBondContact OD1-N 2.92Å; D930-G933 VanDerWaalsContact OD1-N 3.12Å; T931-G933 VanDerWaalsContact C-N 3.34Å
934	Y	86.3	Confident	86.1	Confident	58 Å²	58	59.1 Å²	59.1	23%	0.227	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	139.2	171.3	173.8	-98.4	0	0	0	110.4	R896 E898 Q929 D930 C936	R896-Y934 PolarHBondContact NH2-OH 2.85Å; E898-Y934 HydrophobicContact CB-CE2 4.28Å; E898-Y934 VanDerWaalsContact CD-OH 3.24Å; E898-Y934 HydrophobicContact CG-CE2 4.27Å; E898-Y934 PolarHBondContact OE1-OH 2.9Å; E898-Y934 VanDerWaalsContact OE1-OH 3.13Å; Q929-Y934 VanDerWaalsContact CA-O 3.23Å; Q929-Y934 WeakPolarHBondContact CA-O 3.36Å; D930-Y934 PolarHBondContact N-O 2.87Å; D930-Y934 VanDerWaalsContact N-O 3.14Å; D930-Y934 PolarHBondContact OD1-N 2.95Å; Y934-C936 HydrophobicContact CE1-CB 3.59Å; Y934-C936 WeakPolarHBondContact OH-CB 3.31Å
935	A	89.4	Confident	86.4	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	127.9	175	0	0	0	0	0	110.6	C899 F909 H928 L952	C899-A935 PolarHBondContact N-O 3.13Å; C899-A935 PolarHBondContact O-N 2.94Å; F909-A935 HydrophobicContact CD1-CB 3.73Å; F909-A935 HydrophobicContact CD2-CB 4.12Å; F909-A935 HydrophobicContact CE1-CB 3.67Å; F909-A935 HydrophobicContact CE2-CB 4.08Å; F909-A935 HydrophobicContact CG-CB 3.95Å; F909-A935 HydrophobicContact CZ-CB 3.86Å; H928-A935 WeakPolarHBondContact O-CA 3.28Å; A935-L952 HydrophobicContact CB-CD2 3.87Å
936	C	91.8	Very high	86.6	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.027	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	128.6	-177.8	171.4	0	0	0	0	111.4	L897 E898 M927 H928 Y934	L897-C936 CarbonylContact O-C 3.59Å; L897-C936 VanDerWaalsContact O-CA 3.31Å; L897-C936 WeakPolarHBondContact O-CA 3.49Å; E898-C936 HydrophobicContact CG-CB 4.09Å; M927-C936 WeakPolarHBondContact CA-O 3.48Å; H928-C936 HydrophobicContact CB-CB 4.37Å; H928-C936 PolarHBondContact N-O 2.94Å; H928-C936 PolarHBondContact O-N 2.82Å; Y934-C936 HydrophobicContact CE1-CB 3.59Å; Y934-C936 WeakPolarHBondContact OH-CB 3.31Å
937	L	92.4	Very high	87	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	113.9	164.6	-172.5	72.3	0	0	0	109	L897 W911 I918 I925 M927 I939 Y950	L897-L937 HydrophobicContact CB-CB 4.36Å; L897-L937 HydrophobicContact CD1-CD2 4.48Å; L897-L937 PolarHBondContact N-O 2.83Å; L897-L937 PolarHBondContact O-N 3.36Å; W911-L937 HydrophobicContact CD2-CB 3.89Å; W911-L937 HydrophobicContact CD2-CD2 4.26Å; W911-L937 HydrophobicContact CD2-CG 4.46Å; W911-L937 HydrophobicContact CE3-CB 3.87Å; W911-L937 HydrophobicContact CE3-CD2 3.89Å; W911-L937 HydrophobicContact CE3-CG 4.43Å; W911-L937 HydrophobicContact CG-CD1 4.46Å; W911-L937 HydrophobicContact CH2-CB 3.71Å; W911-L937 HydrophobicContact CZ2-CB 3.76Å; W911-L937 HydrophobicContact CZ3-CB 3.78Å; W911-L937 HydrophobicContact CZ3-CD2 4.3Å; I918-L937 HydrophobicContact CD1-CD1 4.42Å; I918-L937 HydrophobicContact CD1-CD2 3.55Å; I925-L937 HydrophobicContact CG2-CD1 3.58Å; I925-L937 HydrophobicContact CG2-CG 4.29Å; M927-L937 HydrophobicContact CG-CD1 3.51Å; M927-L937 HydrophobicContact SD-CD1 4.44Å; L937-I939 HydrophobicContact CD2-CD1 4.35Å; L937-I939 HydrophobicContact CG-CG1 4.39Å; L937-Y950 HydrophobicContact CD2-CD1 3.5Å; L937-Y950 HydrophobicContact CD2-CE1 3.54Å
938	L	91.9	Very high	87.3	Confident	36 Å²	36	54.9 Å²	54.9	19%	0.188	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.6	174.9	170.1	63.9	0	0	0	109.4	P894 V895 R896 I925 S926 H928 Q940	P894-L938 HydrophobicContact CB-CD1 4.22Å; V895-L938 WeakPolarHBondContact O-CA 3.35Å; V895-L938 WeakPolarHBondContact O-CD1 3.45Å; R896-L938 HydrophobicContact CG-CD1 3.83Å; I925-L938 WeakPolarHBondContact CA-O 3.43Å; S926-L938 PolarHBondContact N-O 2.68Å; S926-L938 PolarHBondContact O-N 2.83Å; H928-L938 WeakPolarHBondContact NE2-CD2 3.42Å; L938-Q940 HydrophobicContact CD1-CB 4.34Å
939	I	92.4	Very high	87.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	115.7	175.4	-52.5	173.7	0	0	0	108.1	P894 V895 R924 I925 L937 D946 Y950 L967	P894-I939 CarbonylContact C-O 3.58Å; P894-I939 WeakPolarHBondContact CA-O 3.35Å; V895-I939 HydrophobicContact CB-CB 4.2Å; V895-I939 PolarHBondContact N-O 2.83Å; V895-I939 PolarHBondContact O-N 2.67Å; R924-I939 WeakPolarHBondContact O-CA 3.47Å; I925-I939 HydrophobicContact CG1-CG1 4.29Å; I925-I939 HydrophobicContact CG1-CG2 4.22Å; I925-I939 HydrophobicContact CG2-CG1 4.43Å; L937-I939 HydrophobicContact CD2-CD1 4.35Å; L937-I939 HydrophobicContact CG-CG1 4.39Å; I939-D946 WeakPolarHBondContact CG2-OD2 3.34Å; I939-Y950 HydrophobicContact CD1-CE1 3.92Å; I939-Y950 WeakPolarHBondContact CD1-OH 3.37Å; I939-L967 HydrophobicContact CD1-CD2 4.16Å
940	Q	91.1	Very high	88.3	Confident	108 Å²	108	50.3 Å²	50.3	51%	0.505	27%	0.269	S	S	.	.	S	Bend	trans	-151.9	126.4	-175.6	-178.4	176.2	-13.6	0	0	112.2	P894 R924 L938	P894-Q940 HydrophobicContact CB-CB 4.06Å; P894-Q940 HydrophobicContact CB-CG 3.98Å; R924-Q940 WeakPolarHBondContact CA-O 3.34Å; R924-Q940 WeakPolarHBondContact CG-O 3.35Å; R924-Q940 PolarHBondContact O-N 3.42Å; L938-Q940 HydrophobicContact CD1-CB 4.34Å
941	P	91.5	Very high	89	Confident	64 Å²	64	48 Å²	48	42%	0.416	26%	0.258	S	S	.	.	S	Bend	cis	-67.9	147.9	-15.3	28.7	-36.6	0	0	0	112.2	G892 R924	G892-P941 WeakPolarHBondContact O-CB 3.43Å; R924-P941 WeakPolarHBondContact CD-O 3.47Å; R924-P941 PolarHBondContact NH1-O 3.1Å
942	A	92.3	Very high	90.2	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.017	22%	0.217	C	C	.	.			trans	-71.2	150.6	170.4	0	0	0	0	0	112.6	G892 H893 V895 D946 I969	G892-A942 PolarHBondContact N-O 3.47Å; H893-A942 WeakPolarHBondContact O-CB 3.49Å; H893-A942 PolarHBondContact O-N 3.13Å; V895-A942 HydrophobicContact CG2-CB 3.8Å; A942-D946 WeakPolarHBondContact CA-OD2 3.38Å; A942-I969 HydrophobicContact CB-CD1 3.86Å
943	K	91.9	Very high	91.1	Very high	102 Å²	102	39.2 Å²	39.2	44%	0.443	20%	0.204	S	C	.	.			trans	-134.8	156	-178.8	-62	-175.3	176.9	-169.8	0	109.5	S945 D946	K943-S945 PolarHBondContact O-N 3.05Å; K943-D946 PolarHBondContact N-OD2 2.76Å; K943-D946 VanDerWaalsContact O-CB 3.32Å; K943-D946 WeakPolarHBondContact O-CB 3.29Å; K943-D946 PolarHBondContact O-N 2.81Å
944	K	91.4	Very high	91.8	Very high	127 Å²	127	39 Å²	39	55%	0.552	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-51.8	-29.9	175.5	-69	172.9	-153.1	-174.6	0	114.6	E891 D946 A947	E891-K944 WeakPolarHBondContact OE1-CG 3.44Å; E891-K944 PolarHBondContact OE1-N 2.72Å; E891-K944 WeakPolarHBondContact OE2-CE 3.23Å; E891-K944 IonicContact OE2-NZ 3.87Å; K944-D946 PolarHBondContact O-N 2.97Å; K944-A947 PolarHBondContact O-N 2.78Å
945	S	91.2	Very high	91.9	Very high	83 Å²	83	41.4 Å²	41.4	58%	0.58	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-65.4	-16.1	175.1	57.3	0	0	0	0	115	K913 K943	K913-S945 WeakPolarHBondContact CE-O 3.45Å; K913-S945 PolarHBondContact NZ-O 3.39Å; K943-S945 PolarHBondContact O-N 3.05Å
946	D	91.3	Very high	91.7	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.032	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-83.1	-17.5	179.8	-55.9	-36.1	0	0	0	112.3	K913 R924 I939 A942 K943 K944 G948 Y950 L967 I969	K913-D946 VanDerWaalsContact CE-C 3.47Å; K913-D946 WeakPolarHBondContact CE-O 3.26Å; R924-D946 IonicContact CZ-OD1 3.4Å; R924-D946 IonicContact CZ-OD2 2.67Å; R924-D946 IonicContact NH1-OD1 3.68Å; R924-D946 PolarHBondContact NH1-OD1 2.94Å; R924-D946 IonicContact NH1-OD2 2.69Å; R924-D946 PolarHBondContact NH1-OD2 2.79Å; R924-D946 IonicContact NH2-OD1 3.49Å; R924-D946 PolarHBondContact NH2-OD1 2.9Å; R924-D946 IonicContact NH2-OD2 3.55Å; I939-D946 WeakPolarHBondContact CG2-OD2 3.34Å; A942-D946 WeakPolarHBondContact CA-OD2 3.38Å; K943-D946 PolarHBondContact N-OD2 2.76Å; K943-D946 VanDerWaalsContact O-CB 3.32Å; K943-D946 WeakPolarHBondContact O-CB 3.29Å; K943-D946 PolarHBondContact O-N 2.81Å; K944-D946 PolarHBondContact O-N 2.97Å; D946-G948 PolarHBondContact O-N 2.92Å; D946-Y950 VanDerWaalsContact O-CE2 3.26Å; D946-Y950 WeakPolarHBondContact O-CE2 3.46Å; D946-Y950 PolarHBondContact O-OH 2.98Å; D946-Y950 VanDerWaalsContact O-OH 3.07Å; D946-L967 HydrophobicContact CB-CD2 4.14Å; D946-I969 HydrophobicContact CB-CG1 4.41Å
947	A	93.7	Very high	91.3	Very high	35 Å²	35	47.5 Å²	47.5	29%	0.289	24%	0.242	S	C	.	.			trans	-59	137.3	174.7	0	0	0	0	0	110.8	K913 K944 L967 I969	K913-A947 PolarHBondContact NZ-O 2.86Å; K944-A947 PolarHBondContact O-N 2.78Å; A947-L967 CarbonylContact C-O 3.58Å; A947-L967 VanDerWaalsContact CA-O 3.23Å; A947-L967 WeakPolarHBondContact CA-O 3.45Å; A947-I969 HydrophobicContact CB-CB 4.45Å; A947-I969 HydrophobicContact CB-CG1 4.3Å
948	G	93.7	Very high	90.4	Very high	13 Å²	13	49.6 Å²	49.6	13%	0.134	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.5	-172.5	-174.2	0	0	0	0	0	113.9	D914 D946 L967	D914-G948 WeakPolarHBondContact OD1-CA 3.49Å; D946-G948 PolarHBondContact O-N 2.92Å; G948-L967 PolarHBondContact N-O 2.95Å; G948-L967 PolarHBondContact O-N 3.17Å
949	W	94.1	Very high	89.9	Confident	128 Å²	128	49 Å²	49	49%	0.485	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121	-179.3	-68	97.5	0	0	0	111.7	K913 D914 T964 A965 R966	K913-W949 CarbonylContact C-O 3.52Å; K913-W949 WeakPolarHBondContact CA-O 3.42Å; D914-W949 PolarHBondContact N-O 2.86Å; D914-W949 PolarHBondContact OD1-N 3.12Å; W949-T964 HydrophobicContact CB-CG2 4.4Å; W949-T964 HydrophobicContact CE3-CG2 3.91Å; W949-A965 CarbonylContact C-O 3.56Å; W949-A965 WeakPolarHBondContact CA-O 3.44Å; W949-R966 HydrophobicContact CD2-CB 4.22Å; W949-R966 HydrophobicContact CE3-CB 3.79Å; W949-R966 HydrophobicContact CH2-CB 4.06Å; W949-R966 HydrophobicContact CZ2-CB 4.43Å; W949-R966 HydrophobicContact CZ3-CB 3.72Å
950	Y	94.1	Very high	89.7	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.008	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.3	178.1	-75	-98.4	0	0	0	110.6	L897 K912 K913 I918 L937 I939 D946 T964 A965 L967	L897-Y950 HydrophobicContact CD1-CD1 3.71Å; L897-Y950 HydrophobicContact CD1-CD2 3.78Å; L897-Y950 HydrophobicContact CD1-CE1 4.34Å; L897-Y950 HydrophobicContact CD1-CE2 4.41Å; L897-Y950 HydrophobicContact CD1-CG 3.38Å; K912-Y950 WeakPolarHBondContact O-CA 3.38Å; K913-Y950 HydrophobicContact CB-CD1 4.35Å; K913-Y950 HydrophobicContact CB-CE1 4.02Å; K913-Y950 HydrophobicContact CD-CE1 4.32Å; K913-Y950 HydrophobicContact CD-CE2 4.27Å; K913-Y950 WeakPolarHBondContact CD-OH 3.16Å; K913-Y950 WeakPolarHBondContact CE-OH 3.49Å; K913-Y950 HydrophobicContact CG-CE1 4.06Å; K913-Y950 HydrophobicContact CG-CE2 4Å; I918-Y950 HydrophobicContact CD1-CD1 3.9Å; I918-Y950 HydrophobicContact CD1-CE1 3.73Å; L937-Y950 HydrophobicContact CD2-CD1 3.5Å; L937-Y950 HydrophobicContact CD2-CE1 3.54Å; I939-Y950 HydrophobicContact CD1-CE1 3.92Å; I939-Y950 WeakPolarHBondContact CD1-OH 3.37Å; D946-Y950 VanDerWaalsContact O-CE2 3.26Å; D946-Y950 WeakPolarHBondContact O-CE2 3.46Å; D946-Y950 PolarHBondContact O-OH 2.98Å; D946-Y950 VanDerWaalsContact O-OH 3.07Å; Y950-T964 CarbonylContact O-C 3.59Å; Y950-T964 VanDerWaalsContact O-CA 3.25Å; Y950-T964 WeakPolarHBondContact O-CA 3.34Å; Y950-A965 PolarHBondContact N-O 2.94Å; Y950-A965 PolarHBondContact O-N 3.02Å; Y950-L967 HydrophobicContact CD2-CB 3.89Å; Y950-L967 HydrophobicContact CD2-CD2 4.45Å; Y950-L967 HydrophobicContact CE2-CB 3.78Å; Y950-L967 HydrophobicContact CE2-CD2 3.7Å; Y950-L967 HydrophobicContact CE2-CG 4.37Å
951	T	92.3	Very high	89.5	Confident	24 Å²	24	51.1 Å²	51.1	15%	0.147	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.6	177.7	-62.3	0	0	0	0	109.7	W911 K912 C963 T964	W911-T951 WeakPolarHBondContact CA-O 3.36Å; K912-T951 PolarHBondContact N-O 2.9Å; K912-T951 PolarHBondContact O-N 2.93Å; T951-C963 WeakPolarHBondContact CA-O 3.39Å; T951-T964 WeakPolarHBondContact OG1-CG2 3.19Å; T951-T964 PolarHBondContact OG1-OG1 2.88Å
952	L	92.6	Very high	89.5	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.6	166.4	177.8	58.1	0	0	0	109.2	L884 C899 F909 Y910 W911 A935 S962 C963	L884-L952 HydrophobicContact CD1-CB 3.94Å; C899-L952 HydrophobicContact CB-CD2 3.57Å; F909-L952 HydrophobicContact CB-CD1 3.98Å; F909-L952 HydrophobicContact CD1-CD1 3.79Å; F909-L952 HydrophobicContact CD1-CD2 3.98Å; F909-L952 HydrophobicContact CD1-CG 4.16Å; F909-L952 HydrophobicContact CE1-CD2 4.27Å; F909-L952 HydrophobicContact CG-CD1 4.34Å; Y910-L952 WeakPolarHBondContact O-CD1 3.49Å; W911-L952 HydrophobicContact CD2-CB 4.28Å; W911-L952 HydrophobicContact CD2-CD1 3.87Å; W911-L952 HydrophobicContact CE3-CB 4.14Å; W911-L952 HydrophobicContact CG-CD1 4.04Å; W911-L952 HydrophobicContact CH2-CB 4.31Å; W911-L952 HydrophobicContact CH2-CD2 4.28Å; W911-L952 HydrophobicContact CZ2-CB 4.4Å; W911-L952 HydrophobicContact CZ2-CD1 4.11Å; W911-L952 HydrophobicContact CZ2-CD2 3.89Å; W911-L952 HydrophobicContact CZ2-CG 4.36Å; W911-L952 HydrophobicContact CZ3-CB 4.16Å; A935-L952 HydrophobicContact CB-CD2 3.87Å; L952-S962 CarbonylContact O-C 3.43Å; L952-S962 WeakPolarHBondContact O-CA 3.36Å; L952-S962 WeakPolarHBondContact O-CB 3.32Å; L952-C963 PolarHBondContact N-O 3.48Å; L952-C963 PolarHBondContact O-N 2.86Å
953	S	91.1	Very high	89.4	Confident	23 Å²	23	52.1 Å²	52.1	16%	0.161	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.9	168.4	-60.4	0	0	0	0	110.1	F909 Y910 V961 S962	F909-S953 CarbonylContact C-O 3.55Å; F909-S953 WeakPolarHBondContact CA-O 2.82Å; Y910-S953 PolarHBondContact N-O 2.87Å; Y910-S953 PolarHBondContact O-N 2.88Å; S953-V961 CarbonylContact C-O 3.54Å; S953-V961 WeakPolarHBondContact CA-O 3.39Å; S953-S962 WeakPolarHBondContact OG-CB 3.15Å
954	A	92.1	Very high	89.5	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	125.7	179.8	0	0	0	0	0	109.4	P878 V901 P907 V908 F909 I960 V961	P878-A954 HydrophobicContact CB-CB 4.45Å; V901-A954 HydrophobicContact CB-CB 4.03Å; V901-A954 HydrophobicContact CG1-CB 3.74Å; V901-A954 HydrophobicContact CG2-CB 4.06Å; P907-A954 HydrophobicContact CB-CB 4.14Å; V908-A954 WeakPolarHBondContact O-CA 3.41Å; F909-A954 HydrophobicContact CD1-CB 3.85Å; F909-A954 HydrophobicContact CE1-CB 3.82Å; A954-I960 WeakPolarHBondContact O-CA 3.24Å; A954-V961 HydrophobicContact CB-CG2 4.19Å; A954-V961 PolarHBondContact N-O 3.27Å; A954-V961 PolarHBondContact O-N 3.07Å
955	K	87.3	Confident	89.5	Confident	108 Å²	108	44.6 Å²	44.6	47%	0.47	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	139.2	-172.8	-177.6	-177.3	176	-173.8	0	112	P907 V908 Y910 G959 I960	P907-K955 CarbonylContact C-O 3.57Å; P907-K955 WeakPolarHBondContact CA-O 3.49Å; V908-K955 PolarHBondContact N-O 2.87Å; V908-K955 PolarHBondContact O-N 2Å; Y910-K955 HydrophobicContact CE2-CB 4.1Å; K955-G959 WeakPolarHBondContact CA-O 3.05Å; K955-I960 HydrophobicContact CB-CB 4.26Å; K955-I960 HydrophobicContact CB-CD1 4.16Å; K955-I960 HydrophobicContact CB-CG1 4.02Å; K955-I960 HydrophobicContact CD-CD1 4.47Å; K955-I960 HydrophobicContact CG-CB 4.24Å; K955-I960 HydrophobicContact CG-CD1 4.47Å; K955-I960 HydrophobicContact CG-CG1 4.45Å
956	N	86.5	Confident	89.7	Confident	17 Å²	17	45.7 Å²	45.7	9%	0.091	25%	0.25	C	S	.	.			trans	-131.1	-167.4	157.5	68.9	13.2	0	0	0	110	K876 P878 M904 P905 A958 G959	K876-N956 PolarHBondContact O-ND2 2.99Å; P878-N956 WeakPolarHBondContact CD-OD1 3.35Å; P878-N956 HydrophobicContact CG-CB 4.38Å; M904-N956 PolarHBondContact N-ND2 3.12Å; M904-N956 PolarHBondContact O-ND2 3.2Å; P905-N956 WeakPolarHBondContact O-CB 3.48Å; P905-N956 PolarHBondContact O-ND2 2.78Å; N956-A958 VanDerWaalsContact C-N 3.29Å; N956-A958 PolarHBondContact O-N 3.43Å; N956-A958 WeakPolarHBondContact OD1-CA 3.05Å; N956-A958 PolarHBondContact OD1-N 2.72Å; N956-G959 PolarHBondContact N-O 3.34Å; N956-G959 VanDerWaalsContact O-O 3.13Å; N956-G959 PolarHBondContact OD1-N 2.78Å; N956-G959 VanDerWaalsContact OD1-N 3.13Å
957	E	83.1	Confident	89.9	Confident	117 Å²	117	45.4 Å²	45.4	55%	0.547	25%	0.249	S	C	.	.	S	Bend	trans	-71	-18.1	178	52.1	171.8	172.1	0	0	114.4	K875 P905	K875-E957 HydrophobicContact CD-CG 4.38Å; K875-E957 WeakPolarHBondContact CD-OE1 3.3Å; K875-E957 WeakPolarHBondContact CG-OE1 3.27Å; K875-E957 IonicContact NZ-OE1 3.09Å; K875-E957 PolarHBondContact NZ-OE1 3.24Å; K875-E957 IonicContact NZ-OE2 2.63Å; K875-E957 PolarHBondContact NZ-OE2 3.19Å; P905-E957 WeakPolarHBondContact CD-OE1 3.35Å; P905-E957 HydrophobicContact CG-CG 4.24Å; P905-E957 WeakPolarHBondContact CG-OE1 3.36Å
958	A	74.1	Confident	89.9	Confident	43 Å²	43	46.7 Å²	46.7	36%	0.355	25%	0.251	S	S	.	.	S	Bend	trans	-95.6	-12.4	179.1	0	0	0	0	0	113.7	K875 A877 N956	K875-A958 HydrophobicContact CB-CB 4.13Å; A877-A958 HydrophobicContact CB-CB 4.38Å; A877-A958 WeakPolarHBondContact CB-O 3.3Å; N956-A958 VanDerWaalsContact C-N 3.29Å; N956-A958 PolarHBondContact O-N 3.43Å; N956-A958 WeakPolarHBondContact OD1-CA 3.05Å; N956-A958 PolarHBondContact OD1-N 2.72Å
959	G	79.6	Confident	89.9	Confident	25 Å²	25	47.3 Å²	47.3	26%	0.258	25%	0.251	S	S	.	.			trans	169.7	-175.6	175.4	0	0	0	0	0	115.2	P878 K955 N956	P878-G959 VanDerWaalsContact CD-C 3.49Å; P878-G959 WeakPolarHBondContact CD-O 3.41Å; K955-G959 WeakPolarHBondContact CA-O 3.05Å; N956-G959 PolarHBondContact N-O 3.34Å; N956-G959 VanDerWaalsContact O-O 3.13Å; N956-G959 PolarHBondContact OD1-N 2.78Å; N956-G959 VanDerWaalsContact OD1-N 3.13Å
960	I	88.3	Confident	89.7	Confident	108 Å²	108	47.3 Å²	47.3	55%	0.554	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	142.2	175.2	-172.2	169.7	0	0	0	109.7	A954 K955	A954-I960 WeakPolarHBondContact O-CA 3.24Å; K955-I960 HydrophobicContact CB-CB 4.26Å; K955-I960 HydrophobicContact CB-CD1 4.16Å; K955-I960 HydrophobicContact CB-CG1 4.02Å; K955-I960 HydrophobicContact CD-CD1 4.47Å; K955-I960 HydrophobicContact CG-CB 4.24Å; K955-I960 HydrophobicContact CG-CD1 4.47Å; K955-I960 HydrophobicContact CG-CG1 4.45Å
961	V	88.1	Confident	89	Confident	43 Å²	43	49.5 Å²	49.5	26%	0.261	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	160.1	171.2	-63.8	0	0	0	0	110	P878 I880 V901 S953 A954	P878-V961 HydrophobicContact CB-CG2 3.98Å; P878-V961 WeakPolarHBondContact O-CG1 3.29Å; I880-V961 HydrophobicContact CD1-CB 4.13Å; I880-V961 HydrophobicContact CD1-CG2 3.91Å; I880-V961 HydrophobicContact CG1-CB 4.09Å; I880-V961 HydrophobicContact CG1-CG2 3.51Å; V901-V961 HydrophobicContact CG1-CG2 3.9Å; S953-V961 CarbonylContact C-O 3.54Å; S953-V961 WeakPolarHBondContact CA-O 3.39Å; A954-V961 HydrophobicContact CB-CG2 4.19Å; A954-V961 PolarHBondContact N-O 3.27Å; A954-V961 PolarHBondContact O-N 3.07Å
962	S	91.9	Very high	87.7	Confident	72 Å²	72	53.8 Å²	53.8	50%	0.503	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	158.3	173.5	58.2	0	0	0	0	112.5	I880 L952 S953	I880-S962 WeakPolarHBondContact CD1-O 3.48Å; L952-S962 CarbonylContact O-C 3.43Å; L952-S962 WeakPolarHBondContact O-CA 3.36Å; L952-S962 WeakPolarHBondContact O-CB 3.32Å; S953-S962 WeakPolarHBondContact OG-CB 3.15Å
963	C	89.5	Confident	85.9	Confident	16 Å²	16	64.9 Å²	64.9	11%	0.108	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	158.9	167.9	60.2	0	0	0	0	109.8	I880 T951 L952	I880-C963 HydrophobicContact CD1-CB 3.74Å; T951-C963 WeakPolarHBondContact CA-O 3.39Å; L952-C963 PolarHBondContact N-O 3.48Å; L952-C963 PolarHBondContact O-N 2.86Å
964	T	92.8	Very high	84.2	Confident	70 Å²	70	71.2 Å²	71.2	43%	0.429	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141.6	-170.7	-58.1	0	0	0	0	110.1	W949 Y950 T951	W949-T964 HydrophobicContact CB-CG2 4.4Å; W949-T964 HydrophobicContact CE3-CG2 3.91Å; Y950-T964 CarbonylContact O-C 3.59Å; Y950-T964 VanDerWaalsContact O-CA 3.25Å; Y950-T964 WeakPolarHBondContact O-CA 3.34Å; T951-T964 WeakPolarHBondContact OG1-CG2 3.19Å; T951-T964 PolarHBondContact OG1-OG1 2.88Å
965	A	93.4	Very high	82.1	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.6	173.2	0	0	0	0	0	111.6	L884 Q885 N886 W949 Y950	L884-A965 HydrophobicContact CB-CB 3.58Å; Q885-A965 WeakPolarHBondContact O-CB 3.33Å; N886-A965 WeakPolarHBondContact OD1-CA 3.37Å; W949-A965 CarbonylContact C-O 3.56Å; W949-A965 WeakPolarHBondContact CA-O 3.44Å; Y950-A965 PolarHBondContact N-O 2.94Å; Y950-A965 PolarHBondContact O-N 3.02Å
966	R	93.9	Very high	80	Confident	107 Å²	107	82.9 Å²	82.9	40%	0.404	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.1	177.5	-179.3	173.3	166.7	153	2	111.2	N886 C887 W949 D968	N886-R966 CarbonylContact C-O 3.44Å; N886-R966 VanDerWaalsContact CA-O 3.27Å; N886-R966 WeakPolarHBondContact CA-O 3.45Å; N886-R966 PolarHBondContact OD1-N 2.96Å; C887-R966 PolarHBondContact N-O 3.19Å; W949-R966 HydrophobicContact CD2-CB 4.22Å; W949-R966 HydrophobicContact CE3-CB 3.79Å; W949-R966 HydrophobicContact CH2-CB 4.06Å; W949-R966 HydrophobicContact CZ2-CB 4.43Å; W949-R966 HydrophobicContact CZ3-CB 3.72Å; R966-D968 WeakPolarHBondContact CD-OD2 2.88Å; R966-D968 IonicContact CZ-OD1 3.05Å; R966-D968 VanDerWaalsContact CZ-OD1 3.32Å; R966-D968 IonicContact CZ-OD2 2.76Å; R966-D968 VanDerWaalsContact NE-CG 3.28Å; R966-D968 IonicContact NE-OD1 3.53Å; R966-D968 PolarHBondContact NE-OD1 3.15Å; R966-D968 IonicContact NE-OD2 2.72Å; R966-D968 PolarHBondContact NE-OD2 2.92Å; R966-D968 IonicContact NH2-OD1 3.32Å; R966-D968 PolarHBondContact NH2-OD1 2.77Å; R966-D968 IonicContact NH2-OD2 3.56Å
967	L	95.1	Very high	78.2	Confident	0 Å²	0	89 Å²	89	0%	0	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.1	167.5	175	59.8	0	0	0	109.2	C887 V889 V895 I939 D946 A947 G948 Y950 I969	C887-L967 WeakPolarHBondContact O-CA 3.09Å; V889-L967 HydrophobicContact CG2-CD1 4.42Å; V895-L967 HydrophobicContact CB-CD1 4.48Å; V895-L967 HydrophobicContact CG1-CD1 3.71Å; V895-L967 HydrophobicContact CG1-CD2 3.96Å; V895-L967 HydrophobicContact CG1-CG 4.49Å; V895-L967 HydrophobicContact CG2-CD1 3.88Å; V895-L967 HydrophobicContact CG2-CD2 4.11Å; I939-L967 HydrophobicContact CD1-CD2 4.16Å; D946-L967 HydrophobicContact CB-CD2 4.14Å; A947-L967 CarbonylContact C-O 3.58Å; A947-L967 VanDerWaalsContact CA-O 3.23Å; A947-L967 WeakPolarHBondContact CA-O 3.45Å; G948-L967 PolarHBondContact N-O 2.95Å; G948-L967 PolarHBondContact O-N 3.17Å; Y950-L967 HydrophobicContact CD2-CB 3.89Å; Y950-L967 HydrophobicContact CD2-CD2 4.45Å; Y950-L967 HydrophobicContact CE2-CB 3.78Å; Y950-L967 HydrophobicContact CE2-CD2 3.7Å; Y950-L967 HydrophobicContact CE2-CG 4.37Å; L967-I969 HydrophobicContact CD1-CD1 3.88Å; L967-I969 HydrophobicContact CD2-CD1 4.27Å; L967-I969 HydrophobicContact CG-CD1 4.05Å; L967-I969 HydrophobicContact CG-CG1 4.38Å
968	D	93.9	Very high	76.6	Confident	62 Å²	62	88.2 Å²	88.2	33%	0.332	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.7	170.9	-71.6	-70.1	0	0	0	110.7	C887 G888 V889 R966	C887-D968 PolarHBondContact O-N 3.12Å; G888-D968 CarbonylContact C-O 3.56Å; G888-D968 VanDerWaalsContact CA-O 3.29Å; G888-D968 WeakPolarHBondContact CA-O 3.5Å; V889-D968 PolarHBondContact N-O 2.86Å; R966-D968 WeakPolarHBondContact CD-OD2 2.88Å; R966-D968 IonicContact CZ-OD1 3.05Å; R966-D968 VanDerWaalsContact CZ-OD1 3.32Å; R966-D968 IonicContact CZ-OD2 2.76Å; R966-D968 VanDerWaalsContact NE-CG 3.28Å; R966-D968 IonicContact NE-OD1 3.53Å; R966-D968 PolarHBondContact NE-OD1 3.15Å; R966-D968 IonicContact NE-OD2 2.72Å; R966-D968 PolarHBondContact NE-OD2 2.92Å; R966-D968 IonicContact NH2-OD1 3.32Å; R966-D968 PolarHBondContact NH2-OD1 2.77Å; R966-D968 IonicContact NH2-OD2 3.56Å
969	I	93.8	Very high	75.4	Confident	26 Å²	26	91.7 Å²	91.7	13%	0.133	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.8	-178.5	-58.6	-62.2	0	0	0	110.2	V889 E891 V895 A942 D946 A947 L967	V889-I969 HydrophobicContact CB-CD1 4.12Å; V889-I969 WeakPolarHBondContact O-CA 3.45Å; E891-I969 HydrophobicContact CB-CG2 4.1Å; V895-I969 HydrophobicContact CG2-CD1 4.12Å; A942-I969 HydrophobicContact CB-CD1 3.86Å; D946-I969 HydrophobicContact CB-CG1 4.41Å; A947-I969 HydrophobicContact CB-CB 4.45Å; A947-I969 HydrophobicContact CB-CG1 4.3Å; L967-I969 HydrophobicContact CD1-CD1 3.88Å; L967-I969 HydrophobicContact CD2-CD1 4.27Å; L967-I969 HydrophobicContact CG-CD1 4.05Å; L967-I969 HydrophobicContact CG-CG1 4.38Å
970	Y	90.1	Very high	73.8	Confident	127 Å²	127	96.4 Å²	96.4	50%	0.498	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	148.8	-179	54.5	-94.2	0	0	0	113	V889 P890 E891	V889-Y970 PolarHBondContact O-N 2.67Å; P890-Y970 CarbonylContact C-O 3.57Å; P890-Y970 WeakPolarHBondContact CA-O 3.34Å; P890-Y970 HydrophobicContact CB-CD2 3.98Å; P890-Y970 HydrophobicContact CB-CE2 3.55Å; P890-Y970 WeakPolarHBondContact CD-OH 3.32Å; P890-Y970 HydrophobicContact CG-CD2 4.47Å; P890-Y970 HydrophobicContact CG-CE2 3.57Å; E891-Y970 PolarHBondContact N-O 2.69Å
971	A	80.5	Confident	71.5	Confident	48 Å²	48	99.9 Å²	99.9	40%	0.397	51%	0.51	S	S	.	.			trans	-75.6	139.5	-178.3	0	0	0	0	0	111.9	W973	A971-W973 PolarHBondContact O-N 3.4Å
972	Q	65	Low	69.3	Low	114 Å²	114	103.4 Å²	103.4	53%	0.533	54%	0.536	S	S	.	.			trans	-80.1	102.3	177.6	-168.8	175.5	19.9	0	0	110.9	H974	Q972-H974 PolarHBondContact O-N 3.16Å; Q972-H974 PolarHBondContact O-ND1 3.18Å
973	W	53.4	Low	67	Low	236 Å²	236	106.2 Å²	106.2	89%	0.894	55%	0.55	S	S	*	*			trans	-64.6	112.6	176.7	-74.9	86.6	0	0	0	111.3	A971 H975	A971-W973 PolarHBondContact O-N 3.4Å; W973-H975 PolarHBondContact O-N 3.07Å
974	H	55	Low	64.6	Low	155 Å²	155	116.4 Å²	116.4	72%	0.718	59%	0.586	S	S	*	*			trans	-79.1	99.2	174.8	-73.2	55.4	0	0	0	109.5	Q972 Q976	Q972-H974 PolarHBondContact O-N 3.16Å; Q972-H974 PolarHBondContact O-ND1 3.18Å; H974-Q976 VanDerWaalsContact C-N 3.34Å; H974-Q976 PolarHBondContact O-N 3.28Å
975	H	49.2	Very low	62.2	Low	173 Å²	173	118.3 Å²	118.3	80%	0.801	60%	0.6	S	S	*	*			trans	-67.8	92.9	167.4	-107.4	70.9	0	0	0	109.5	W973 I977	W973-H975 PolarHBondContact O-N 3.07Å; H975-I977 VanDerWaalsContact C-N 3.33Å; H975-I977 PolarHBondContact O-N 3.32Å
976	Q	43.5	Very low	59.5	Low	181 Å²	181	124.5 Å²	124.5	85%	0.846	64%	0.644	S	S	*	*			trans	-70.4	94.1	162.9	-68.9	-171	6.9	0	0	108	H974 P978	H974-Q976 VanDerWaalsContact C-N 3.34Å; H974-Q976 PolarHBondContact O-N 3.28Å; Q976-P978 VanDerWaalsContact O-CD 3.29Å; Q976-P978 WeakPolarHBondContact O-CD 3.17Å
977	I	48.1	Very low	56.6	Low	145 Å²	145	122.8 Å²	122.8	74%	0.744	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-67.1	116.1	169.6	-58	174.5	0	0	0	106.7	H975	H975-I977 VanDerWaalsContact C-N 3.33Å; H975-I977 PolarHBondContact O-N 3.32Å
978	P	48.9	Very low	53.9	Low	102 Å²	102	127.7 Å²	127.7	66%	0.662	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-63	141.2	174	27.3	-33.5	0	0	0	109.1	Q976	Q976-P978 VanDerWaalsContact O-CD 3.29Å; Q976-P978 WeakPolarHBondContact O-CD 3.17Å
979	P	48.7	Very low	51.3	Low	115 Å²	115	136.4 Å²	136.4	75%	0.747	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-59.6	141.2	-175	24.3	-33.9	0	0	0	111	M981	P979-M981 PolarHBondContact O-N 3.28Å
980	P	45.7	Very low	48.5	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-61.8	129	-173.3	24.6	-34.1	0	0	0	111.1	S982	P980-S982 PolarHBondContact O-N 2.92Å
981	M	40.8	Very low	46.1	Very low	181 Å²	181	143 Å²	143	89%	0.892	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-59.1	126.6	174.9	-83.5	-171.8	-84.7	0	0	110.5	P979 V983	P979-M981 PolarHBondContact O-N 3.28Å; M981-V983 PolarHBondContact O-N 2.79Å; M981-V983 VanDerWaalsContact O-N 3.07Å
982	S	42.4	Very low	44.3	Very low	116 Å²	116	145.7 Å²	145.7	81%	0.811	78%	0.783	S	S	*	*			trans	-68.6	105.1	176.3	-174.9	0	0	0	0	110.2	P980 R984	P980-S982 PolarHBondContact O-N 2.92Å; S982-R984 PolarHBondContact O-N 2.89Å; S982-R984 VanDerWaalsContact O-N 3.16Å
983	V	44.1	Very low	42.9	Very low	132 Å²	132	147.4 Å²	147.4	80%	0.8	80%	0.795	S	S	*	*			trans	-71.3	106.9	179.6	-179.7	0	0	0	0	109.5	M981	M981-V983 PolarHBondContact O-N 2.79Å; M981-V983 VanDerWaalsContact O-N 3.07Å
984	R	38.9	Very low	42.8	Very low	229 Å²	229	140.5 Å²	140.5	86%	0.864	78%	0.779	S	S	*	*			trans	-70.7	138.3	165.9	-67.8	-174.4	177.7	-170.9	-0.1	109.7	S982	S982-R984 PolarHBondContact O-N 2.89Å; S982-R984 VanDerWaalsContact O-N 3.16Å
985	P	41.9	Very low	42.1	Very low	110 Å²	110	139.2 Å²	139.2	71%	0.714	79%	0.787	S	S	*	*			trans	-84.9	160.2	-171.2	33.5	-37	0	0	0	114.1
986	S	36	Very low	42.1	Very low	131 Å²	131	140.6 Å²	140.6	92%	0.916	79%	0.791	S	S	*	*			trans	72.8	136.8	167.9	77.3	0	0	0	0	117.9
987	G	34.5	Very low	42.1	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	78%	0.777	S	S	*	*			trans	159.7	77.2	-175.7	0	0	0	0	0	110.8
988	S	37.7	Very low	41.8	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	78%	0.779	S	S	*	*			trans	-61.4	138.4	-172.7	-175.3	0	0	0	0	112.9
989	R	38.6	Very low	41.5	Very low	245 Å²	245	136.7 Å²	136.7	93%	0.925	78%	0.784	S	S	*	*			trans	-133.9	62.6	167.4	-69.5	-158.7	-66.1	-177.2	-1.4	112	G991	R989-G991 PolarHBondContact O-N 3.26Å
990	Y	35.8	Very low	41.5	Very low	222 Å²	222	138.1 Å²	138.1	87%	0.871	78%	0.784	S	S	*	*			trans	-69.4	101.1	153.9	-88.2	-84.8	0	0	0	108.7	S992	Y990-S992 PolarHBondContact O-N 2.86Å
991	G	40.3	Very low	41.1	Very low	68 Å²	68	141.7 Å²	141.7	70%	0.701	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72	117	163.2	0	0	0	0	0	108.9	R989 L993	R989-G991 PolarHBondContact O-N 3.26Å; G991-L993 PolarHBondContact O-N 3.01Å
992	S	41	Very low	41.2	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.3	129.3	-179.1	-169.9	0	0	0	0	111	Y990 T994	Y990-S992 PolarHBondContact O-N 2.86Å; S992-T994 PolarHBondContact O-N 3.28Å
993	L	35.5	Very low	40.8	Very low	151 Å²	151	138 Å²	138	79%	0.791	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-72	118.6	173.1	-169.8	74.3	0	0	0	109.1	G991	G991-L993 PolarHBondContact O-N 3.01Å
994	T	51.8	Low	40.4	Very low	91 Å²	91	142.4 Å²	142.4	56%	0.558	79%	0.793	S	S	*	*			trans	-114	157.9	170.8	69.1	0	0	0	0	110.4	S992 K996 G997	S992-T994 PolarHBondContact O-N 3.28Å; T994-K996 PolarHBondContact O-N 2.79Å; T994-G997 PolarHBondContact O-N 2.77Å
995	S	40.9	Very low	40.2	Very low	127 Å²	127	136.5 Å²	136.5	89%	0.888	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	19.4	-162.7	50.8	0	0	0	0	116.4
996	K	49.6	Very low	39.8	Very low	203 Å²	203	136.2 Å²	136.2	88%	0.883	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.4	4.9	178.3	-66.6	-168.3	176.5	-176	0	115.8	T994	T994-K996 PolarHBondContact O-N 2.79Å
997	G	43.3	Very low	39.7	Very low	54 Å²	54	138.9 Å²	138.9	56%	0.557	79%	0.788	S	S	*	*			trans	107.8	-176.4	172.8	0	0	0	0	0	115.4	T994	T994-G997 PolarHBondContact O-N 2.77Å
998	L	41.3	Very low	39.7	Very low	150 Å²	150	143.8 Å²	143.8	79%	0.785	79%	0.792	S	S	*	*			trans	-108.3	131.2	-175.6	-103.1	153.9	0	0	0	110.4
999	D	42.4	Very low	39.5	Very low	141 Å²	141	145 Å²	145	75%	0.754	80%	0.8	S	S	*	*			trans	-107.9	146.2	179	-168.5	1.8	0	0	0	110.9
1000	I	49.3	Very low	39.1	Very low	146 Å²	146	138.7 Å²	138.7	75%	0.749	79%	0.789	S	S	*	*			trans	-144.7	57.3	-168.8	-40.2	179.8	0	0	0	111.5
1001	F	36.8	Very low	38.9	Very low	199 Å²	199	137.4 Å²	137.4	87%	0.873	79%	0.794	S	S	*	*			trans	-138.5	59.8	-179.1	-104.6	-74.4	0	0	0	116.1
1002	S	42.6	Very low	38.5	Very low	123 Å²	123	139 Å²	139	86%	0.86	79%	0.789	S	S	*	*			trans	-163	84.7	163.7	63.5	0	0	0	0	115.5
1003	A	34.8	Very low	38.1	Very low	98 Å²	98	144.5 Å²	144.5	81%	0.81	80%	0.796	S	S	*	*			trans	-169.7	71.4	162.2	0	0	0	0	0	114.2
1004	F	36.1	Very low	37.9	Very low	223 Å²	223	141.9 Å²	141.9	98%	0.978	79%	0.79	S	S	*	*			trans	-140.1	124.7	167.9	-96.8	-72.7	0	0	0	111.7
1005	S	33.8	Very low	36.8	Very low	105 Å²	105	143.5 Å²	143.5	73%	0.734	80%	0.804	S	S	*	*			trans	-171	105.8	163.1	-161.7	0	0	0	0	106.3
1006	S	34.4	Very low	36.2	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	80%	0.796	S	S	*	*				84.6	128.9	76.6	87.6	0	0	0	0	114
1007	M	34.3	Very low	35.4	Very low	187 Å²	187	137.9 Å²	137.9	92%	0.921	79%	0.79	S	S	*	*				173.4	142.8	129.9	-91	-171.6	85.9	0	0	110.4
1008	E	33.3	Very low	34.8	Very low	175 Å²	175	146.3 Å²	146.3	82%	0.818	81%	0.805	S	S	*	*			trans	-101.7	163.7	178.9	-58.8	167.1	102.4	0	0	111.6
1009	S	32.8	Very low	34.2	Very low	127 Å²	127	144.9 Å²	144.9	89%	0.888	81%	0.808	S	S	*	*			trans	-165.3	146.9	143.1	-85.1	0	0	0	0	111.5
1010	T	31.8	Very low	33.6	Very low	113 Å²	113	143 Å²	143	69%	0.693	80%	0.801	S	S	*	*			trans	-136.4	139.4	-166.9	-55	0	0	0	0	111.1	V1012	T1010-V1012 HydrophobicContact CG2-CG2 3.79Å
1011	M	30.5	Very low	33	Very low	196 Å²	196	142.4 Å²	142.4	97%	0.966	80%	0.804	S	S	*	*			trans	-140.4	149.8	157.4	-78.3	-158	170.7	0	0	110.7
1012	V	32	Very low	32.8	Very low	101 Å²	101	141.3 Å²	141.3	61%	0.612	80%	0.802	S	S	*	*			trans	-140.8	164.8	-165.3	-170.4	0	0	0	0	110.3	T1010	T1010-V1012 HydrophobicContact CG2-CG2 3.79Å
1013	Y	32.4	Very low	32.2	Very low	220 Å²	220	139.7 Å²	139.7	86%	0.863	79%	0.79	S	S	*	*			trans	101.2	134.1	164.4	-60.5	-67.8	0	0	0	116
1014	S	30.8	Very low	32.2	Very low	96 Å²	96	142.1 Å²	142.1	67%	0.671	79%	0.79	S	S	*	*			cis	-159.1	142.8	0.4	49.7	0	0	0	0	114.3
1015	C	28.8	Very low	32.3	Very low	125 Å²	125	140.3 Å²	140.3	85%	0.845	78%	0.784	S	S	*	*			trans	59.8	149	150.7	-67.8	0	0	0	0	119.5
1016	S	29.2	Very low	32.3	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	81%	0.811	S	S	*	*			cis	-140.1	157.2	16.2	-60.1	0	0	0	0	113.7
1017	S	32.4	Very low	32.2	Very low	109 Å²	109	149.3 Å²	149.3	76%	0.762	82%	0.815	S	S	*	*			trans	34.1	102.4	149.8	56.4	0	0	0	0	118.5
1018	R	30.3	Very low	32.1	Very low	230 Å²	230	147.3 Å²	147.3	87%	0.868	81%	0.81	S	S	*	*				68	93	57.7	-162.6	-172.9	-169.7	179.9	4.7	114.4	V1020	R1018-V1020 HydrophobicContact CG-CG2 4.03Å
1019	S	28.6	Very low	32	Very low	121 Å²	121	145.7 Å²	145.7	85%	0.846	81%	0.809	S	S	*	*			trans	-116	142.3	136.9	50	0	0	0	0	107.7
1020	V	31.4	Very low	32	Very low	101 Å²	101	146.8 Å²	146.8	61%	0.612	81%	0.805	S	S	*	*			trans	-113.2	147.1	-178.9	171.1	0	0	0	0	108.7	R1018	R1018-V1020 HydrophobicContact CG-CG2 4.03Å
1021	V	35.7	Very low	32	Very low	134 Å²	134	148.9 Å²	148.9	81%	0.812	81%	0.811	S	S	*	*			trans	-101.8	136.4	175.7	177.4	0	0	0	0	108.6
1022	E	32.8	Very low	32.1	Very low	175 Å²	175	145.8 Å²	145.8	82%	0.818	80%	0.801	S	S	*	*			trans	-172.4	142.7	159.6	-105.3	153.8	-163.1	0	0	107.1
1023	S	30.8	Very low	32.1	Very low	89 Å²	89	149 Å²	149	62%	0.622	82%	0.815	S	S	*	*			cis	-166.2	158.4	-15.9	42.7	0	0	0	0	110.2
1024	D	34.3	Very low	32.1	Very low	149 Å²	149	143.5 Å²	143.5	80%	0.797	81%	0.811	S	S	*	*			trans	21.6	127.8	142.3	-44.1	-27.5	0	0	0	120.4
1025	E	36.8	Very low	32.2	Very low	185 Å²	185	147.5 Å²	147.5	86%	0.864	82%	0.823	S	S	*	*				-166	146.7	99.9	-101.8	-173	167.2	0	0	111.9
1026	L	34.6	Very low	32.5	Very low	248 Å²	248	149.5 Å²	149.5	100%	1.298	82%	0.821	S	S	*	*			trans	61.7	0	172.9	-66.6	167.6	0	0	0	118.7

Retrieved 1,026 of 1,026 residues in 428.3 ms (Link to these results)

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