A0A087X8L5_POEFO Loading...

DNA replication licensing factor MCM3

Acts as component of the MCM2-7 complex (MCM complex) which is the replicative helicase essential for 'once per cell cycle' DNA replication initiation and elongation in eukaryotic cells. The active ATPase sites in the MCM2-7 ring are formed through the interaction surfaces of two neighboring subunits such that a critical structure of a conserved arginine finger motif is provided in trans relative to the ATP-binding site of the Walker A box of the adjacent subunit. The six ATPase active sites, however, are likely to contribute differentially to the complex helicase activity.

AlphaFold DB , UniProt , Accession A0A087X8L5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 815 aa.

						>A0A087X8L5_POEFO|A0A087X8L5
MATDTADDREMREAQRDYLDFLDDDQDQGIYQSKVRDMISENKARLIVNINDLRRRNETRAAKLMSNAFEELLAFQRALKDLVASVDGTYAKQHEEFFIGLEGSFGSKHVSPRTLTSRLLGSMVCVEGIITKCSLVRPKVVRSVHYCPATKKTMERKYTDMTSLDAFPSSAIYPTKDEENNPLETEFGLSIYKDHQTITVQEMPEKAPAGQLPRSVDIILDNDLVDVVKPGDRVQVIGTYRCLPGKKGGFTSGTFRTIMIACHVKQMSKEVSQSFSADDVAKIRNFSRTRSVNVFNQLARSLAPSIHGHDYIKKAILCMLLGGVEKVLENGTRIRGDINVLLIGDPSVAKSQLLRYVLHTAPRAIPTTGRGSSGVGLTAAVTTDQETGERRLEAGAMVLADRGVVCIDEFDKMSDMDRTAIHEVMEQGRVTIAKAGIHARLNARCSVLAAANPVYGRYNQYKTPMENIGLQDSLLSRFDLLFIMLDQMDPEQDREISDHVLRMHRYRDSREQEGAAMTLGGSVDVLATDDPDAMTEEHEELQIYEKHNNLLHGSKKKKDKILSKEFMRKYIHIAKIITPVLTEEAANHIAEEYSRLRSQEQLAADIARTSPVTARTLETLIRLSTAHAKARMSKAVELEDTEVAVELVQFAYFKKVLEKEKKRTRQDRDSDSEEDDDEEAPPSQRSQRTRKRGRQGSQSSEPYSPYDFSEEQDVPEIQAGTPKPAKPQQQEEEPMEAISQAEGGEPSAERLKEFKSSLFAVFQSAHAQSVKMTKLMDEINKERESRFTEREVRAALARMQDDNQVMVADDIIFLI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.9	Very low	57.3	Low	183 Å²	183	97.5 Å²	97.5	90%	0.901	53%	0.531	S	S	*	.				0	-58.4	0	-72.9	-166.6	-176.2	0	0	112.9	D4 T5	M1-D4 WeakPolarHBondContact CA-OD2 3.32Å; M1-D4 PolarHBondContact N-OD1 3.4Å; M1-D4 PolarHBondContact N-OD2 3.21Å; M1-T5 PolarHBondContact O-OG1 3.29Å
2	A	32.9	Very low	59.4	Low	87 Å²	87	101.6 Å²	101.6	72%	0.719	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-25.9	176.1	0	0	0	0	0	113.5	T5	A2-T5 PolarHBondContact O-OG1 2.95Å; A2-T5 VanDerWaalsContact O-OG1 3.05Å
3	T	43.4	Very low	61.4	Low	91 Å²	91	99.6 Å²	99.6	56%	0.558	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-50.4	169	42.9	0	0	0	0	111	T5 A6 D7	T3-T5 PolarHBondContact O-N 3.04Å; T3-A6 WeakPolarHBondContact O-CA 3.29Å; T3-A6 WeakPolarHBondContact O-CB 3.32Å; T3-A6 PolarHBondContact O-N 2.65Å; T3-D7 PolarHBondContact O-N 3.09Å
4	D	47.3	Very low	62.9	Low	87 Å²	87	92.7 Å²	92.7	47%	0.465	48%	0.484	S	S	.	.	H	α-helix	trans	-56.4	-34.1	-175.2	-31.2	-14.8	0	0	0	111.8	M1 D8	M1-D4 WeakPolarHBondContact CA-OD2 3.32Å; M1-D4 PolarHBondContact N-OD1 3.4Å; M1-D4 PolarHBondContact N-OD2 3.21Å; D4-D8 VanDerWaalsContact O-CB 3.28Å; D4-D8 WeakPolarHBondContact O-CB 3.42Å; D4-D8 PolarHBondContact O-N 3.5Å
5	T	51.4	Low	64.6	Low	97 Å²	97	89.4 Å²	89.4	60%	0.595	47%	0.465	S	S	*	.	H	α-helix	trans	-73.9	-21	175.9	48.7	0	0	0	0	115.1	M1 A2 T3	M1-T5 PolarHBondContact O-OG1 3.29Å; A2-T5 PolarHBondContact O-OG1 2.95Å; A2-T5 VanDerWaalsContact O-OG1 3.05Å; T3-T5 PolarHBondContact O-N 3.04Å
6	A	52.8	Low	66	Low	46 Å²	46	94.5 Å²	94.5	38%	0.38	48%	0.477	S	S	.	.	H	α-helix	trans	-81.9	-45.9	171.7	0	0	0	0	0	110	T3 D8 R9 E10	T3-A6 WeakPolarHBondContact O-CA 3.29Å; T3-A6 WeakPolarHBondContact O-CB 3.32Å; T3-A6 PolarHBondContact O-N 2.65Å; A6-D8 VanDerWaalsContact C-N 3.34Å; A6-D8 PolarHBondContact O-N 3.02Å; A6-R9 WeakPolarHBondContact O-CA 3.35Å; A6-R9 WeakPolarHBondContact O-CB 3.25Å; A6-R9 PolarHBondContact O-N 3.06Å; A6-E10 PolarHBondContact O-N 3.07Å
7	D	61	Low	67.2	Low	94 Å²	94	92 Å²	92	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-60.3	-43.2	177.8	-52.2	-30.3	0	0	0	111	T3 R9 E10 M11	T3-D7 PolarHBondContact O-N 3.09Å; D7-R9 PolarHBondContact O-N 3.35Å; D7-E10 PolarHBondContact O-N 3.14Å; D7-M11 WeakPolarHBondContact O-CB 3.41Å; D7-M11 WeakPolarHBondContact O-CG 3.25Å; D7-M11 PolarHBondContact O-N 2.82Å
8	D	69.2	Low	68.3	Low	78 Å²	78	86.9 Å²	86.9	42%	0.417	44%	0.439	S	S	.	.	H	α-helix	trans	-60.8	-28.5	173.4	-116.8	29.8	0	0	0	113.6	D4 A6 R12	D4-D8 VanDerWaalsContact O-CB 3.28Å; D4-D8 WeakPolarHBondContact O-CB 3.42Å; D4-D8 PolarHBondContact O-N 3.5Å; A6-D8 VanDerWaalsContact C-N 3.34Å; A6-D8 PolarHBondContact O-N 3.02Å; D8-R12 VanDerWaalsContact O-CG 3.29Å; D8-R12 WeakPolarHBondContact O-CG 3.21Å; D8-R12 PolarHBondContact O-N 3.29Å; D8-R12 PolarHBondContact O-NE 3.01Å; D8-R12 IonicContact OD2-CZ 3.65Å; D8-R12 IonicContact OD2-NH2 2.74Å; D8-R12 PolarHBondContact OD2-NH2 3.37Å
9	R	77.5	Confident	69.4	Low	166 Å²	166	85.3 Å²	85.3	63%	0.626	43%	0.432	S	S	*	.	H	α-helix	trans	-81.4	-46.5	179.2	-178.2	179	174.5	163.6	1.6	110.5	A6 D7 M11 R12 E13	A6-R9 WeakPolarHBondContact O-CA 3.35Å; A6-R9 WeakPolarHBondContact O-CB 3.25Å; A6-R9 PolarHBondContact O-N 3.06Å; D7-R9 PolarHBondContact O-N 3.35Å; R9-M11 VanDerWaalsContact C-N 3.28Å; R9-M11 PolarHBondContact O-N 3.13Å; R9-R12 PolarHBondContact O-N 3.27Å; R9-R12 VanDerWaalsContact O-N 3.15Å; R9-E13 WeakPolarHBondContact CG-OE1 3.45Å; R9-E13 IonicContact CZ-OE1 3.92Å; R9-E13 IonicContact NE-OE1 2.85Å; R9-E13 PolarHBondContact NE-OE1 3.13Å; R9-E13 IonicContact NH2-OE1 2.97Å; R9-E13 WeakPolarHBondContact O-CG 3.38Å; R9-E13 PolarHBondContact O-N 3Å
10	E	75.9	Confident	70.1	Confident	101 Å²	101	85.6 Å²	85.6	47%	0.472	43%	0.434	S	S	.	.	H	α-helix	trans	-60.8	-37.6	175.4	-70.6	-157.3	-154.8	0	0	111.8	A6 D7 E13 A14 K63	A6-E10 PolarHBondContact O-N 3.07Å; D7-E10 PolarHBondContact O-N 3.14Å; E10-E13 PolarHBondContact O-N 3.32Å; E10-A14 WeakPolarHBondContact O-CB 3.39Å; E10-A14 PolarHBondContact O-N 2.94Å; E10-K63 IonicContact OE2-NZ 3.35Å; E10-K63 PolarHBondContact OE2-NZ 3.09Å
11	M	77.1	Confident	70.8	Confident	42 Å²	42	81.6 Å²	81.6	21%	0.207	41%	0.414	C	S	.	.	H	α-helix	trans	-63.9	-39.2	173.3	-82.7	-119.4	-80.8	0	0	113.4	D7 R9 A14 Q15 E70 L73	D7-M11 WeakPolarHBondContact O-CB 3.41Å; D7-M11 WeakPolarHBondContact O-CG 3.25Å; D7-M11 PolarHBondContact O-N 2.82Å; R9-M11 VanDerWaalsContact C-N 3.28Å; R9-M11 PolarHBondContact O-N 3.13Å; M11-A14 PolarHBondContact O-N 3.12Å; M11-Q15 WeakPolarHBondContact O-CB 3.47Å; M11-Q15 PolarHBondContact O-N 3.32Å; M11-E70 HydrophobicContact SD-CB 4.45Å; M11-L73 HydrophobicContact CE-CD2 4.45Å
12	R	83.1	Confident	72.7	Confident	147 Å²	147	72.9 Å²	72.9	56%	0.555	37%	0.371	S	S	*	.	H	α-helix	trans	-72.6	-34.1	175.9	-72.8	176.5	-137.6	176.9	3	112.6	D8 R9 R16	D8-R12 VanDerWaalsContact O-CG 3.29Å; D8-R12 WeakPolarHBondContact O-CG 3.21Å; D8-R12 PolarHBondContact O-N 3.29Å; D8-R12 PolarHBondContact O-NE 3.01Å; D8-R12 IonicContact OD2-CZ 3.65Å; D8-R12 IonicContact OD2-NH2 2.74Å; D8-R12 PolarHBondContact OD2-NH2 3.37Å; R9-R12 PolarHBondContact O-N 3.27Å; R9-R12 VanDerWaalsContact O-N 3.15Å; R12-R16 WeakPolarHBondContact O-CG 3.31Å; R12-R16 PolarHBondContact O-N 2.96Å
13	E	84.9	Confident	74.8	Confident	76 Å²	76	73 Å²	73	36%	0.355	36%	0.36	S	S	.	.	H	α-helix	trans	-66.4	-43.4	172.8	-71.1	171.4	-171.4	0	0	109.7	R9 E10 R16 D17	R9-E13 WeakPolarHBondContact CG-OE1 3.45Å; R9-E13 IonicContact CZ-OE1 3.92Å; R9-E13 IonicContact NE-OE1 2.85Å; R9-E13 PolarHBondContact NE-OE1 3.13Å; R9-E13 IonicContact NH2-OE1 2.97Å; R9-E13 WeakPolarHBondContact O-CG 3.38Å; R9-E13 PolarHBondContact O-N 3Å; E10-E13 PolarHBondContact O-N 3.32Å; E13-R16 PolarHBondContact O-N 3.21Å; E13-D17 VanDerWaalsContact O-CG 3.22Å; E13-D17 PolarHBondContact O-N 3.34Å
14	A	83	Confident	75.9	Confident	3 Å²	3	69.2 Å²	69.2	3%	0.025	34%	0.336	C	S	.	.	H	α-helix	trans	-59.7	-47.4	172.6	0	0	0	0	0	112.9	E10 M11 R16 D17 Y18 A74	E10-A14 WeakPolarHBondContact O-CB 3.39Å; E10-A14 PolarHBondContact O-N 2.94Å; M11-A14 PolarHBondContact O-N 3.12Å; A14-R16 PolarHBondContact O-N 3.26Å; A14-D17 PolarHBondContact O-N 3.47Å; A14-Y18 HydrophobicContact CB-CD2 4.44Å; A14-Y18 HydrophobicContact CB-CE2 4.16Å; A14-Y18 WeakPolarHBondContact O-CD2 3.39Å; A14-Y18 PolarHBondContact O-N 3Å; A14-A74 HydrophobicContact CB-CB 3.97Å
15	Q	87.8	Confident	76.4	Confident	43 Å²	43	71.1 Å²	71.1	20%	0.201	35%	0.346	C	S	.	.	H	α-helix	trans	-58.5	-34.7	178.8	-175.7	178.2	-6.3	0	0	112.4	M11 L19 R77 A78 D81	M11-Q15 WeakPolarHBondContact O-CB 3.47Å; M11-Q15 PolarHBondContact O-N 3.32Å; Q15-L19 WeakPolarHBondContact O-CB 3.23Å; Q15-L19 PolarHBondContact O-N 3.34Å; Q15-R77 HydrophobicContact CG-CB 4.39Å; Q15-A78 HydrophobicContact CG-CB 4.1Å; Q15-A78 WeakPolarHBondContact O-CB 3.32Å; Q15-D81 PolarHBondContact NE2-OD2 3.36Å
16	R	87.1	Confident	76.7	Confident	171 Å²	171	75.2 Å²	75.2	65%	0.645	36%	0.358	S	S	*	.	H	α-helix	trans	-71.8	-50.1	174.6	-72.5	172.6	178.6	-174.2	-2.5	112	R12 E13 A14 Y18 L19 D20	R12-R16 WeakPolarHBondContact O-CG 3.31Å; R12-R16 PolarHBondContact O-N 2.96Å; E13-R16 PolarHBondContact O-N 3.21Å; A14-R16 PolarHBondContact O-N 3.26Å; R16-Y18 PolarHBondContact O-N 2.99Å; R16-Y18 VanDerWaalsContact O-N 3.16Å; R16-L19 WeakPolarHBondContact O-CB 3.41Å; R16-L19 PolarHBondContact O-N 2.88Å; R16-D20 PolarHBondContact O-N 2.96Å
17	D	86.5	Confident	76.9	Confident	52 Å²	52	78 Å²	78	28%	0.278	37%	0.367	S	S	.	.	H	α-helix	trans	-56.6	-34.3	178.6	-60.8	-17.9	0	0	0	111.7	E13 A14 F21 R60	E13-D17 VanDerWaalsContact O-CG 3.22Å; E13-D17 PolarHBondContact O-N 3.34Å; A14-D17 PolarHBondContact O-N 3.47Å; D17-F21 WeakPolarHBondContact O-CB 3.45Å; D17-F21 PolarHBondContact O-N 3.36Å; D17-F21 VanDerWaalsContact O-N 3.12Å; D17-R60 HydrophobicContact CB-CG 4.42Å; D17-R60 IonicContact OD2-CZ 3.64Å; D17-R60 IonicContact OD2-NE 2.84Å; D17-R60 PolarHBondContact OD2-NE 2.96Å; D17-R60 IonicContact OD2-NH2 3.54Å; D17-R60 PolarHBondContact OD2-NH2 3.26Å
18	Y	87.6	Confident	76.9	Confident	1 Å²	1	81.6 Å²	81.6	0%	0.004	38%	0.381	C	S	.	.	H	α-helix	trans	-77.5	-33	173.8	-71.8	-51.9	0	0	0	114.6	A14 R16 F21 L22 L53 E71 A74 F75	A14-Y18 HydrophobicContact CB-CD2 4.44Å; A14-Y18 HydrophobicContact CB-CE2 4.16Å; A14-Y18 WeakPolarHBondContact O-CD2 3.39Å; A14-Y18 PolarHBondContact O-N 3Å; R16-Y18 PolarHBondContact O-N 2.99Å; R16-Y18 VanDerWaalsContact O-N 3.16Å; Y18-F21 PolarHBondContact O-N 3.49Å; Y18-L22 WeakPolarHBondContact O-CG 3.22Å; Y18-L22 PolarHBondContact O-N 3.44Å; Y18-L53 HydrophobicContact CD1-CD1 4.41Å; Y18-L53 HydrophobicContact CE1-CD1 4.13Å; Y18-L53 HydrophobicContact CE1-CD2 4.22Å; Y18-E71 WeakPolarHBondContact CE2-OE2 3.2Å; Y18-E71 VanDerWaalsContact CZ-OE2 3.26Å; Y18-E71 PolarHBondContact OH-OE2 2.95Å; Y18-A74 HydrophobicContact CD2-CB 4.42Å; Y18-A74 HydrophobicContact CE2-CB 4.42Å; Y18-F75 HydrophobicContact CD1-CB 4.43Å; Y18-F75 HydrophobicContact CD1-CD1 4.3Å; Y18-F75 AromaticContact CD1-CD2 3.59Å; Y18-F75 HydrophobicContact CD1-CD2 3.59Å; Y18-F75 HydrophobicContact CD1-CE1 4.43Å; Y18-F75 AromaticContact CD1-CE2 3.7Å; Y18-F75 HydrophobicContact CD1-CE2 3.7Å; Y18-F75 AromaticContact CD1-CG 3.88Å; Y18-F75 HydrophobicContact CD1-CG 3.88Å; Y18-F75 HydrophobicContact CD1-CZ 4.13Å; Y18-F75 HydrophobicContact CD2-CB 3.88Å; Y18-F75 HydrophobicContact CD2-CD2 4.16Å; Y18-F75 HydrophobicContact CD2-CG 4.19Å; Y18-F75 HydrophobicContact CE1-CD1 4.34Å; Y18-F75 HydrophobicContact CE1-CD2 4.38Å; Y18-F75 HydrophobicContact CE1-CG 4.23Å; Y18-F75 HydrophobicContact CE2-CB 4.09Å; Y18-F75 HydrophobicContact CG-CB 4.11Å; Y18-F75 AromaticContact CG-CD2 3.5Å; Y18-F75 HydrophobicContact CG-CD2 3.5Å; Y18-F75 VanDerWaalsContact CG-CD2 3.5Å; Y18-F75 AromaticContact CG-CE2 3.99Å; Y18-F75 HydrophobicContact CG-CE2 3.99Å; Y18-F75 AromaticContact CG-CG 3.9Å; Y18-F75 HydrophobicContact CG-CG 3.9Å
19	L	87.5	Confident	76.9	Confident	56 Å²	56	78.9 Å²	78.9	29%	0.293	37%	0.371	S	S	.	.	H	α-helix	trans	-65.6	-47	173.8	-175.6	65.6	0	0	0	109.5	Q15 R16 F21 L22 D23 A78 L82	Q15-L19 WeakPolarHBondContact O-CB 3.23Å; Q15-L19 PolarHBondContact O-N 3.34Å; R16-L19 WeakPolarHBondContact O-CB 3.41Å; R16-L19 PolarHBondContact O-N 2.88Å; L19-F21 VanDerWaalsContact C-N 3.27Å; L19-F21 PolarHBondContact O-N 3.01Å; L19-L22 PolarHBondContact O-N 3.19Å; L19-D23 WeakPolarHBondContact O-CB 3.42Å; L19-D23 PolarHBondContact O-N 3.23Å; L19-A78 HydrophobicContact CB-CB 4.38Å; L19-L82 HydrophobicContact CD1-CB 4.03Å; L19-L82 HydrophobicContact CD1-CD1 4.05Å
20	D	85	Confident	77	Confident	91 Å²	91	74.1 Å²	74.1	49%	0.487	36%	0.358	S	S	.	.	H	α-helix	trans	-57.3	-41.6	174.2	-65.5	-7.2	0	0	0	110.9	R16 L22 D23 R56	R16-D20 PolarHBondContact O-N 2.96Å; D20-L22 VanDerWaalsContact C-N 3.34Å; D20-L22 PolarHBondContact O-N 3.35Å; D20-D23 PolarHBondContact O-N 2.91Å; D20-R56 VanDerWaalsContact O-CZ 3.22Å; D20-R56 PolarHBondContact O-NH1 3.42Å; D20-R56 PolarHBondContact O-NH2 3.25Å
21	F	84.3	Confident	77.2	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.009	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-38.1	174.1	174.5	-95.4	0	0	0	113.3	D17 Y18 L19 Y31 V48 D52 L53 R56 F75	D17-F21 WeakPolarHBondContact O-CB 3.45Å; D17-F21 PolarHBondContact O-N 3.36Å; D17-F21 VanDerWaalsContact O-N 3.12Å; Y18-F21 PolarHBondContact O-N 3.49Å; L19-F21 VanDerWaalsContact C-N 3.27Å; L19-F21 PolarHBondContact O-N 3.01Å; F21-Y31 HydrophobicContact CE1-CE2 4.28Å; F21-Y31 HydrophobicContact CZ-CD2 4.39Å; F21-Y31 AromaticContact CZ-CE2 3.84Å; F21-Y31 HydrophobicContact CZ-CE2 3.84Å; F21-V48 HydrophobicContact CE1-CG1 3.73Å; F21-V48 HydrophobicContact CZ-CG1 4.05Å; F21-D52 HydrophobicContact CE2-CB 4.2Å; F21-D52 HydrophobicContact CZ-CB 4.21Å; F21-L53 HydrophobicContact CD1-CD1 4.44Å; F21-L53 HydrophobicContact CD2-CD1 3.81Å; F21-L53 HydrophobicContact CE2-CB 4.12Å; F21-L53 HydrophobicContact CE2-CD1 4.06Å; F21-L53 HydrophobicContact CG-CD1 4.03Å; F21-L53 HydrophobicContact CZ-CB 4.28Å; F21-L53 HydrophobicContact CZ-CD1 4.47Å; F21-R56 HydrophobicContact CD2-CB 4.36Å; F21-R56 PolarHBondContact O-NH1 3.35Å; F21-R56 VanDerWaalsContact O-NH1 3.14Å; F21-F75 HydrophobicContact CD1-CE2 4.26Å; F21-F75 HydrophobicContact CD1-CZ 4.07Å; F21-F75 HydrophobicContact CE1-CZ 4.15Å
22	L	82.1	Confident	77.5	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-82.6	-28.1	-178.7	-69.1	172	0	0	0	113.5	Y18 L19 D20 D24 L46 F75 L79 L82	Y18-L22 WeakPolarHBondContact O-CG 3.22Å; Y18-L22 PolarHBondContact O-N 3.44Å; L19-L22 PolarHBondContact O-N 3.19Å; D20-L22 VanDerWaalsContact C-N 3.34Å; D20-L22 PolarHBondContact O-N 3.35Å; L22-D24 PolarHBondContact O-N 3.47Å; L22-L46 HydrophobicContact CD2-CD2 3.91Å; L22-F75 HydrophobicContact CD1-CD2 4.4Å; L22-F75 HydrophobicContact CD1-CE2 3.91Å; L22-F75 HydrophobicContact CD2-CE2 4.12Å; L22-F75 HydrophobicContact CD2-CZ 4.45Å; L22-F75 HydrophobicContact CG-CE2 3.98Å; L22-L79 HydrophobicContact CD1-CB 4.14Å; L22-L79 HydrophobicContact CD1-CD1 4.23Å; L22-L82 HydrophobicContact CB-CD1 4.16Å; L22-L82 HydrophobicContact CB-CD2 3.94Å; L22-L82 HydrophobicContact CD1-CD2 4.44Å
23	D	76.4	Confident	77.5	Confident	89 Å²	89	65.1 Å²	65.1	48%	0.476	33%	0.327	S	S	.	.			trans	-80.8	40.4	-178.2	-157.2	25.1	0	0	0	112.7	L19 D20 D25 L82	L19-D23 WeakPolarHBondContact O-CB 3.42Å; L19-D23 PolarHBondContact O-N 3.23Å; D20-D23 PolarHBondContact O-N 2.91Å; D23-D25 PolarHBondContact O-N 3.05Å; D23-L82 HydrophobicContact CB-CD1 4.31Å
24	D	66.1	Low	77.5	Confident	12 Å²	12	64.8 Å²	64.8	6%	0.064	32%	0.324	C	S	.	.			trans	-80.5	76.3	-164.5	-150.6	-25.5	0	0	0	114.2	L22 Q26 D27 G29 R56	L22-D24 PolarHBondContact O-N 3.47Å; D24-Q26 VanDerWaalsContact C-N 3.26Å; D24-Q26 PolarHBondContact O-N 3.12Å; D24-Q26 PolarHBondContact OD1-N 2.85Å; D24-D27 PolarHBondContact OD1-N 3Å; D24-G29 WeakPolarHBondContact O-CA 3.32Å; D24-G29 PolarHBondContact O-N 3.35Å; D24-R56 IonicContact OD1-NH1 2.67Å; D24-R56 IonicContact OD2-CZ 2.72Å; D24-R56 IonicContact OD2-NH1 2.82Å; D24-R56 PolarHBondContact OD2-NH1 3.42Å
25	D	58.7	Low	77.6	Confident	126 Å²	126	64.7 Å²	64.7	67%	0.674	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-11.7	172.8	-96.1	-0	0	0	0	113.6	D23 Q32	D23-D25 PolarHBondContact O-N 3.05Å; D25-Q32 PolarHBondContact OD1-NE2 3.05Å
26	Q	58.2	Low	77.5	Confident	183 Å²	183	69.9 Å²	69.9	86%	0.855	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-41.1	-172.3	-62.7	-172.6	18	0	0	112.9	D24 Q28	D24-Q26 VanDerWaalsContact C-N 3.26Å; D24-Q26 PolarHBondContact O-N 3.12Å; D24-Q26 PolarHBondContact OD1-N 2.85Å; Q26-Q28 PolarHBondContact O-N 2.71Å
27	D	55.5	Low	77.5	Confident	104 Å²	104	65.9 Å²	65.9	56%	0.556	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	61.2	-179.5	-70.7	-48.1	0	0	0	112.2	D24 G29	D24-D27 PolarHBondContact OD1-N 3Å; D27-G29 PolarHBondContact O-N 2.77Å
28	Q	61.1	Low	77.3	Confident	170 Å²	170	63.7 Å²	63.7	79%	0.794	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	2	166.6	-45.9	166.1	32.7	0	0	117.6	Q26 I30	Q26-Q28 PolarHBondContact O-N 2.71Å; Q28-I30 HydrophobicContact CB-CD1 4.2Å; Q28-I30 HydrophobicContact CB-CG1 4.01Å; Q28-I30 PolarHBondContact O-N 3.45Å; Q28-I30 VanDerWaalsContact O-N 3.15Å
29	G	69.2	Low	77.3	Confident	21 Å²	21	65.2 Å²	65.2	22%	0.216	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	14.2	171.5	0	0	0	0	0	115.9	D24 D27 Y31 Q32 S33	D24-G29 WeakPolarHBondContact O-CA 3.32Å; D24-G29 PolarHBondContact O-N 3.35Å; D27-G29 PolarHBondContact O-N 2.77Å; G29-Y31 VanDerWaalsContact C-N 3.3Å; G29-Y31 PolarHBondContact O-N 3.04Å; G29-Q32 PolarHBondContact O-N 2.73Å; G29-S33 PolarHBondContact O-N 3.31Å
30	I	79.5	Confident	77.2	Confident	67 Å²	67	66.6 Å²	66.6	34%	0.344	34%	0.343	S	S	.	.	H	α-helix	trans	-60.6	-38.8	-173.4	-57.3	170.9	0	0	0	111.6	Q28 S33 K34	Q28-I30 HydrophobicContact CB-CD1 4.2Å; Q28-I30 HydrophobicContact CB-CG1 4.01Å; Q28-I30 PolarHBondContact O-N 3.45Å; Q28-I30 VanDerWaalsContact O-N 3.15Å; I30-S33 PolarHBondContact O-OG 2.89Å; I30-K34 HydrophobicContact CG2-CD 4.24Å; I30-K34 WeakPolarHBondContact O-CB 3.49Å; I30-K34 VanDerWaalsContact O-CG 3.29Å; I30-K34 WeakPolarHBondContact O-CG 3.45Å; I30-K34 PolarHBondContact O-N 3.27Å
31	Y	81.3	Confident	77.2	Confident	8 Å²	8	67.5 Å²	67.5	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-74.4	-36	-179.8	-73.2	-70	0	0	0	112.3	F21 G29 K34 V35 V48 N49 D52	F21-Y31 HydrophobicContact CE1-CE2 4.28Å; F21-Y31 HydrophobicContact CZ-CD2 4.39Å; F21-Y31 AromaticContact CZ-CE2 3.84Å; F21-Y31 HydrophobicContact CZ-CE2 3.84Å; G29-Y31 VanDerWaalsContact C-N 3.3Å; G29-Y31 PolarHBondContact O-N 3.04Å; Y31-K34 HydrophobicContact CD1-CD 4.13Å; Y31-K34 HydrophobicContact CE1-CD 4.2Å; Y31-K34 PolarHBondContact O-N 2.97Å; Y31-V35 WeakPolarHBondContact O-CB 3.42Å; Y31-V35 VanDerWaalsContact O-CG2 3.29Å; Y31-V35 WeakPolarHBondContact O-CG2 3.32Å; Y31-V35 PolarHBondContact O-N 3Å; Y31-V48 HydrophobicContact CE1-CB 4.39Å; Y31-V48 HydrophobicContact CE1-CG1 4.26Å; Y31-V48 HydrophobicContact CE1-CG2 4.2Å; Y31-N49 PolarHBondContact OH-N 2.84Å; Y31-D52 HydrophobicContact CE2-CB 4.32Å; Y31-D52 PolarHBondContact OH-OD2 2.66Å
32	Q	81.9	Confident	77.1	Confident	40 Å²	40	72.1 Å²	72.1	19%	0.187	37%	0.369	C	S	.	.	H	α-helix	trans	-64.4	-39.8	171.3	-67.2	-173.9	12.7	0	0	112.3	D25 G29 V35 R36	D25-Q32 PolarHBondContact OD1-NE2 3.05Å; G29-Q32 PolarHBondContact O-N 2.73Å; Q32-V35 PolarHBondContact O-N 3.5Å; Q32-R36 WeakPolarHBondContact O-CG 3.45Å; Q32-R36 PolarHBondContact O-N 3.09Å
33	S	84.4	Confident	77.1	Confident	52 Å²	52	76.5 Å²	76.5	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-47.3	175.8	77.2	0	0	0	0	110.9	G29 I30 V35 R36 D37	G29-S33 PolarHBondContact O-N 3.31Å; I30-S33 PolarHBondContact O-OG 2.89Å; S33-V35 VanDerWaalsContact C-N 3.26Å; S33-V35 PolarHBondContact O-N 3.27Å; S33-R36 PolarHBondContact O-N 3.27Å; S33-D37 VanDerWaalsContact O-CG 3.25Å; S33-D37 PolarHBondContact O-N 3.39Å
34	K	84.5	Confident	77.4	Confident	69 Å²	69	73.1 Å²	73.1	30%	0.3	37%	0.372	S	S	.	.	H	α-helix	trans	-56.9	-36.2	174.5	-74.5	172.8	177.4	178.8	0	113.1	I30 Y31 M38 L46	I30-K34 HydrophobicContact CG2-CD 4.24Å; I30-K34 WeakPolarHBondContact O-CB 3.49Å; I30-K34 VanDerWaalsContact O-CG 3.29Å; I30-K34 WeakPolarHBondContact O-CG 3.45Å; I30-K34 PolarHBondContact O-N 3.27Å; Y31-K34 HydrophobicContact CD1-CD 4.13Å; Y31-K34 HydrophobicContact CE1-CD 4.2Å; Y31-K34 PolarHBondContact O-N 2.97Å; K34-M38 VanDerWaalsContact O-CB 3.22Å; K34-M38 WeakPolarHBondContact O-CB 3.25Å; K34-M38 PolarHBondContact O-N 3.43Å; K34-L46 HydrophobicContact CB-CD1 3.85Å
35	V	85.6	Confident	78.4	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.012	37%	0.373	C	S	.	.	H	α-helix	trans	-70.7	-39.5	175.9	168.1	0	0	0	0	111.4	Y31 Q32 S33 M38 I39 L46 L79 L82 V83	Y31-V35 WeakPolarHBondContact O-CB 3.42Å; Y31-V35 VanDerWaalsContact O-CG2 3.29Å; Y31-V35 WeakPolarHBondContact O-CG2 3.32Å; Y31-V35 PolarHBondContact O-N 3Å; Q32-V35 PolarHBondContact O-N 3.5Å; S33-V35 VanDerWaalsContact C-N 3.26Å; S33-V35 PolarHBondContact O-N 3.27Å; V35-M38 HydrophobicContact CG1-CE 4.45Å; V35-M38 WeakPolarHBondContact O-CB 3.38Å; V35-M38 PolarHBondContact O-N 2.84Å; V35-I39 HydrophobicContact CG1-CD1 4.07Å; V35-I39 WeakPolarHBondContact O-CD1 3.28Å; V35-I39 VanDerWaalsContact O-CG1 3.26Å; V35-I39 WeakPolarHBondContact O-CG1 3.48Å; V35-I39 PolarHBondContact O-N 3.09Å; V35-L46 HydrophobicContact CG2-CD1 4.06Å; V35-L46 HydrophobicContact CG2-CD2 4Å; V35-L79 HydrophobicContact CG2-CD1 4.24Å; V35-L82 HydrophobicContact CG1-CD2 4.41Å; V35-L82 HydrophobicContact CG2-CD2 3.98Å; V35-V83 HydrophobicContact CG1-CG2 4.19Å
36	R	85.3	Confident	79.8	Confident	151 Å²	151	67.8 Å²	67.8	57%	0.57	34%	0.342	S	S	*	.	H	α-helix	trans	-64.1	-42.2	172.5	-68	173.6	-166.6	160.9	11.6	111.6	Q32 S33 I39 S40	Q32-R36 WeakPolarHBondContact O-CG 3.45Å; Q32-R36 PolarHBondContact O-N 3.09Å; S33-R36 PolarHBondContact O-N 3.27Å; R36-I39 PolarHBondContact O-N 3.44Å; R36-S40 PolarHBondContact O-N 3.46Å
37	D	86.1	Confident	81.2	Confident	87 Å²	87	62.4 Å²	62.4	47%	0.465	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-46.2	175.1	-64	-22.9	0	0	0	110.6	S33 I39 S40 E41	S33-D37 VanDerWaalsContact O-CG 3.25Å; S33-D37 PolarHBondContact O-N 3.39Å; D37-I39 VanDerWaalsContact C-N 3.34Å; D37-I39 PolarHBondContact O-N 3.26Å; D37-S40 WeakPolarHBondContact O-CA 3.47Å; D37-S40 WeakPolarHBondContact O-CB 3.24Å; D37-S40 PolarHBondContact O-N 3.14Å; D37-S40 PolarHBondContact O-OG 2.82Å; D37-E41 WeakPolarHBondContact O-CG 3.41Å; D37-E41 PolarHBondContact O-N 3.01Å
38	M	83.9	Confident	82.8	Confident	7 Å²	7	57.4 Å²	57.4	3%	0.034	29%	0.292	C	S	.	.	H	α-helix	trans	-56.7	-43.1	175.7	-179.3	-172.7	78	0	0	112.7	K34 V35 E41 N42 K43 L46 V83 F97	K34-M38 VanDerWaalsContact O-CB 3.22Å; K34-M38 WeakPolarHBondContact O-CB 3.25Å; K34-M38 PolarHBondContact O-N 3.43Å; V35-M38 HydrophobicContact CG1-CE 4.45Å; V35-M38 WeakPolarHBondContact O-CB 3.38Å; V35-M38 PolarHBondContact O-N 2.84Å; M38-E41 PolarHBondContact O-N 2.89Å; M38-N42 PolarHBondContact O-N 3.19Å; M38-N42 VanDerWaalsContact O-N 3.08Å; M38-K43 HydrophobicContact CG-CB 4.04Å; M38-K43 WeakPolarHBondContact CG-O 3.21Å; M38-K43 PolarHBondContact O-N 3.49Å; M38-L46 HydrophobicContact SD-CB 3.9Å; M38-L46 HydrophobicContact SD-CD1 4.43Å; M38-V83 HydrophobicContact CE-CG2 3.76Å; M38-F97 HydrophobicContact CE-CD1 4.49Å
39	I	85.9	Confident	84	Confident	32 Å²	32	50.2 Å²	50.2	16%	0.164	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-44	174.2	-66.2	162.8	0	0	0	110.1	V35 R36 D37 E41 N42 V86 Y90	V35-I39 HydrophobicContact CG1-CD1 4.07Å; V35-I39 WeakPolarHBondContact O-CD1 3.28Å; V35-I39 VanDerWaalsContact O-CG1 3.26Å; V35-I39 WeakPolarHBondContact O-CG1 3.48Å; V35-I39 PolarHBondContact O-N 3.09Å; R36-I39 PolarHBondContact O-N 3.44Å; D37-I39 VanDerWaalsContact C-N 3.34Å; D37-I39 PolarHBondContact O-N 3.26Å; I39-E41 VanDerWaalsContact C-N 3.32Å; I39-E41 PolarHBondContact O-N 3.05Å; I39-N42 PolarHBondContact O-N 3.44Å; I39-N42 VanDerWaalsContact O-N 3.13Å; I39-V86 HydrophobicContact CD1-CB 4.49Å; I39-V86 HydrophobicContact CD1-CG1 3.94Å; I39-Y90 HydrophobicContact CG1-CD1 3.81Å; I39-Y90 HydrophobicContact CG1-CE1 3.97Å; I39-Y90 HydrophobicContact CG2-CD1 4.4Å; I39-Y90 HydrophobicContact CG2-CG 4.4Å
40	S	86.8	Confident	84.7	Confident	85 Å²	85	49.3 Å²	49.3	59%	0.594	25%	0.249	S	C	*	.	H	α-helix	trans	-63.7	-35	178.8	82.2	0	0	0	0	113.3	R36 D37 N42	R36-S40 PolarHBondContact O-N 3.46Å; D37-S40 WeakPolarHBondContact O-CA 3.47Å; D37-S40 WeakPolarHBondContact O-CB 3.24Å; D37-S40 PolarHBondContact O-N 3.14Å; D37-S40 PolarHBondContact O-OG 2.82Å; S40-N42 VanDerWaalsContact C-N 3.33Å
41	E	84.1	Confident	85	Confident	110 Å²	110	47 Å²	47	51%	0.514	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.7	177	-66.7	-171.8	113.2	0	0	113.3	D37 M38 I39 K43	D37-E41 WeakPolarHBondContact O-CG 3.41Å; D37-E41 PolarHBondContact O-N 3.01Å; M38-E41 PolarHBondContact O-N 2.89Å; I39-E41 VanDerWaalsContact C-N 3.32Å; I39-E41 PolarHBondContact O-N 3.05Å; E41-K43 VanDerWaalsContact C-N 3.26Å; E41-K43 HydrophobicContact CB-CD 4.07Å; E41-K43 HydrophobicContact CB-CG 4.01Å; E41-K43 PolarHBondContact O-N 2.83Å; E41-K43 IonicContact OE1-NZ 3.25Å; E41-K43 PolarHBondContact OE1-NZ 3.38Å; E41-K43 WeakPolarHBondContact OE2-CD 3.25Å; E41-K43 VanDerWaalsContact OE2-CE 3.28Å; E41-K43 WeakPolarHBondContact OE2-CE 3.21Å; E41-K43 IonicContact OE2-NZ 2.69Å; E41-K43 PolarHBondContact OE2-NZ 2.93Å
42	N	83.4	Confident	85.1	Confident	99 Å²	99	48.3 Å²	48.3	53%	0.529	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	39.9	-172.6	-64.1	-81.1	0	0	0	113.8	M38 I39 S40 Y90	M38-N42 PolarHBondContact O-N 3.19Å; M38-N42 VanDerWaalsContact O-N 3.08Å; I39-N42 PolarHBondContact O-N 3.44Å; I39-N42 VanDerWaalsContact O-N 3.13Å; S40-N42 VanDerWaalsContact C-N 3.33Å; N42-Y90 WeakPolarHBondContact CA-OH 3.47Å; N42-Y90 HydrophobicContact CB-CE2 4.43Å
43	K	82.3	Confident	85.2	Confident	93 Å²	93	46.5 Å²	46.5	40%	0.404	24%	0.236	S	C	.	.			trans	-90.3	134.9	178.8	-72.8	176.6	-173.5	161.1	0	111.3	M38 E41 R45 Y90	M38-K43 HydrophobicContact CG-CB 4.04Å; M38-K43 WeakPolarHBondContact CG-O 3.21Å; M38-K43 PolarHBondContact O-N 3.49Å; E41-K43 VanDerWaalsContact C-N 3.26Å; E41-K43 HydrophobicContact CB-CD 4.07Å; E41-K43 HydrophobicContact CB-CG 4.01Å; E41-K43 PolarHBondContact O-N 2.83Å; E41-K43 IonicContact OE1-NZ 3.25Å; E41-K43 PolarHBondContact OE1-NZ 3.38Å; E41-K43 WeakPolarHBondContact OE2-CD 3.25Å; E41-K43 VanDerWaalsContact OE2-CE 3.28Å; E41-K43 WeakPolarHBondContact OE2-CE 3.21Å; E41-K43 IonicContact OE2-NZ 2.69Å; E41-K43 PolarHBondContact OE2-NZ 2.93Å; K43-R45 VanDerWaalsContact C-N 3.26Å; K43-R45 PolarHBondContact O-N 3.01Å; K43-Y90 PolarHBondContact N-OH 3.48Å; K43-Y90 PolarHBondContact O-OH 2.92Å; K43-Y90 VanDerWaalsContact O-OH 3.11Å
44	A	82	Confident	85.3	Confident	17 Å²	17	48.3 Å²	48.3	14%	0.14	24%	0.235	C	C	.	.	S	Bend	trans	-82.3	3.3	175.6	0	0	0	0	0	114	F97 F98	A44-F97 WeakPolarHBondContact O-CA 3.36Å; A44-F98 PolarHBondContact O-N 2.94Å
45	R	87.1	Confident	85.2	Confident	21 Å²	21	53.1 Å²	53.1	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.5	-171.8	-164.6	-178.3	-53.7	-121.7	-2.2	112.8	K43 F98 D221 D223 L224 C262	K43-R45 VanDerWaalsContact C-N 3.26Å; K43-R45 PolarHBondContact O-N 3.01Å; R45-F98 VanDerWaalsContact CA-O 3.29Å; R45-F98 WeakPolarHBondContact CA-O 3.36Å; R45-F98 HydrophobicContact CB-CB 4.28Å; R45-F98 HydrophobicContact CG-CB 3.98Å; R45-D221 PolarHBondContact NH2-O 2.73Å; R45-D223 VanDerWaalsContact CB-OD2 3.32Å; R45-D223 WeakPolarHBondContact CB-OD2 3.5Å; R45-D223 WeakPolarHBondContact CD-OD2 3.46Å; R45-D223 IonicContact CZ-OD1 3.78Å; R45-D223 VanDerWaalsContact CZ-OD1 3.25Å; R45-D223 IonicContact CZ-OD2 2.87Å; R45-D223 VanDerWaalsContact NE-CG 3.31Å; R45-D223 IonicContact NE-OD1 2.87Å; R45-D223 PolarHBondContact NE-OD1 3.15Å; R45-D223 IonicContact NE-OD2 2.91Å; R45-D223 PolarHBondContact NE-OD2 2.7Å; R45-D223 IonicContact NH2-OD1 3.95Å; R45-D223 PolarHBondContact NH2-OD1 3.07Å; R45-D223 IonicContact NH2-OD2 3.49Å; R45-L224 VanDerWaalsContact NH1-CD1 3.29Å; R45-C262 PolarHBondContact NH1-O 3.38Å
46	L	88.9	Confident	85	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139.7	172.3	-176.1	65.6	0	0	0	110.7	L22 K34 V35 M38 V48 L79 F98 I99 G100	L22-L46 HydrophobicContact CD2-CD2 3.91Å; K34-L46 HydrophobicContact CB-CD1 3.85Å; V35-L46 HydrophobicContact CG2-CD1 4.06Å; V35-L46 HydrophobicContact CG2-CD2 4Å; M38-L46 HydrophobicContact SD-CB 3.9Å; M38-L46 HydrophobicContact SD-CD1 4.43Å; L46-V48 HydrophobicContact CD2-CG2 3.97Å; L46-V48 HydrophobicContact CG-CG2 4.12Å; L46-L79 HydrophobicContact CB-CD1 4.47Å; L46-L79 HydrophobicContact CB-CD2 3.77Å; L46-L79 HydrophobicContact CD2-CD1 3.78Å; L46-L79 HydrophobicContact CD2-CD2 4.35Å; L46-F98 PolarHBondContact N-O 3.13Å; L46-F98 VanDerWaalsContact N-O 3.14Å; L46-I99 WeakPolarHBondContact O-CA 3.31Å; L46-G100 PolarHBondContact O-N 2.98Å
47	I	87.4	Confident	84.8	Confident	70 Å²	70	52.8 Å²	52.8	36%	0.359	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	116.1	173.1	-57.3	175.1	0	0	0	110	G100 E102	I47-G100 WeakPolarHBondContact CA-O 3.36Å; I47-E102 HydrophobicContact CG2-CB 4.02Å
48	V	87.4	Confident	84.8	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.1	-178.7	176.5	0	0	0	0	110.6	F21 Y31 L46 F75 I99 G100 L101 E102	F21-V48 HydrophobicContact CE1-CG1 3.73Å; F21-V48 HydrophobicContact CZ-CG1 4.05Å; Y31-V48 HydrophobicContact CE1-CB 4.39Å; Y31-V48 HydrophobicContact CE1-CG1 4.26Å; Y31-V48 HydrophobicContact CE1-CG2 4.2Å; L46-V48 HydrophobicContact CD2-CG2 3.97Å; L46-V48 HydrophobicContact CG-CG2 4.12Å; V48-F75 HydrophobicContact CB-CE1 4.33Å; V48-F75 HydrophobicContact CB-CZ 4.4Å; V48-F75 HydrophobicContact CG1-CE1 4.1Å; V48-F75 HydrophobicContact CG1-CZ 4Å; V48-F75 HydrophobicContact CG2-CE1 4.17Å; V48-F75 HydrophobicContact CG2-CZ 3.94Å; V48-I99 HydrophobicContact CB-CG2 4.21Å; V48-I99 HydrophobicContact CG2-CG2 3.87Å; V48-G100 PolarHBondContact N-O 2.74Å; V48-L101 HydrophobicContact CB-CD2 4.05Å; V48-L101 HydrophobicContact CG1-CD2 4.21Å; V48-L101 WeakPolarHBondContact O-CA 3.38Å; V48-E102 PolarHBondContact O-N 2.91Å
49	N	86.6	Confident	84.9	Confident	19 Å²	19	60.7 Å²	60.7	10%	0.102	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	124.3	175.7	-171.5	-3.2	0	0	0	110.5	Y31 N51 D52 L53 E102 G103	Y31-N49 PolarHBondContact OH-N 2.84Å; N49-N51 PolarHBondContact O-N 3.15Å; N49-N51 WeakPolarHBondContact OD1-CB 3.44Å; N49-N51 PolarHBondContact OD1-N 3.48Å; N49-N51 VanDerWaalsContact OD1-N 3.09Å; N49-D52 PolarHBondContact O-N 3.16Å; N49-L53 PolarHBondContact O-N 3.28Å; N49-E102 CarbonylContact C-O 3.47Å; N49-E102 WeakPolarHBondContact CA-O 3.38Å; N49-E102 PolarHBondContact OD1-O 3.43Å; N49-G103 VanDerWaalsContact OD1-CA 3.3Å; N49-G103 WeakPolarHBondContact OD1-CA 3.31Å
50	I	85.1	Confident	84.8	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-26.1	178.1	-68.7	-176.6	0	0	0	111.8	D52 L53 R54 M65 L101 E102 F105	I50-D52 VanDerWaalsContact C-N 3.33Å; I50-D52 PolarHBondContact O-N 2.89Å; I50-L53 PolarHBondContact O-N 3.49Å; I50-R54 HydrophobicContact CG2-CG 4.34Å; I50-R54 WeakPolarHBondContact O-CG 3.39Å; I50-R54 PolarHBondContact O-N 2.88Å; I50-M65 HydrophobicContact CD1-SD 4.4Å; I50-L101 HydrophobicContact CD1-CB 4.17Å; I50-L101 HydrophobicContact CD1-CD2 4.42Å; I50-L101 HydrophobicContact CG1-CB 4.28Å; I50-L101 HydrophobicContact CG1-CD2 3.89Å; I50-E102 PolarHBondContact N-O 3.46Å; I50-F105 HydrophobicContact CD1-CD1 4.2Å; I50-F105 HydrophobicContact CD1-CE1 3.32Å; I50-F105 HydrophobicContact CD1-CE2 4.13Å; I50-F105 HydrophobicContact CD1-CZ 3.27Å; I50-F105 HydrophobicContact CG1-CZ 4.39Å
51	N	85.1	Confident	84.6	Confident	20 Å²	20	56.2 Å²	56.2	11%	0.107	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-38.4	179.5	-63.9	-8.2	0	0	0	111.8	N49 R54 R55 S104 D530	N49-N51 PolarHBondContact O-N 3.15Å; N49-N51 WeakPolarHBondContact OD1-CB 3.44Å; N49-N51 PolarHBondContact OD1-N 3.48Å; N49-N51 VanDerWaalsContact OD1-N 3.09Å; N51-R54 WeakPolarHBondContact O-CB 3.42Å; N51-R54 PolarHBondContact O-N 3.35Å; N51-R55 WeakPolarHBondContact O-CG 3.29Å; N51-R55 PolarHBondContact O-N 3.2Å; N51-S104 PolarHBondContact OD1-N 3.05Å; N51-D530 PolarHBondContact ND2-OD1 3.49Å
52	D	84.2	Confident	84.7	Confident	35 Å²	35	53.7 Å²	53.7	19%	0.187	26%	0.262	C	S	.	.	H	α-helix	trans	-68.8	-41.2	176.4	-54.1	-25.4	0	0	0	110.3	F21 Y31 N49 I50 R54 R55 R56	F21-D52 HydrophobicContact CE2-CB 4.2Å; F21-D52 HydrophobicContact CZ-CB 4.21Å; Y31-D52 HydrophobicContact CE2-CB 4.32Å; Y31-D52 PolarHBondContact OH-OD2 2.66Å; N49-D52 PolarHBondContact O-N 3.16Å; I50-D52 VanDerWaalsContact C-N 3.33Å; I50-D52 PolarHBondContact O-N 2.89Å; D52-R54 VanDerWaalsContact C-N 3.27Å; D52-R54 PolarHBondContact O-N 3.33Å; D52-R55 WeakPolarHBondContact O-CB 3.36Å; D52-R55 PolarHBondContact O-N 3.27Å; D52-R55 VanDerWaalsContact O-N 3.17Å; D52-R55 IonicContact OD1-NH1 2.68Å; D52-R55 PolarHBondContact OD1-NH1 3.23Å; D52-R56 PolarHBondContact O-N 3.42Å
53	L	83.5	Confident	84.8	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-61.8	-35.2	174.3	-172.2	66.1	0	0	0	111.9	Y18 F21 N49 I50 N57 A61 L64	Y18-L53 HydrophobicContact CD1-CD1 4.41Å; Y18-L53 HydrophobicContact CE1-CD1 4.13Å; Y18-L53 HydrophobicContact CE1-CD2 4.22Å; F21-L53 HydrophobicContact CD1-CD1 4.44Å; F21-L53 HydrophobicContact CD2-CD1 3.81Å; F21-L53 HydrophobicContact CE2-CB 4.12Å; F21-L53 HydrophobicContact CE2-CD1 4.06Å; F21-L53 HydrophobicContact CG-CD1 4.03Å; F21-L53 HydrophobicContact CZ-CB 4.28Å; F21-L53 HydrophobicContact CZ-CD1 4.47Å; N49-L53 PolarHBondContact O-N 3.28Å; I50-L53 PolarHBondContact O-N 3.49Å; L53-N57 CarbonylContact O-C 3.53Å; L53-N57 VanDerWaalsContact O-C 3.22Å; L53-N57 WeakPolarHBondContact O-CA 3.45Å; L53-N57 PolarHBondContact O-N 2.65Å; L53-A61 HydrophobicContact CD2-CB 4.44Å; L53-A61 HydrophobicContact CG-CB 4.28Å; L53-L64 HydrophobicContact CD2-CD2 3.68Å
54	R	85.3	Confident	85	Confident	90 Å²	90	48.4 Å²	48.4	34%	0.34	23%	0.234	S	C	.	.	H	α-helix	trans	-67.8	-42.4	172.1	-75.8	-179.8	-177.3	145.6	10.3	112.9	I50 N51 D52 R56 E58 A61 S104	I50-R54 HydrophobicContact CG2-CG 4.34Å; I50-R54 WeakPolarHBondContact O-CG 3.39Å; I50-R54 PolarHBondContact O-N 2.88Å; N51-R54 WeakPolarHBondContact O-CB 3.42Å; N51-R54 PolarHBondContact O-N 3.35Å; D52-R54 VanDerWaalsContact C-N 3.27Å; D52-R54 PolarHBondContact O-N 3.33Å; R54-R56 VanDerWaalsContact C-N 3.3Å; R54-R56 PolarHBondContact O-N 2.76Å; R54-E58 PolarHBondContact O-N 2.84Å; R54-A61 HydrophobicContact CB-CB 4.46Å; R54-A61 HydrophobicContact CG-CB 3.64Å; R54-S104 PolarHBondContact NH1-O 2.9Å; R54-S104 PolarHBondContact NH2-O 3Å
55	R	84.4	Confident	85.1	Confident	171 Å²	171	48.5 Å²	48.5	65%	0.645	23%	0.232	S	C	*	.	H	α-helix	trans	-59.5	-41.8	177.2	-75.4	171.8	172.5	147	-0.1	111.3	N51 D52 D532	N51-R55 WeakPolarHBondContact O-CG 3.29Å; N51-R55 PolarHBondContact O-N 3.2Å; D52-R55 WeakPolarHBondContact O-CB 3.36Å; D52-R55 PolarHBondContact O-N 3.27Å; D52-R55 VanDerWaalsContact O-N 3.17Å; D52-R55 IonicContact OD1-NH1 2.68Å; D52-R55 PolarHBondContact OD1-NH1 3.23Å; R55-D532 IonicContact CZ-OD2 3.8Å; R55-D532 VanDerWaalsContact CZ-OD2 3.25Å; R55-D532 IonicContact NH1-OD2 3.55Å; R55-D532 PolarHBondContact NH1-OD2 3.09Å; R55-D532 IonicContact NH2-OD2 2.64Å; R55-D532 PolarHBondContact NH2-OD2 3.48Å
56	R	80.2	Confident	85	Confident	93 Å²	93	51 Å²	51	35%	0.351	25%	0.252	S	S	.	.	H	α-helix	trans	-87.4	-43	-175.9	-159	158.3	176.2	-155.5	-12.7	113.5	D20 F21 D24 D52 R54	D20-R56 VanDerWaalsContact O-CZ 3.22Å; D20-R56 PolarHBondContact O-NH1 3.42Å; D20-R56 PolarHBondContact O-NH2 3.25Å; F21-R56 HydrophobicContact CD2-CB 4.36Å; F21-R56 PolarHBondContact O-NH1 3.35Å; F21-R56 VanDerWaalsContact O-NH1 3.14Å; D24-R56 IonicContact OD1-NH1 2.67Å; D24-R56 IonicContact OD2-CZ 2.72Å; D24-R56 IonicContact OD2-NH1 2.82Å; D24-R56 PolarHBondContact OD2-NH1 3.42Å; D52-R56 PolarHBondContact O-N 3.42Å; R54-R56 VanDerWaalsContact C-N 3.3Å; R54-R56 PolarHBondContact O-N 2.76Å
57	N	82.3	Confident	84.8	Confident	52 Å²	52	53.5 Å²	53.5	28%	0.278	27%	0.266	S	S	.	.			trans	-145.9	81	-175.7	-83.3	-39.4	0	0	0	112.8	L53 T59 R60 A61	L53-N57 CarbonylContact O-C 3.53Å; L53-N57 VanDerWaalsContact O-C 3.22Å; L53-N57 WeakPolarHBondContact O-CA 3.45Å; L53-N57 PolarHBondContact O-N 2.65Å; N57-T59 VanDerWaalsContact C-N 3.27Å; N57-T59 PolarHBondContact O-N 3.47Å; N57-R60 HydrophobicContact CB-CB 4.16Å; N57-R60 HydrophobicContact CB-CG 4.39Å; N57-R60 PolarHBondContact O-N 3.14Å; N57-A61 PolarHBondContact O-N 2.79Å
58	E	85.4	Confident	84.6	Confident	155 Å²	155	50.1 Å²	50.1	72%	0.724	25%	0.249	S	C	*	.	H	α-helix	trans	-53.7	-39.9	177.6	-172.8	-178.3	-173.9	0	0	113.2	R54 R60 A61 A62	R54-E58 PolarHBondContact O-N 2.84Å; E58-R60 PolarHBondContact O-N 3.01Å; E58-A61 PolarHBondContact O-N 3.32Å; E58-A62 WeakPolarHBondContact O-CB 3.38Å; E58-A62 PolarHBondContact O-N 2.92Å
59	T	85.7	Confident	84.4	Confident	105 Å²	105	52 Å²	52	64%	0.644	26%	0.257	S	S	*	.	H	α-helix	trans	-63.3	-41.3	-179	54.7	0	0	0	0	112.7	N57 A62 K63	N57-T59 VanDerWaalsContact C-N 3.27Å; N57-T59 PolarHBondContact O-N 3.47Å; T59-A62 PolarHBondContact O-N 3.46Å; T59-K63 PolarHBondContact O-N 2.99Å
60	R	83.5	Confident	84.3	Confident	21 Å²	21	56.3 Å²	56.3	8%	0.079	28%	0.277	C	S	.	.	H	α-helix	trans	-73	-40.1	175.6	-69.8	-66.1	-178.7	-174.5	2.1	111.6	D17 N57 E58 A62 K63 L64 E71	D17-R60 HydrophobicContact CB-CG 4.42Å; D17-R60 IonicContact OD2-CZ 3.64Å; D17-R60 IonicContact OD2-NE 2.84Å; D17-R60 PolarHBondContact OD2-NE 2.96Å; D17-R60 IonicContact OD2-NH2 3.54Å; D17-R60 PolarHBondContact OD2-NH2 3.26Å; N57-R60 HydrophobicContact CB-CB 4.16Å; N57-R60 HydrophobicContact CB-CG 4.39Å; N57-R60 PolarHBondContact O-N 3.14Å; E58-R60 PolarHBondContact O-N 3.01Å; R60-A62 VanDerWaalsContact C-N 3.26Å; R60-A62 PolarHBondContact O-N 2.69Å; R60-K63 PolarHBondContact O-N 2.93Å; R60-L64 WeakPolarHBondContact O-CB 3.45Å; R60-L64 PolarHBondContact O-N 2.79Å; R60-E71 IonicContact NH1-OE1 3.49Å; R60-E71 PolarHBondContact NH1-OE1 3.04Å; R60-E71 VanDerWaalsContact NH1-OE1 3.1Å
61	A	83.6	Confident	84.3	Confident	2 Å²	2	57 Å²	57	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-39.1	172.4	0	0	0	0	0	111.9	L53 R54 N57 E58 M65	L53-A61 HydrophobicContact CD2-CB 4.44Å; L53-A61 HydrophobicContact CG-CB 4.28Å; R54-A61 HydrophobicContact CB-CB 4.46Å; R54-A61 HydrophobicContact CG-CB 3.64Å; N57-A61 PolarHBondContact O-N 2.79Å; E58-A61 PolarHBondContact O-N 3.32Å; A61-M65 WeakPolarHBondContact O-CB 3.37Å; A61-M65 WeakPolarHBondContact O-CG 3.45Å; A61-M65 PolarHBondContact O-N 2.89Å; A61-M65 VanDerWaalsContact O-N 3.14Å
62	A	84.9	Confident	84.4	Confident	58 Å²	58	56.1 Å²	56.1	48%	0.479	28%	0.275	S	S	.	.	H	α-helix	trans	-67.4	-42.3	174.5	0	0	0	0	0	112.9	E58 T59 R60 M65 S66	E58-A62 WeakPolarHBondContact O-CB 3.38Å; E58-A62 PolarHBondContact O-N 2.92Å; T59-A62 PolarHBondContact O-N 3.46Å; R60-A62 VanDerWaalsContact C-N 3.26Å; R60-A62 PolarHBondContact O-N 2.69Å; A62-M65 PolarHBondContact O-N 2.7Å; A62-S66 PolarHBondContact O-N 2.94Å; A62-S66 VanDerWaalsContact O-N 3.08Å; A62-S66 PolarHBondContact O-OG 3.4Å
63	K	85.4	Confident	84.5	Confident	80 Å²	80	56.1 Å²	56.1	35%	0.348	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-51.1	174.6	-78.9	-167.2	172.6	-165.3	0	112.1	E10 T59 R60 M65 S66 N67 E71	E10-K63 IonicContact OE2-NZ 3.35Å; E10-K63 PolarHBondContact OE2-NZ 3.09Å; T59-K63 PolarHBondContact O-N 2.99Å; R60-K63 PolarHBondContact O-N 2.93Å; K63-M65 PolarHBondContact O-N 3.04Å; K63-S66 PolarHBondContact O-N 3.34Å; K63-S66 PolarHBondContact O-OG 2.88Å; K63-S66 VanDerWaalsContact O-OG 3.09Å; K63-N67 PolarHBondContact O-N 3.15Å; K63-E71 HydrophobicContact CB-CG 4.22Å; K63-E71 WeakPolarHBondContact CB-OE1 3.39Å; K63-E71 VanDerWaalsContact CD-OE1 3.3Å; K63-E71 WeakPolarHBondContact CD-OE1 3.35Å
64	L	86.4	Confident	84.7	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-54.9	-37.8	176.8	178.4	65.9	0	0	0	112	L53 R60 A68 E71 L72 L101	L53-L64 HydrophobicContact CD2-CD2 3.68Å; R60-L64 WeakPolarHBondContact O-CB 3.45Å; R60-L64 PolarHBondContact O-N 2.79Å; L64-A68 WeakPolarHBondContact O-CA 3.37Å; L64-A68 WeakPolarHBondContact O-CB 3.48Å; L64-E71 HydrophobicContact CB-CB 4.33Å; L64-E71 HydrophobicContact CD1-CB 3.82Å; L64-L72 HydrophobicContact CD1-CD2 4.32Å; L64-L72 HydrophobicContact CD1-CG 4.24Å; L64-L101 HydrophobicContact CD1-CD1 4.42Å; L64-L101 HydrophobicContact CD2-CD1 3.99Å; L64-L101 HydrophobicContact CD2-CD2 4.36Å; L64-L101 HydrophobicContact CG-CD1 4.5Å
65	M	84.8	Confident	84.9	Confident	18 Å²	18	51.9 Å²	51.9	9%	0.089	26%	0.259	C	S	.	.	H	α-helix	trans	-70.9	-37.1	176	-73.5	-73.5	-89.1	0	0	112.6	I50 A61 A62 K63 F105 K108 S122 M123	I50-M65 HydrophobicContact CD1-SD 4.4Å; A61-M65 WeakPolarHBondContact O-CB 3.37Å; A61-M65 WeakPolarHBondContact O-CG 3.45Å; A61-M65 PolarHBondContact O-N 2.89Å; A61-M65 VanDerWaalsContact O-N 3.14Å; A62-M65 PolarHBondContact O-N 2.7Å; K63-M65 PolarHBondContact O-N 3.04Å; M65-F105 HydrophobicContact CE-CB 4.4Å; M65-F105 HydrophobicContact CE-CD1 3.85Å; M65-F105 HydrophobicContact SD-CD1 3.77Å; M65-F105 HydrophobicContact SD-CE1 4.03Å; M65-K108 HydrophobicContact CE-CB 4.05Å; M65-K108 HydrophobicContact CE-CD 3.67Å; M65-K108 HydrophobicContact CE-CG 3.8Å; M65-K108 PolarHBondContact O-NZ 3.37Å; M65-K108 HydrophobicContact SD-CD 4.32Å; M65-S122 VanDerWaalsContact O-CB 3.29Å; M65-S122 WeakPolarHBondContact O-CB 3.09Å; M65-M123 PolarHBondContact O-N 2.95Å
66	S	84.7	Confident	85.1	Confident	73 Å²	73	44.7 Å²	44.7	51%	0.51	23%	0.233	S	C	.	.	H	α-helix	trans	-84.9	-43.2	-176.7	62.5	0	0	0	0	113.9	A62 K63	A62-S66 PolarHBondContact O-N 2.94Å; A62-S66 VanDerWaalsContact O-N 3.08Å; A62-S66 PolarHBondContact O-OG 3.4Å; K63-S66 PolarHBondContact O-N 3.34Å; K63-S66 PolarHBondContact O-OG 2.88Å; K63-S66 VanDerWaalsContact O-OG 3.09Å
67	N	86.1	Confident	85.4	Confident	58 Å²	58	45.6 Å²	45.6	31%	0.31	24%	0.236	S	C	.	.			trans	-128.3	90	178.6	179.5	12.8	0	0	0	109.2	K63 E70	K63-N67 PolarHBondContact O-N 3.15Å; N67-E70 PolarHBondContact ND2-OE2 3.11Å
68	A	82.7	Confident	85.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-80.6	-21.2	-171	0	0	0	0	0	113.9	L64 L72 G121 M123 T239	L64-A68 WeakPolarHBondContact O-CA 3.37Å; L64-A68 WeakPolarHBondContact O-CB 3.48Å; A68-L72 HydrophobicContact CB-CD1 4.47Å; A68-L72 WeakPolarHBondContact O-CB 3.37Å; A68-L72 WeakPolarHBondContact O-CD1 3.36Å; A68-L72 WeakPolarHBondContact O-CG 3.45Å; A68-L72 PolarHBondContact O-N 3.43Å; A68-G121 PolarHBondContact N-O 3.39Å; A68-G121 VanDerWaalsContact N-O 3.14Å; A68-M123 HydrophobicContact CB-CB 4.1Å; A68-M123 HydrophobicContact CB-CE 4.14Å; A68-T239 HydrophobicContact CB-CG2 3.46Å; A68-T239 VanDerWaalsContact CB-CG2 3.46Å
69	F	82.1	Confident	85.9	Confident	40 Å²	40	35.7 Å²	35.7	18%	0.175	19%	0.188	C	C	.	.	H	α-helix	trans	-71	-51.9	-170.2	-67.8	-64.3	0	0	0	113.1	L73 L164 R241	F69-L73 PolarHBondContact O-N 3.48Å; F69-L164 HydrophobicContact CD1-CD2 3.8Å; F69-L164 HydrophobicContact CE1-CD2 4.28Å; F69-R241 HydrophobicContact CZ-CB 4.14Å; F69-R241 HydrophobicContact CZ-CG 4.12Å
70	E	84.6	Confident	86	Confident	109 Å²	109	34.2 Å²	34.2	51%	0.509	17%	0.173	S	C	.	.	H	α-helix	trans	-69.7	-44.9	-178.7	-71	156.5	-167	0	0	111.2	M11 N67 L72 L73 A74	M11-E70 HydrophobicContact SD-CB 4.45Å; N67-E70 PolarHBondContact ND2-OE2 3.11Å; E70-L72 PolarHBondContact O-N 3.24Å; E70-L73 PolarHBondContact O-N 3.08Å; E70-A74 PolarHBondContact O-N 3.03Å
71	E	85.7	Confident	86.2	Confident	14 Å²	14	37.1 Å²	37.1	7%	0.065	19%	0.19	C	C	.	.	H	α-helix	trans	-64.7	-39.7	179.3	-67.8	-76.6	-179.5	0	0	111.6	Y18 R60 K63 L64 A74 F75	Y18-E71 WeakPolarHBondContact CE2-OE2 3.2Å; Y18-E71 VanDerWaalsContact CZ-OE2 3.26Å; Y18-E71 PolarHBondContact OH-OE2 2.95Å; R60-E71 IonicContact NH1-OE1 3.49Å; R60-E71 PolarHBondContact NH1-OE1 3.04Å; R60-E71 VanDerWaalsContact NH1-OE1 3.1Å; K63-E71 HydrophobicContact CB-CG 4.22Å; K63-E71 WeakPolarHBondContact CB-OE1 3.39Å; K63-E71 VanDerWaalsContact CD-OE1 3.3Å; K63-E71 WeakPolarHBondContact CD-OE1 3.35Å; L64-E71 HydrophobicContact CB-CB 4.33Å; L64-E71 HydrophobicContact CD1-CB 3.82Å; E71-A74 PolarHBondContact O-N 3.31Å; E71-F75 VanDerWaalsContact O-CB 3.29Å; E71-F75 WeakPolarHBondContact O-CB 3.46Å; E71-F75 PolarHBondContact O-N 3.26Å
72	L	86.9	Confident	86.3	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-40.4	171.9	-79	173.5	0	0	0	112.7	L64 A68 E70 F75 Q76 L101 M123 L164 T239	L64-L72 HydrophobicContact CD1-CD2 4.32Å; L64-L72 HydrophobicContact CD1-CG 4.24Å; A68-L72 HydrophobicContact CB-CD1 4.47Å; A68-L72 WeakPolarHBondContact O-CB 3.37Å; A68-L72 WeakPolarHBondContact O-CD1 3.36Å; A68-L72 WeakPolarHBondContact O-CG 3.45Å; A68-L72 PolarHBondContact O-N 3.43Å; E70-L72 PolarHBondContact O-N 3.24Å; L72-F75 PolarHBondContact O-N 2.88Å; L72-Q76 WeakPolarHBondContact O-CB 3.5Å; L72-Q76 VanDerWaalsContact O-CG 3.24Å; L72-Q76 WeakPolarHBondContact O-CG 3.38Å; L72-Q76 PolarHBondContact O-N 2.91Å; L72-L101 HydrophobicContact CD2-CD1 3.93Å; L72-M123 HydrophobicContact CD1-CE 3.75Å; L72-M123 HydrophobicContact CD2-CE 4.14Å; L72-M123 HydrophobicContact CG-CE 4.17Å; L72-L164 HydrophobicContact CD1-CD2 4.37Å; L72-T239 HydrophobicContact CD1-CG2 3.67Å
73	L	86.6	Confident	86.4	Confident	36 Å²	36	34.7 Å²	34.7	19%	0.188	17%	0.169	C	C	.	.	H	α-helix	trans	-67.7	-41	179.7	-174.6	66.5	0	0	0	111.3	M11 F69 E70 F75 R77	M11-L73 HydrophobicContact CE-CD2 4.45Å; F69-L73 PolarHBondContact O-N 3.48Å; E70-L73 PolarHBondContact O-N 3.08Å; L73-F75 VanDerWaalsContact C-N 3.33Å; L73-R77 WeakPolarHBondContact O-CG 3.33Å; L73-R77 PolarHBondContact O-N 3.37Å
74	A	87.6	Confident	86.5	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-41.9	172.1	0	0	0	0	0	111.4	A14 Y18 E70 E71 R77 A78	A14-A74 HydrophobicContact CB-CB 3.97Å; Y18-A74 HydrophobicContact CD2-CB 4.42Å; Y18-A74 HydrophobicContact CE2-CB 4.42Å; E70-A74 PolarHBondContact O-N 3.03Å; E71-A74 PolarHBondContact O-N 3.31Å; A74-R77 PolarHBondContact O-N 3.1Å; A74-A78 PolarHBondContact O-N 3.07Å
75	F	88.6	Confident	86.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-40	-179.3	-161.2	-168.6	0	0	0	112.4	Y18 F21 L22 V48 E71 L72 L73 R77 A78 L79 I99 L101	Y18-F75 HydrophobicContact CD1-CB 4.43Å; Y18-F75 HydrophobicContact CD1-CD1 4.3Å; Y18-F75 AromaticContact CD1-CD2 3.59Å; Y18-F75 HydrophobicContact CD1-CD2 3.59Å; Y18-F75 HydrophobicContact CD1-CE1 4.43Å; Y18-F75 AromaticContact CD1-CE2 3.7Å; Y18-F75 HydrophobicContact CD1-CE2 3.7Å; Y18-F75 AromaticContact CD1-CG 3.88Å; Y18-F75 HydrophobicContact CD1-CG 3.88Å; Y18-F75 HydrophobicContact CD1-CZ 4.13Å; Y18-F75 HydrophobicContact CD2-CB 3.88Å; Y18-F75 HydrophobicContact CD2-CD2 4.16Å; Y18-F75 HydrophobicContact CD2-CG 4.19Å; Y18-F75 HydrophobicContact CE1-CD1 4.34Å; Y18-F75 HydrophobicContact CE1-CD2 4.38Å; Y18-F75 HydrophobicContact CE1-CG 4.23Å; Y18-F75 HydrophobicContact CE2-CB 4.09Å; Y18-F75 HydrophobicContact CG-CB 4.11Å; Y18-F75 AromaticContact CG-CD2 3.5Å; Y18-F75 HydrophobicContact CG-CD2 3.5Å; Y18-F75 VanDerWaalsContact CG-CD2 3.5Å; Y18-F75 AromaticContact CG-CE2 3.99Å; Y18-F75 HydrophobicContact CG-CE2 3.99Å; Y18-F75 AromaticContact CG-CG 3.9Å; Y18-F75 HydrophobicContact CG-CG 3.9Å; F21-F75 HydrophobicContact CD1-CE2 4.26Å; F21-F75 HydrophobicContact CD1-CZ 4.07Å; F21-F75 HydrophobicContact CE1-CZ 4.15Å; L22-F75 HydrophobicContact CD1-CD2 4.4Å; L22-F75 HydrophobicContact CD1-CE2 3.91Å; L22-F75 HydrophobicContact CD2-CE2 4.12Å; L22-F75 HydrophobicContact CD2-CZ 4.45Å; L22-F75 HydrophobicContact CG-CE2 3.98Å; V48-F75 HydrophobicContact CB-CE1 4.33Å; V48-F75 HydrophobicContact CB-CZ 4.4Å; V48-F75 HydrophobicContact CG1-CE1 4.1Å; V48-F75 HydrophobicContact CG1-CZ 4Å; V48-F75 HydrophobicContact CG2-CE1 4.17Å; V48-F75 HydrophobicContact CG2-CZ 3.94Å; E71-F75 VanDerWaalsContact O-CB 3.29Å; E71-F75 WeakPolarHBondContact O-CB 3.46Å; E71-F75 PolarHBondContact O-N 3.26Å; L72-F75 PolarHBondContact O-N 2.88Å; L73-F75 VanDerWaalsContact C-N 3.33Å; F75-R77 VanDerWaalsContact C-N 3.31Å; F75-R77 PolarHBondContact O-N 2.91Å; F75-A78 PolarHBondContact O-N 3.39Å; F75-L79 PolarHBondContact O-N 3.3Å; F75-I99 HydrophobicContact CB-CD1 3.79Å; F75-I99 HydrophobicContact CD1-CB 4.49Å; F75-I99 HydrophobicContact CD1-CD1 3.45Å; F75-I99 VanDerWaalsContact CD1-CD1 3.45Å; F75-I99 HydrophobicContact CD1-CG2 4.01Å; F75-I99 HydrophobicContact CD2-CD1 3.54Å; F75-I99 HydrophobicContact CE1-CD1 3.91Å; F75-I99 HydrophobicContact CE1-CG2 3.88Å; F75-I99 HydrophobicContact CE2-CD1 4.02Å; F75-I99 HydrophobicContact CG-CD1 3.26Å; F75-I99 HydrophobicContact CZ-CD1 4.19Å; F75-I99 WeakPolarHBondContact O-CD1 3.19Å; F75-L101 HydrophobicContact CE1-CD2 4.42Å
76	Q	89.1	Confident	86.5	Confident	21 Å²	21	40.6 Å²	40.6	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-36.7	173.6	-72.4	173.3	5.7	0	0	112.6	L72 K80 F97 I99	L72-Q76 WeakPolarHBondContact O-CB 3.5Å; L72-Q76 VanDerWaalsContact O-CG 3.24Å; L72-Q76 WeakPolarHBondContact O-CG 3.38Å; L72-Q76 PolarHBondContact O-N 2.91Å; Q76-K80 PolarHBondContact O-N 3.31Å; Q76-K80 VanDerWaalsContact O-N 3.08Å; Q76-F97 WeakPolarHBondContact CB-O 3.15Å; Q76-F97 WeakPolarHBondContact CG-O 3.08Å; Q76-I99 HydrophobicContact CG-CG1 4.43Å
77	R	87.6	Confident	86.4	Confident	111 Å²	111	39.6 Å²	39.6	42%	0.419	21%	0.21	S	C	.	.	H	α-helix	trans	-67.5	-45.9	173.6	-69.6	171.4	-176.6	179	2.3	111.7	Q15 L73 A74 F75 L79 K80 D81	Q15-R77 HydrophobicContact CG-CB 4.39Å; L73-R77 WeakPolarHBondContact O-CG 3.33Å; L73-R77 PolarHBondContact O-N 3.37Å; A74-R77 PolarHBondContact O-N 3.1Å; F75-R77 VanDerWaalsContact C-N 3.31Å; F75-R77 PolarHBondContact O-N 2.91Å; R77-L79 VanDerWaalsContact C-N 3.34Å; R77-L79 PolarHBondContact O-N 3.11Å; R77-K80 WeakPolarHBondContact O-CB 3.47Å; R77-K80 PolarHBondContact O-N 2.89Å; R77-K80 VanDerWaalsContact O-N 3.1Å; R77-D81 PolarHBondContact O-N 3.04Å
78	A	88.9	Confident	86.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.5	-43.6	175.8	0	0	0	0	0	112.2	Q15 L19 A74 F75 K80 D81 L82	Q15-A78 HydrophobicContact CG-CB 4.1Å; Q15-A78 WeakPolarHBondContact O-CB 3.32Å; L19-A78 HydrophobicContact CB-CB 4.38Å; A74-A78 PolarHBondContact O-N 3.07Å; F75-A78 PolarHBondContact O-N 3.39Å; A78-K80 VanDerWaalsContact C-N 3.33Å; A78-K80 PolarHBondContact O-N 3.27Å; A78-D81 PolarHBondContact O-N 3.1Å; A78-L82 PolarHBondContact O-N 2.71Å
79	L	88.3	Confident	86.3	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-39.6	174.5	178	60.7	0	0	0	112.1	L22 V35 L46 F75 R77 L82 V83 F97 I99	L22-L79 HydrophobicContact CD1-CB 4.14Å; L22-L79 HydrophobicContact CD1-CD1 4.23Å; V35-L79 HydrophobicContact CG2-CD1 4.24Å; L46-L79 HydrophobicContact CB-CD1 4.47Å; L46-L79 HydrophobicContact CB-CD2 3.77Å; L46-L79 HydrophobicContact CD2-CD1 3.78Å; L46-L79 HydrophobicContact CD2-CD2 4.35Å; F75-L79 PolarHBondContact O-N 3.3Å; R77-L79 VanDerWaalsContact C-N 3.34Å; R77-L79 PolarHBondContact O-N 3.11Å; L79-L82 PolarHBondContact O-N 3.01Å; L79-V83 HydrophobicContact CD1-CG2 4.03Å; L79-V83 HydrophobicContact CG-CG2 4.37Å; L79-V83 WeakPolarHBondContact O-CB 3.48Å; L79-V83 VanDerWaalsContact O-CG2 3.3Å; L79-V83 WeakPolarHBondContact O-CG2 3.43Å; L79-V83 PolarHBondContact O-N 3.18Å; L79-F97 HydrophobicContact CD2-CB 3.99Å; L79-F97 HydrophobicContact CG-CB 4.31Å; L79-I99 HydrophobicContact CB-CD1 4.13Å; L79-I99 HydrophobicContact CD2-CD1 4.11Å; L79-I99 HydrophobicContact CD2-CG1 3.72Å
80	K	88.3	Confident	86.3	Confident	73 Å²	73	41.3 Å²	41.3	32%	0.317	23%	0.233	S	C	.	.	H	α-helix	trans	-64.1	-39.9	176.8	-173.7	170.4	-176.2	171.9	0	112.3	Q76 R77 A78 V83 A84 E95 F97	Q76-K80 PolarHBondContact O-N 3.31Å; Q76-K80 VanDerWaalsContact O-N 3.08Å; R77-K80 WeakPolarHBondContact O-CB 3.47Å; R77-K80 PolarHBondContact O-N 2.89Å; R77-K80 VanDerWaalsContact O-N 3.1Å; A78-K80 VanDerWaalsContact C-N 3.33Å; A78-K80 PolarHBondContact O-N 3.27Å; K80-V83 PolarHBondContact O-N 3.46Å; K80-A84 VanDerWaalsContact O-CB 3.31Å; K80-A84 WeakPolarHBondContact O-CB 3.5Å; K80-A84 PolarHBondContact O-N 3.44Å; K80-E95 PolarHBondContact NZ-O 3.37Å; K80-F97 HydrophobicContact CB-CD2 4.04Å; K80-F97 HydrophobicContact CG-CD2 4.05Å; K80-F97 HydrophobicContact CG-CE2 4.29Å
81	D	88.1	Confident	86	Confident	82 Å²	82	36.7 Å²	36.7	44%	0.439	21%	0.213	S	C	.	.	H	α-helix	trans	-65.8	-41.5	176.5	-65.2	-28.6	0	0	0	111.5	Q15 R77 A78 A84 S85	Q15-D81 PolarHBondContact NE2-OD2 3.36Å; R77-D81 PolarHBondContact O-N 3.04Å; A78-D81 PolarHBondContact O-N 3.1Å; D81-A84 PolarHBondContact O-N 3.39Å; D81-S85 PolarHBondContact O-N 3.32Å; D81-S85 VanDerWaalsContact O-N 3.1Å
82	L	85.4	Confident	85.8	Confident	9 Å²	9	44.7 Å²	44.7	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-46.1	174.1	-169.6	95.2	0	0	0	112.1	L19 L22 D23 V35 A78 L79 A84 S85 V86	L19-L82 HydrophobicContact CD1-CB 4.03Å; L19-L82 HydrophobicContact CD1-CD1 4.05Å; L22-L82 HydrophobicContact CB-CD1 4.16Å; L22-L82 HydrophobicContact CB-CD2 3.94Å; L22-L82 HydrophobicContact CD1-CD2 4.44Å; D23-L82 HydrophobicContact CB-CD1 4.31Å; V35-L82 HydrophobicContact CG1-CD2 4.41Å; V35-L82 HydrophobicContact CG2-CD2 3.98Å; A78-L82 PolarHBondContact O-N 2.71Å; L79-L82 PolarHBondContact O-N 3.01Å; L82-A84 PolarHBondContact O-N 2.98Å; L82-S85 PolarHBondContact O-N 3.1Å; L82-S85 VanDerWaalsContact O-N 3.14Å; L82-S85 PolarHBondContact O-OG 2.73Å; L82-V86 PolarHBondContact O-N 2.8Å
83	V	87.1	Confident	85.5	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-34.6	176.9	173	0	0	0	0	110.8	V35 M38 L79 K80 S85 V86 D87 Y90 A91 F97	V35-V83 HydrophobicContact CG1-CG2 4.19Å; M38-V83 HydrophobicContact CE-CG2 3.76Å; L79-V83 HydrophobicContact CD1-CG2 4.03Å; L79-V83 HydrophobicContact CG-CG2 4.37Å; L79-V83 WeakPolarHBondContact O-CB 3.48Å; L79-V83 VanDerWaalsContact O-CG2 3.3Å; L79-V83 WeakPolarHBondContact O-CG2 3.43Å; L79-V83 PolarHBondContact O-N 3.18Å; K80-V83 PolarHBondContact O-N 3.46Å; V83-S85 VanDerWaalsContact C-N 3.33Å; V83-S85 PolarHBondContact O-N 3.16Å; V83-V86 PolarHBondContact O-N 3.27Å; V83-D87 CarbonylContact O-C 3.58Å; V83-D87 PolarHBondContact O-N 2.83Å; V83-Y90 HydrophobicContact CG1-CD1 3.78Å; V83-Y90 HydrophobicContact CG1-CE1 4.44Å; V83-A91 HydrophobicContact CG1-CB 4.34Å; V83-F97 HydrophobicContact CB-CE2 4.18Å; V83-F97 HydrophobicContact CB-CZ 4.39Å; V83-F97 HydrophobicContact CG1-CE1 4.45Å; V83-F97 HydrophobicContact CG1-CE2 3.91Å; V83-F97 HydrophobicContact CG1-CZ 3.71Å
84	A	87.4	Confident	84.9	Confident	48 Å²	48	51.7 Å²	51.7	40%	0.397	28%	0.28	S	S	.	.	H	α-helix	trans	-69.6	-24.9	175.2	0	0	0	0	0	114	K80 D81 L82 A91	K80-A84 VanDerWaalsContact O-CB 3.31Å; K80-A84 WeakPolarHBondContact O-CB 3.5Å; K80-A84 PolarHBondContact O-N 3.44Å; D81-A84 PolarHBondContact O-N 3.39Å; L82-A84 PolarHBondContact O-N 2.98Å; A84-A91 HydrophobicContact CB-CB 3.91Å
85	S	85.9	Confident	84.2	Confident	95 Å²	95	54.4 Å²	54.4	66%	0.664	29%	0.292	S	S	*	.	H	α-helix	trans	-77.8	-32.3	173.1	78.1	0	0	0	0	112.5	D81 L82 V83	D81-S85 PolarHBondContact O-N 3.32Å; D81-S85 VanDerWaalsContact O-N 3.1Å; L82-S85 PolarHBondContact O-N 3.1Å; L82-S85 VanDerWaalsContact O-N 3.14Å; L82-S85 PolarHBondContact O-OG 2.73Å; V83-S85 VanDerWaalsContact C-N 3.33Å; V83-S85 PolarHBondContact O-N 3.16Å
86	V	84.4	Confident	83.7	Confident	80 Å²	80	59 Å²	59	49%	0.485	31%	0.313	S	S	.	.	H	α-helix	trans	-80.7	-50.6	177.3	179.8	0	0	0	0	112.2	I39 L82 V83	I39-V86 HydrophobicContact CD1-CB 4.49Å; I39-V86 HydrophobicContact CD1-CG1 3.94Å; L82-V86 PolarHBondContact O-N 2.8Å; V83-V86 PolarHBondContact O-N 3.27Å
87	D	83.4	Confident	83.6	Confident	52 Å²	52	58 Å²	58	28%	0.278	31%	0.309	S	S	.	.			trans	-146.3	98.8	174	-178.1	16.2	0	0	0	112.6	V83 T89 Y90 A91	V83-D87 CarbonylContact O-C 3.58Å; V83-D87 PolarHBondContact O-N 2.83Å; D87-T89 PolarHBondContact O-N 3.05Å; D87-T89 VanDerWaalsContact O-N 3.11Å; D87-T89 WeakPolarHBondContact OD1-CA 3.35Å; D87-T89 WeakPolarHBondContact OD1-CB 3.45Å; D87-T89 PolarHBondContact OD1-N 3.07Å; D87-T89 PolarHBondContact OD1-OG1 3.17Å; D87-Y90 PolarHBondContact O-N 3.28Å; D87-Y90 VanDerWaalsContact OD2-CB 3.29Å; D87-Y90 WeakPolarHBondContact OD2-CB 3.34Å; D87-Y90 PolarHBondContact OD2-N 3.1Å; D87-A91 PolarHBondContact O-N 3.11Å
88	G	82.1	Confident	83.6	Confident	36 Å²	36	54.5 Å²	54.5	37%	0.371	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-4.8	173.5	0	0	0	0	0	115.4
89	T	85.2	Confident	83.6	Confident	93 Å²	93	54.6 Å²	54.6	57%	0.571	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-52.9	173	-28.2	0	0	0	0	110.1	D87 A91 K92	D87-T89 PolarHBondContact O-N 3.05Å; D87-T89 VanDerWaalsContact O-N 3.11Å; D87-T89 WeakPolarHBondContact OD1-CA 3.35Å; D87-T89 WeakPolarHBondContact OD1-CB 3.45Å; D87-T89 PolarHBondContact OD1-N 3.07Å; D87-T89 PolarHBondContact OD1-OG1 3.17Å; T89-A91 VanDerWaalsContact C-N 3.33Å; T89-A91 PolarHBondContact O-N 3.23Å; T89-K92 PolarHBondContact O-N 2.73Å; T89-K92 VanDerWaalsContact O-N 3.15Å
90	Y	81.3	Confident	83.6	Confident	5 Å²	5	54.6 Å²	54.6	2%	0.02	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-40.1	175.8	-172.3	-115	0	0	0	112.3	I39 N42 K43 V83 D87 K92 Q93 H94 F97	I39-Y90 HydrophobicContact CG1-CD1 3.81Å; I39-Y90 HydrophobicContact CG1-CE1 3.97Å; I39-Y90 HydrophobicContact CG2-CD1 4.4Å; I39-Y90 HydrophobicContact CG2-CG 4.4Å; N42-Y90 WeakPolarHBondContact CA-OH 3.47Å; N42-Y90 HydrophobicContact CB-CE2 4.43Å; K43-Y90 PolarHBondContact N-OH 3.48Å; K43-Y90 PolarHBondContact O-OH 2.92Å; K43-Y90 VanDerWaalsContact O-OH 3.11Å; V83-Y90 HydrophobicContact CG1-CD1 3.78Å; V83-Y90 HydrophobicContact CG1-CE1 4.44Å; D87-Y90 PolarHBondContact O-N 3.28Å; D87-Y90 VanDerWaalsContact OD2-CB 3.29Å; D87-Y90 WeakPolarHBondContact OD2-CB 3.34Å; D87-Y90 PolarHBondContact OD2-N 3.1Å; Y90-K92 PolarHBondContact O-N 3.43Å; Y90-Q93 PolarHBondContact O-N 3.03Å; Y90-H94 AromaticContact CE2-CD2 3.51Å; Y90-H94 AromaticContact CE2-NE2 3.51Å; Y90-H94 AromaticContact CZ-CD2 3.5Å; Y90-H94 AromaticContact CZ-NE2 3.66Å; Y90-H94 PolarHBondContact O-N 3.16Å; Y90-H94 PolarHBondContact OH-NE2 3.46Å; Y90-F97 HydrophobicContact CD1-CE1 4.21Å; Y90-F97 AromaticContact CD1-CZ 3.98Å; Y90-F97 HydrophobicContact CD1-CZ 3.98Å; Y90-F97 AromaticContact CE1-CE1 3.6Å; Y90-F97 HydrophobicContact CE1-CE1 3.6Å; Y90-F97 AromaticContact CE1-CZ 3.85Å; Y90-F97 HydrophobicContact CE1-CZ 3.85Å
91	A	78.8	Confident	83.5	Confident	12 Å²	12	51.1 Å²	51.1	10%	0.099	28%	0.282	C	S	.	.	H	α-helix	trans	-61.4	-11.3	176	0	0	0	0	0	115.4	V83 A84 D87 T89	V83-A91 HydrophobicContact CG1-CB 4.34Å; A84-A91 HydrophobicContact CB-CB 3.91Å; D87-A91 PolarHBondContact O-N 3.11Å; T89-A91 VanDerWaalsContact C-N 3.33Å; T89-A91 PolarHBondContact O-N 3.23Å
92	K	81.5	Confident	83.3	Confident	183 Å²	183	50 Å²	50	80%	0.796	27%	0.274	S	S	*	.	H	α-helix	trans	-98.1	-19.4	173	-69.3	175.9	-176.9	173.2	0	113.8	T89 Y90	T89-K92 PolarHBondContact O-N 2.73Å; T89-K92 VanDerWaalsContact O-N 3.15Å; Y90-K92 PolarHBondContact O-N 3.43Å
93	Q	79.1	Confident	82.9	Confident	133 Å²	133	49.9 Å²	49.9	62%	0.621	28%	0.275	S	S	*	.	H	α-helix	trans	-78	-34.3	179.2	-64.5	-178.5	0.8	0	0	111.4	Y90	Y90-Q93 PolarHBondContact O-N 3.03Å
94	H	74.6	Confident	82.6	Confident	52 Å²	52	50.9 Å²	50.9	24%	0.241	28%	0.282	C	S	.	.			trans	-104.9	123.3	175.5	-65.1	-75.8	0	0	0	111.2	Y90 F97	Y90-H94 AromaticContact CE2-CD2 3.51Å; Y90-H94 AromaticContact CE2-NE2 3.51Å; Y90-H94 AromaticContact CZ-CD2 3.5Å; Y90-H94 AromaticContact CZ-NE2 3.66Å; Y90-H94 PolarHBondContact O-N 3.16Å; Y90-H94 PolarHBondContact OH-NE2 3.46Å; H94-F97 HydrophobicContact CB-CE1 3.98Å; H94-F97 HydrophobicContact CB-CE2 4.44Å; H94-F97 HydrophobicContact CB-CZ 3.88Å
95	E	72.1	Confident	82.1	Confident	58 Å²	58	48.7 Å²	48.7	27%	0.271	26%	0.263	S	S	.	.	S	Bend	trans	-70.3	-36.2	178.8	-169.6	170.4	177	0	0	111.6	K80 R142 K157 I191	K80-E95 PolarHBondContact NZ-O 3.37Å; E95-R142 IonicContact OE1-NE 3.25Å; E95-R142 IonicContact OE2-NE 3.64Å; E95-R142 PolarHBondContact OE2-NE 2.7Å; E95-K157 WeakPolarHBondContact OE1-CE 3.5Å; E95-K157 IonicContact OE1-NZ 3.18Å; E95-K157 PolarHBondContact OE1-NZ 3.35Å; E95-I191 VanDerWaalsContact OE2-CD1 3.28Å; E95-I191 WeakPolarHBondContact OE2-CD1 3.32Å
96	E	79.9	Confident	81.7	Confident	95 Å²	95	46.1 Å²	46.1	44%	0.444	25%	0.252	S	S	.	.			trans	-136.7	141.9	-179.7	-66	179	172.7	0	0	110.3	F98	E96-F98 HydrophobicContact CB-CE2 4.36Å; E96-F98 HydrophobicContact CB-CZ 3.98Å
97	F	86.6	Confident	81.5	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.009	27%	0.268	C	S	.	.			trans	-106.2	145	168.5	-69.5	-75.9	0	0	0	109.2	M38 A44 Q76 L79 K80 V83 Y90 H94	M38-F97 HydrophobicContact CE-CD1 4.49Å; A44-F97 WeakPolarHBondContact O-CA 3.36Å; Q76-F97 WeakPolarHBondContact CB-O 3.15Å; Q76-F97 WeakPolarHBondContact CG-O 3.08Å; L79-F97 HydrophobicContact CD2-CB 3.99Å; L79-F97 HydrophobicContact CG-CB 4.31Å; K80-F97 HydrophobicContact CB-CD2 4.04Å; K80-F97 HydrophobicContact CG-CD2 4.05Å; K80-F97 HydrophobicContact CG-CE2 4.29Å; V83-F97 HydrophobicContact CB-CE2 4.18Å; V83-F97 HydrophobicContact CB-CZ 4.39Å; V83-F97 HydrophobicContact CG1-CE1 4.45Å; V83-F97 HydrophobicContact CG1-CE2 3.91Å; V83-F97 HydrophobicContact CG1-CZ 3.71Å; Y90-F97 HydrophobicContact CD1-CE1 4.21Å; Y90-F97 AromaticContact CD1-CZ 3.98Å; Y90-F97 HydrophobicContact CD1-CZ 3.98Å; Y90-F97 AromaticContact CE1-CE1 3.6Å; Y90-F97 HydrophobicContact CE1-CE1 3.6Å; Y90-F97 AromaticContact CE1-CZ 3.85Å; Y90-F97 HydrophobicContact CE1-CZ 3.85Å; H94-F97 HydrophobicContact CB-CE1 3.98Å; H94-F97 HydrophobicContact CB-CE2 4.44Å; H94-F97 HydrophobicContact CB-CZ 3.88Å
98	F	87.8	Confident	81.5	Confident	36 Å²	36	47 Å²	47	16%	0.158	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	160.4	179.9	-59.5	-75.3	0	0	0	110.6	A44 R45 L46 E96 N222	A44-F98 PolarHBondContact O-N 2.94Å; R45-F98 VanDerWaalsContact CA-O 3.29Å; R45-F98 WeakPolarHBondContact CA-O 3.36Å; R45-F98 HydrophobicContact CB-CB 4.28Å; R45-F98 HydrophobicContact CG-CB 3.98Å; L46-F98 PolarHBondContact N-O 3.13Å; L46-F98 VanDerWaalsContact N-O 3.14Å; E96-F98 HydrophobicContact CB-CE2 4.36Å; E96-F98 HydrophobicContact CB-CZ 3.98Å; F98-N222 WeakPolarHBondContact CE2-ND2 3.45Å; F98-N222 VanDerWaalsContact CZ-ND2 3.3Å; F98-N222 WeakPolarHBondContact CZ-ND2 3.49Å
99	I	88.8	Confident	81.8	Confident	3 Å²	3	46 Å²	46	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	121.9	176.4	-61.7	176.5	0	0	0	108	L46 V48 F75 Q76 L79 L101	L46-I99 WeakPolarHBondContact O-CA 3.31Å; V48-I99 HydrophobicContact CB-CG2 4.21Å; V48-I99 HydrophobicContact CG2-CG2 3.87Å; F75-I99 HydrophobicContact CB-CD1 3.79Å; F75-I99 HydrophobicContact CD1-CB 4.49Å; F75-I99 HydrophobicContact CD1-CD1 3.45Å; F75-I99 VanDerWaalsContact CD1-CD1 3.45Å; F75-I99 HydrophobicContact CD1-CG2 4.01Å; F75-I99 HydrophobicContact CD2-CD1 3.54Å; F75-I99 HydrophobicContact CE1-CD1 3.91Å; F75-I99 HydrophobicContact CE1-CG2 3.88Å; F75-I99 HydrophobicContact CE2-CD1 4.02Å; F75-I99 HydrophobicContact CG-CD1 3.26Å; F75-I99 HydrophobicContact CZ-CD1 4.19Å; F75-I99 WeakPolarHBondContact O-CD1 3.19Å; Q76-I99 HydrophobicContact CG-CG1 4.43Å; L79-I99 HydrophobicContact CB-CD1 4.13Å; L79-I99 HydrophobicContact CD2-CD1 4.11Å; L79-I99 HydrophobicContact CD2-CG1 3.72Å; I99-L101 HydrophobicContact CG2-CD2 4.41Å; I99-L101 HydrophobicContact CG2-CG 4.41Å
100	G	87	Confident	81.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	137	164.7	0	0	0	0	0	108.9	L46 I47 V48 C262	L46-G100 PolarHBondContact O-N 2.98Å; I47-G100 WeakPolarHBondContact CA-O 3.36Å; V48-G100 PolarHBondContact N-O 2.74Å; G100-C262 WeakPolarHBondContact CA-O 3.47Å
101	L	86.5	Confident	82.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.6	175.4	-70.6	160.9	0	0	0	109	V48 I50 L64 L72 F75 I99 F105 M123 I237	V48-L101 HydrophobicContact CB-CD2 4.05Å; V48-L101 HydrophobicContact CG1-CD2 4.21Å; V48-L101 WeakPolarHBondContact O-CA 3.38Å; I50-L101 HydrophobicContact CD1-CB 4.17Å; I50-L101 HydrophobicContact CD1-CD2 4.42Å; I50-L101 HydrophobicContact CG1-CB 4.28Å; I50-L101 HydrophobicContact CG1-CD2 3.89Å; L64-L101 HydrophobicContact CD1-CD1 4.42Å; L64-L101 HydrophobicContact CD2-CD1 3.99Å; L64-L101 HydrophobicContact CD2-CD2 4.36Å; L64-L101 HydrophobicContact CG-CD1 4.5Å; L72-L101 HydrophobicContact CD2-CD1 3.93Å; F75-L101 HydrophobicContact CE1-CD2 4.42Å; I99-L101 HydrophobicContact CG2-CD2 4.41Å; I99-L101 HydrophobicContact CG2-CG 4.41Å; L101-F105 HydrophobicContact CB-CZ 4.4Å; L101-M123 HydrophobicContact CB-SD 4.19Å; L101-M123 HydrophobicContact CD1-CE 3.61Å; L101-M123 HydrophobicContact CD1-SD 3.4Å; L101-M123 WeakPolarHBondContact CD1-SD 3.47Å; L101-M123 HydrophobicContact CG-SD 4.42Å; L101-I237 HydrophobicContact CB-CG2 4.4Å; L101-I237 WeakPolarHBondContact O-CD1 3.4Å
102	E	83.6	Confident	82.7	Confident	59 Å²	59	42.3 Å²	42.3	28%	0.276	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	168.4	173.7	-175	164.8	-157.9	0	0	108.8	I47 V48 N49 I50 K265	I47-E102 HydrophobicContact CG2-CB 4.02Å; V48-E102 PolarHBondContact O-N 2.91Å; N49-E102 CarbonylContact C-O 3.47Å; N49-E102 WeakPolarHBondContact CA-O 3.38Å; N49-E102 PolarHBondContact OD1-O 3.43Å; I50-E102 PolarHBondContact N-O 3.46Å; E102-K265 WeakPolarHBondContact OE1-CD 3.3Å; E102-K265 WeakPolarHBondContact OE1-CE 3.39Å; E102-K265 IonicContact OE1-NZ 3.65Å; E102-K265 PolarHBondContact OE1-NZ 3.29Å
103	G	79	Confident	83.1	Confident	5 Å²	5	36.5 Å²	36.5	5%	0.052	20%	0.197	C	C	.	.	S	Bend	trans	113	-166.7	178.4	0	0	0	0	0	113.2	N49 F105	N49-G103 VanDerWaalsContact OD1-CA 3.3Å; N49-G103 WeakPolarHBondContact OD1-CA 3.31Å; G103-F105 WeakPolarHBondContact O-CD2 3.5Å; G103-F105 WeakPolarHBondContact O-CE2 3.37Å; G103-F105 PolarHBondContact O-N 2.94Å
104	S	80.1	Confident	83.5	Confident	22 Å²	22	33.5 Å²	33.5	15%	0.154	19%	0.189	C	C	.	.			trans	-88.9	111.8	-168.5	172.3	0	0	0	0	114.1	N51 R54 T528 D530	N51-S104 PolarHBondContact OD1-N 3.05Å; R54-S104 PolarHBondContact NH1-O 2.9Å; R54-S104 PolarHBondContact NH2-O 3Å; S104-T528 WeakPolarHBondContact CA-OG1 3.43Å; S104-T528 WeakPolarHBondContact CB-OG1 3.46Å; S104-T528 PolarHBondContact OG-OG1 2.86Å; S104-D530 WeakPolarHBondContact CB-OD1 3.38Å
105	F	76.5	Confident	84.1	Confident	1 Å²	1	32 Å²	32	0%	0.004	18%	0.182	C	C	.	.			trans	-86.4	-6.9	-179.2	-72.1	-92.3	0	0	0	113.6	I50 M65 L101 G103 S107 K108 M123 C125 I237 T528	I50-F105 HydrophobicContact CD1-CD1 4.2Å; I50-F105 HydrophobicContact CD1-CE1 3.32Å; I50-F105 HydrophobicContact CD1-CE2 4.13Å; I50-F105 HydrophobicContact CD1-CZ 3.27Å; I50-F105 HydrophobicContact CG1-CZ 4.39Å; M65-F105 HydrophobicContact CE-CB 4.4Å; M65-F105 HydrophobicContact CE-CD1 3.85Å; M65-F105 HydrophobicContact SD-CD1 3.77Å; M65-F105 HydrophobicContact SD-CE1 4.03Å; L101-F105 HydrophobicContact CB-CZ 4.4Å; G103-F105 WeakPolarHBondContact O-CD2 3.5Å; G103-F105 WeakPolarHBondContact O-CE2 3.37Å; G103-F105 PolarHBondContact O-N 2.94Å; F105-S107 PolarHBondContact O-N 3.49Å; F105-K108 HydrophobicContact CB-CB 4.28Å; F105-K108 PolarHBondContact O-N 2.96Å; F105-M123 HydrophobicContact CE1-CG 3.83Å; F105-M123 HydrophobicContact CE1-SD 3.93Å; F105-M123 HydrophobicContact CZ-SD 4.35Å; F105-C125 HydrophobicContact CB-CB 3.98Å; F105-C125 HydrophobicContact CD1-CB 4.45Å; F105-C125 HydrophobicContact CD2-CB 3.83Å; F105-C125 HydrophobicContact CG-CB 3.8Å; F105-I237 HydrophobicContact CD2-CD1 4.38Å; F105-I237 HydrophobicContact CD2-CG1 4.45Å; F105-I237 HydrophobicContact CE1-CG2 3.94Å; F105-I237 HydrophobicContact CE2-CD1 3.56Å; F105-I237 HydrophobicContact CE2-CG1 3.84Å; F105-I237 HydrophobicContact CE2-CG2 3.96Å; F105-I237 HydrophobicContact CZ-CB 4.39Å; F105-I237 HydrophobicContact CZ-CD1 4.11Å; F105-I237 HydrophobicContact CZ-CG1 4.15Å; F105-I237 HydrophobicContact CZ-CG2 3.36Å; F105-T528 HydrophobicContact CD2-CG2 4.32Å
106	G	78.3	Confident	84.9	Confident	42 Å²	42	32.6 Å²	32.6	43%	0.433	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	50.3	-120.2	179.1	0	0	0	0	0	112.3	K108 H109	G106-K108 PolarHBondContact O-N 3.49Å; G106-H109 PolarHBondContact O-N 2.69Å; G106-H109 VanDerWaalsContact O-N 3.11Å
107	S	78.6	Confident	85.2	Confident	116 Å²	116	32.6 Å²	32.6	81%	0.811	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-64.3	-5.2	179.1	59.2	0	0	0	0	115.7	F105	F105-S107 PolarHBondContact O-N 3.49Å
108	K	83.7	Confident	85.2	Confident	35 Å²	35	43.8 Å²	43.8	15%	0.152	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-102.2	3.6	175.3	-51.1	-155.3	-176.9	-157.4	0	114.2	M65 F105 G106 M123 C125	M65-K108 HydrophobicContact CE-CB 4.05Å; M65-K108 HydrophobicContact CE-CD 3.67Å; M65-K108 HydrophobicContact CE-CG 3.8Å; M65-K108 PolarHBondContact O-NZ 3.37Å; M65-K108 HydrophobicContact SD-CD 4.32Å; F105-K108 HydrophobicContact CB-CB 4.28Å; F105-K108 PolarHBondContact O-N 2.96Å; G106-K108 PolarHBondContact O-N 3.49Å; K108-M123 WeakPolarHBondContact CD-O 3.27Å; K108-C125 PolarHBondContact O-N 3.47Å
109	H	88.1	Confident	85.2	Confident	13 Å²	13	43.2 Å²	43.2	6%	0.06	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	115.2	161.2	-169.2	103.7	0	0	0	108.7	G106 C125 E127 Q235 T528	G106-H109 PolarHBondContact O-N 2.69Å; G106-H109 VanDerWaalsContact O-N 3.11Å; H109-C125 WeakPolarHBondContact CA-O 3.39Å; H109-C125 HydrophobicContact CB-CB 4.46Å; H109-C125 PolarHBondContact ND1-SG 3.19Å; H109-E127 IonicContact CD2-OE2 3.87Å; H109-E127 IonicContact CE1-OE2 3.77Å; H109-E127 IonicContact NE2-OE2 3.66Å; H109-E127 PolarHBondContact NE2-OE2 2.93Å; H109-Q235 PolarHBondContact CE1-NE2 3.08Å; H109-Q235 VanDerWaalsContact CE1-NE2 3.35Å; H109-Q235 PolarHBondContact ND1-NE2 3.22Å; H109-T528 HydrophobicContact CB-CG2 4.4Å
110	V	88.5	Confident	85.2	Confident	12 Å²	12	46.3 Å²	46.3	7%	0.073	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	147.1	-169.6	-68.4	0	0	0	0	111.4	T114 L115 L119 V124 C125 V126 E127	V110-T114 WeakPolarHBondContact CB-OG1 3.48Å; V110-L115 HydrophobicContact CG2-CD1 3.98Å; V110-L119 HydrophobicContact CG1-CD1 4.03Å; V110-L119 HydrophobicContact CG2-CD1 4.22Å; V110-V124 HydrophobicContact CG2-CB 4.36Å; V110-C125 PolarHBondContact N-O 3.45Å; V110-V126 HydrophobicContact CG2-CG2 4.23Å; V110-V126 WeakPolarHBondContact O-CA 3.32Å; V110-E127 PolarHBondContact O-N 3.38Å
111	S	87.9	Confident	85.1	Confident	10 Å²	10	47.3 Å²	47.3	7%	0.07	27%	0.267	C	S	.	.			trans	-78.6	159.4	165.8	85	0	0	0	0	110.6	R113 T114 L115 E202	S111-R113 PolarHBondContact O-N 3.31Å; S111-R113 WeakPolarHBondContact OG-CB 3.38Å; S111-R113 PolarHBondContact OG-N 2.87Å; S111-T114 PolarHBondContact N-OG1 3.02Å; S111-T114 PolarHBondContact O-N 3.33Å; S111-T114 PolarHBondContact O-OG1 3.47Å; S111-T114 VanDerWaalsContact O-OG1 3.04Å; S111-T114 PolarHBondContact OG-OG1 3.43Å; S111-L115 PolarHBondContact O-N 3.18Å; S111-L115 VanDerWaalsContact O-N 3.13Å; S111-E202 PolarHBondContact OG-OE1 3.11Å
112	P	89.2	Confident	85.2	Confident	11 Å²	11	47.5 Å²	47.5	7%	0.071	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-16.5	173.5	-28.7	35.9	0	0	0	115.1	V126 E127 V200 E202 V216	P112-V126 HydrophobicContact CG-CG1 3.77Å; P112-E127 VanDerWaalsContact CD-O 3.25Å; P112-E127 WeakPolarHBondContact CD-O 3.46Å; P112-V200 HydrophobicContact CG-CG1 4.43Å; P112-E202 HydrophobicContact CG-CB 4.43Å; P112-V216 HydrophobicContact CB-CB 4.48Å; P112-V216 HydrophobicContact CB-CG1 4.12Å; P112-V216 HydrophobicContact CG-CG1 4.11Å
113	R	88.4	Confident	85.4	Confident	61 Å²	61	44.7 Å²	44.7	23%	0.23	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-37.3	173.4	176.2	-171.5	-61.3	-92	-9	113.2	S111 L115 E202 P208	S111-R113 PolarHBondContact O-N 3.31Å; S111-R113 WeakPolarHBondContact OG-CB 3.38Å; S111-R113 PolarHBondContact OG-N 2.87Å; R113-L115 VanDerWaalsContact C-N 3.35Å; R113-E202 WeakPolarHBondContact CB-OE1 3.44Å; R113-E202 IonicContact CZ-OE2 2.71Å; R113-E202 IonicContact NE-OE1 2.75Å; R113-E202 PolarHBondContact NE-OE1 2.94Å; R113-E202 IonicContact NE-OE2 3.23Å; R113-E202 PolarHBondContact NE-OE2 3.28Å; R113-E202 IonicContact NH2-OE2 2.95Å; R113-E202 PolarHBondContact NH2-OE2 3.23Å; R113-P208 VanDerWaalsContact CZ-CD 3.49Å
114	T	88.3	Confident	86	Confident	71 Å²	71	44.5 Å²	44.5	44%	0.436	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.9	-178.3	43.7	0	0	0	0	112.9	V110 S111 T116	V110-T114 WeakPolarHBondContact CB-OG1 3.48Å; S111-T114 PolarHBondContact N-OG1 3.02Å; S111-T114 PolarHBondContact O-N 3.33Å; S111-T114 PolarHBondContact O-OG1 3.47Å; S111-T114 VanDerWaalsContact O-OG1 3.04Å; S111-T114 PolarHBondContact OG-OG1 3.43Å; T114-T116 PolarHBondContact O-N 2.91Å
115	L	88.1	Confident	86.5	Confident	20 Å²	20	43.4 Å²	43.4	11%	0.105	25%	0.246	C	C	.	.			trans	-62.9	84.9	171.3	-167.8	93.5	0	0	0	112.2	V110 S111 R113 V124 V126 V216 Y240	V110-L115 HydrophobicContact CG2-CD1 3.98Å; S111-L115 PolarHBondContact O-N 3.18Å; S111-L115 VanDerWaalsContact O-N 3.13Å; R113-L115 VanDerWaalsContact C-N 3.35Å; L115-V124 HydrophobicContact CD1-CG2 4.11Å; L115-V126 HydrophobicContact CD1-CG2 3.86Å; L115-V216 HydrophobicContact CD2-CB 4.33Å; L115-V216 HydrophobicContact CD2-CG2 3.79Å; L115-Y240 HydrophobicContact CD1-CD2 4.39Å; L115-Y240 HydrophobicContact CD1-CG 4.43Å; L115-Y240 HydrophobicContact CD2-CD2 4.03Å; L115-Y240 HydrophobicContact CD2-CE1 4.29Å; L115-Y240 HydrophobicContact CD2-CE2 3.43Å; L115-Y240 VanDerWaalsContact CD2-CE2 3.43Å; L115-Y240 HydrophobicContact CG-CD2 4.44Å; L115-Y240 HydrophobicContact CG-CE1 4.14Å; L115-Y240 HydrophobicContact CG-CE2 4.1Å
116	T	87.4	Confident	87.1	Confident	71 Å²	71	43.4 Å²	43.4	44%	0.436	25%	0.246	S	C	.	.			trans	-100.2	166.3	-178.8	59.1	0	0	0	0	112.9	T114 R118 L119	T114-T116 PolarHBondContact O-N 2.91Å; T116-R118 PolarHBondContact O-N 2.88Å; T116-L119 PolarHBondContact O-N 3.44Å
117	S	86	Confident	87.6	Confident	95 Å²	95	41.8 Å²	41.8	66%	0.664	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-56.7	-15.3	178.8	-41.8	0	0	0	0	115	L119 L120	S117-L119 PolarHBondContact O-N 2.86Å; S117-L120 WeakPolarHBondContact O-CD1 3.42Å; S117-L120 WeakPolarHBondContact O-CG 3.26Å; S117-L120 PolarHBondContact O-N 3.17Å
118	R	88.1	Confident	88.1	Confident	236 Å²	236	36.3 Å²	36.3	89%	0.891	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-65.6	-18.6	174.5	-65.1	-178.4	178.7	175.3	-0.3	113.5	T116	T116-R118 PolarHBondContact O-N 2.88Å
119	L	87.5	Confident	88.4	Confident	24 Å²	24	36.2 Å²	36.2	13%	0.126	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-99.1	3.8	-176.2	-59.3	172.8	0	0	0	113.2	V110 T116 S117 S122 V124 Y240	V110-L119 HydrophobicContact CG1-CD1 4.03Å; V110-L119 HydrophobicContact CG2-CD1 4.22Å; T116-L119 PolarHBondContact O-N 3.44Å; S117-L119 PolarHBondContact O-N 2.86Å; L119-S122 WeakPolarHBondContact CA-OG 3.05Å; L119-S122 WeakPolarHBondContact O-CB 3.5Å; L119-S122 PolarHBondContact O-N 3.13Å; L119-S122 VanDerWaalsContact O-N 3.16Å; L119-S122 PolarHBondContact O-OG 3.36Å; L119-V124 HydrophobicContact CB-CG1 3.84Å; L119-V124 HydrophobicContact CD1-CG1 3.93Å; L119-V124 HydrophobicContact CD2-CG1 4.28Å; L119-V124 HydrophobicContact CG-CG1 4.23Å; L119-Y240 HydrophobicContact CB-CD1 4.28Å
120	L	88.3	Confident	88.4	Confident	69 Å²	69	35.7 Å²	35.7	36%	0.361	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	135.5	176.9	-71.5	169.2	0	0	0	111	S117 S122 Y240 C242	S117-L120 WeakPolarHBondContact O-CD1 3.42Å; S117-L120 WeakPolarHBondContact O-CG 3.26Å; S117-L120 PolarHBondContact O-N 3.17Å; L120-S122 PolarHBondContact O-N 3.24Å; L120-Y240 HydrophobicContact CD2-CD1 3.72Å; L120-Y240 HydrophobicContact CD2-CE1 3.69Å; L120-Y240 HydrophobicContact CD2-CG 4.43Å; L120-Y240 HydrophobicContact CG-CD1 4.15Å; L120-Y240 HydrophobicContact CG-CE1 4.13Å; L120-C242 HydrophobicContact CD2-CB 4.1Å
121	G	85.6	Confident	88.1	Confident	20 Å²	20	37.6 Å²	37.6	21%	0.206	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	-10.7	-176.5	0	0	0	0	0	114.9	A68 Y240	A68-G121 PolarHBondContact N-O 3.39Å; A68-G121 VanDerWaalsContact N-O 3.14Å; G121-Y240 PolarHBondContact N-O 2.84Å
122	S	87.3	Confident	87.9	Confident	5 Å²	5	42 Å²	42	4%	0.035	22%	0.216	C	C	.	.	S	Bend	trans	-95.1	155.8	-179.9	82.9	0	0	0	0	112.3	M65 L119 L120 Y240	M65-S122 VanDerWaalsContact O-CB 3.29Å; M65-S122 WeakPolarHBondContact O-CB 3.09Å; L119-S122 WeakPolarHBondContact CA-OG 3.05Å; L119-S122 WeakPolarHBondContact O-CB 3.5Å; L119-S122 PolarHBondContact O-N 3.13Å; L119-S122 VanDerWaalsContact O-N 3.16Å; L119-S122 PolarHBondContact O-OG 3.36Å; L120-S122 PolarHBondContact O-N 3.24Å; S122-Y240 PolarHBondContact O-N 2.93Å
123	M	88.4	Confident	87.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	134.9	168.7	-170.3	158.7	-65	0	0	110.4	M65 A68 L72 L101 F105 K108 I237 T239	M65-M123 PolarHBondContact O-N 2.95Å; A68-M123 HydrophobicContact CB-CB 4.1Å; A68-M123 HydrophobicContact CB-CE 4.14Å; L72-M123 HydrophobicContact CD1-CE 3.75Å; L72-M123 HydrophobicContact CD2-CE 4.14Å; L72-M123 HydrophobicContact CG-CE 4.17Å; L101-M123 HydrophobicContact CB-SD 4.19Å; L101-M123 HydrophobicContact CD1-CE 3.61Å; L101-M123 HydrophobicContact CD1-SD 3.4Å; L101-M123 WeakPolarHBondContact CD1-SD 3.47Å; L101-M123 HydrophobicContact CG-SD 4.42Å; F105-M123 HydrophobicContact CE1-CG 3.83Å; F105-M123 HydrophobicContact CE1-SD 3.93Å; F105-M123 HydrophobicContact CZ-SD 4.35Å; K108-M123 WeakPolarHBondContact CD-O 3.27Å; M123-I237 HydrophobicContact CG-CG2 4.31Å; M123-I237 HydrophobicContact SD-CG2 3.97Å; M123-T239 HydrophobicContact CE-CG2 3.86Å
124	V	91	Very high	87.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.8	179.9	-65.8	0	0	0	0	110.5	V110 L115 L119 V126 I237 G238 M259	V110-V124 HydrophobicContact CG2-CB 4.36Å; L115-V124 HydrophobicContact CD1-CG2 4.11Å; L119-V124 HydrophobicContact CB-CG1 3.84Å; L119-V124 HydrophobicContact CD1-CG1 3.93Å; L119-V124 HydrophobicContact CD2-CG1 4.28Å; L119-V124 HydrophobicContact CG-CG1 4.23Å; V124-V126 HydrophobicContact CG2-CG2 4.07Å; V124-I237 WeakPolarHBondContact O-CA 3.46Å; V124-G238 PolarHBondContact N-O 3.12Å; V124-G238 PolarHBondContact O-N 3.34Å; V124-M259 HydrophobicContact CG2-SD 3.58Å; V124-M259 VanDerWaalsContact CG2-SD 3.58Å
125	C	90.6	Very high	87.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	118.7	170.5	176	0	0	0	0	108.1	F105 K108 H109 V110 Q235 I237	F105-C125 HydrophobicContact CB-CB 3.98Å; F105-C125 HydrophobicContact CD1-CB 4.45Å; F105-C125 HydrophobicContact CD2-CB 3.83Å; F105-C125 HydrophobicContact CG-CB 3.8Å; K108-C125 PolarHBondContact O-N 3.47Å; H109-C125 WeakPolarHBondContact CA-O 3.39Å; H109-C125 HydrophobicContact CB-CB 4.46Å; H109-C125 PolarHBondContact ND1-SG 3.19Å; V110-C125 PolarHBondContact N-O 3.45Å; C125-Q235 WeakPolarHBondContact SG-CG 3.28Å; C125-Q235 PolarHBondContact SG-NE2 2.95Å; C125-I237 HydrophobicContact CB-CG1 4.03Å
126	V	90.3	Very high	87.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.7	-177.1	-175.1	0	0	0	0	110.6	V110 P112 L115 V124 V216 Q235 V236 M259	V110-V126 HydrophobicContact CG2-CG2 4.23Å; V110-V126 WeakPolarHBondContact O-CA 3.32Å; P112-V126 HydrophobicContact CG-CG1 3.77Å; L115-V126 HydrophobicContact CD1-CG2 3.86Å; V124-V126 HydrophobicContact CG2-CG2 4.07Å; V126-V216 HydrophobicContact CG1-CG1 4.22Å; V126-Q235 WeakPolarHBondContact O-CA 3.45Å; V126-V236 PolarHBondContact N-O 3.38Å; V126-V236 PolarHBondContact O-N 3.15Å; V126-M259 HydrophobicContact CB-CE 3.86Å; V126-M259 HydrophobicContact CB-SD 4.38Å; V126-M259 HydrophobicContact CG2-CE 3.73Å; V126-M259 HydrophobicContact CG2-SD 3.61Å
127	E	89	Confident	87.4	Confident	9 Å²	9	46.3 Å²	46.3	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	143.1	174.7	54.2	165.9	-142.5	0	0	112.2	H109 V110 P112 M203 K206 L526	H109-E127 IonicContact CD2-OE2 3.87Å; H109-E127 IonicContact CE1-OE2 3.77Å; H109-E127 IonicContact NE2-OE2 3.66Å; H109-E127 PolarHBondContact NE2-OE2 2.93Å; V110-E127 PolarHBondContact O-N 3.38Å; P112-E127 VanDerWaalsContact CD-O 3.25Å; P112-E127 WeakPolarHBondContact CD-O 3.46Å; E127-M203 HydrophobicContact CB-CE 4.17Å; E127-K206 WeakPolarHBondContact OE1-CD 3.28Å; E127-K206 WeakPolarHBondContact OE1-CE 3.36Å; E127-K206 IonicContact OE1-NZ 3.25Å; E127-K206 PolarHBondContact OE1-NZ 3.5Å; E127-K206 IonicContact OE2-NZ 2.87Å; E127-K206 PolarHBondContact OE2-NZ 3.11Å; E127-L526 WeakPolarHBondContact OE1-CD2 3.31Å
128	G	89.3	Confident	87.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-170.3	174	0	0	0	0	0	115.3	Q201 V234	G128-Q201 CarbonylContact C-O 3.51Å; G128-Q201 WeakPolarHBondContact CA-O 3.22Å; G128-V234 PolarHBondContact N-O 2.89Å; G128-V234 PolarHBondContact O-N 2.87Å
129	I	88.4	Confident	87.5	Confident	34 Å²	34	37 Å²	37	17%	0.174	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.4	175.6	-57.6	178.4	0	0	0	108.4	T131 V200 Q201 M203 P204 D232 R233	I129-T131 PolarHBondContact O-N 2.94Å; I129-V200 WeakPolarHBondContact O-CA 3.46Å; I129-Q201 PolarHBondContact N-O 3.17Å; I129-Q201 PolarHBondContact O-N 2.88Å; I129-M203 HydrophobicContact CG1-CG 4.24Å; I129-P204 HydrophobicContact CD1-CG 4.46Å; I129-D232 WeakPolarHBondContact CA-O 3.24Å; I129-R233 HydrophobicContact CG1-CG 4.2Å
130	I	88.6	Confident	87.5	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	125.1	174.5	-64.6	161.2	0	0	0	109.5	I198 V200 V228 P230 G231 D232 V234	I130-I198 HydrophobicContact CD1-CD1 4.19Å; I130-I198 HydrophobicContact CG1-CD1 4.26Å; I130-V200 HydrophobicContact CG1-CG2 3.84Å; I130-V228 HydrophobicContact CD1-CB 3.33Å; I130-V228 HydrophobicContact CD1-CG1 4.01Å; I130-V228 HydrophobicContact CD1-CG2 3.39Å; I130-P230 WeakPolarHBondContact O-CA 3.41Å; I130-G231 PolarHBondContact O-N 2.94Å; I130-D232 PolarHBondContact N-O 2.99Å; I130-D232 VanDerWaalsContact N-O 3.1Å; I130-V234 HydrophobicContact CD1-CB 4.3Å; I130-V234 HydrophobicContact CD1-CG1 3.6Å; I130-V234 HydrophobicContact CD1-CG2 3.75Å; I130-V234 HydrophobicContact CG1-CG1 4.33Å; I130-V234 HydrophobicContact CG1-CG2 3.7Å
131	T	83.4	Confident	87.4	Confident	52 Å²	52	35.5 Å²	35.5	32%	0.319	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-32.9	-179.8	46.6	0	0	0	0	112.4	I129 T199 Q201	I129-T131 PolarHBondContact O-N 2.94Å; T131-T199 PolarHBondContact N-O 3.37Å; T131-T199 PolarHBondContact OG1-O 3.06Å; T131-T199 PolarHBondContact OG1-OG1 2.93Å; T131-Q201 HydrophobicContact CG2-CB 3.56Å; T131-Q201 HydrophobicContact CG2-CG 4.38Å; T131-Q201 VanDerWaalsContact CG2-OE1 3.23Å
132	K	82.9	Confident	87.5	Confident	102 Å²	102	36.2 Å²	36.2	44%	0.443	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.8	179.5	-53.3	178.4	-177.7	177.6	0	108.9	I198 T199	K132-I198 CarbonylContact O-C 3.49Å; K132-I198 VanDerWaalsContact O-CA 3.28Å; K132-I198 WeakPolarHBondContact O-CA 3.44Å; K132-T199 HydrophobicContact CB-CG2 4.4Å; K132-T199 VanDerWaalsContact CB-OG1 3.23Å; K132-T199 WeakPolarHBondContact CB-OG1 3.49Å; K132-T199 WeakPolarHBondContact CG-OG1 3.3Å; K132-T199 PolarHBondContact N-OG1 2.8Å; K132-T199 PolarHBondContact O-N 2.87Å
133	C	84.3	Confident	87.6	Confident	23 Å²	23	36 Å²	36	16%	0.155	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.3	157.3	-58.5	0	0	0	0	107.6	I198 V228 P230	C133-I198 HydrophobicContact CB-CG2 4.31Å; C133-V228 PolarHBondContact SG-O 3.38Å; C133-P230 HydrophobicContact CB-CG 4.38Å
134	S	85.4	Confident	87.7	Confident	31 Å²	31	36.1 Å²	36.1	22%	0.217	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-81.6	165.8	164.7	-167.2	0	0	0	0	110.1	Q196 T197	S134-Q196 WeakPolarHBondContact O-CG 3.44Å; S134-Q196 PolarHBondContact O-NE2 2.92Å; S134-T197 WeakPolarHBondContact CB-O 3.41Å; S134-T197 WeakPolarHBondContact CB-OG1 3.46Å; S134-T197 PolarHBondContact N-O 3.32Å
135	L	84.6	Confident	87.6	Confident	115 Å²	115	36.2 Å²	36.2	60%	0.602	19%	0.19	S	C	*	.	P	Polyproline II helix	trans	-75	146.4	175.3	-148.4	142	0	0	0	109.6	R137	L135-R137 PolarHBondContact O-N 3.12Å
136	V	89.3	Confident	87.6	Confident	51 Å²	51	39.4 Å²	39.4	31%	0.309	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-64.1	130.3	178.7	-176.7	0	0	0	0	110.1	D194 V225	V136-D194 HydrophobicContact CG1-CB 3.93Å; V136-V225 HydrophobicContact CB-CG1 4.03Å; V136-V225 HydrophobicContact CG1-CG1 3.62Å; V136-V225 HydrophobicContact CG2-CG1 3.3Å
137	R	87.5	Confident	87.5	Confident	106 Å²	106	39.4 Å²	39.4	40%	0.4	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.4	178.7	-69.3	-178.9	169.3	-160.9	-9.9	110.8	L135 H195 E389	L135-R137 PolarHBondContact O-N 3.12Å; R137-H195 PolarHBondContact N-O 2.75Å; R137-H195 PolarHBondContact O-N 2.83Å; R137-E389 IonicContact CZ-OE1 3.78Å; R137-E389 IonicContact NH2-OE1 2.7Å; R137-E389 PolarHBondContact NH2-OE1 2.98Å
138	P	89.4	Confident	87.4	Confident	95 Å²	95	42.3 Å²	42.3	62%	0.617	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	133.2	172.3	29.6	-33.6	0	0	0	110	K193	P138-K193 CarbonylContact C-O 3.54Å; P138-K193 WeakPolarHBondContact CA-O 3.5Å
139	K	87.3	Confident	87.2	Confident	41 Å²	41	45.8 Å²	45.8	18%	0.178	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.8	176.8	172.1	166.6	172.7	169.8	0	109.3	D160 T162 Y192 K193 H195	K139-D160 IonicContact NZ-OD2 3.39Å; K139-D160 PolarHBondContact NZ-OD2 2.96Å; K139-T162 PolarHBondContact NZ-OG1 2.87Å; K139-Y192 CarbonylContact O-C 3.58Å; K139-Y192 WeakPolarHBondContact O-CA 3.39Å; K139-K193 HydrophobicContact CB-CG 4.13Å; K139-K193 HydrophobicContact CG-CG 4.5Å; K139-K193 PolarHBondContact N-O 2.95Å; K139-K193 PolarHBondContact O-N 3.17Å; K139-H195 HydrophobicContact CB-CB 4.16Å
140	V	87.1	Confident	86.9	Confident	29 Å²	29	45.8 Å²	45.8	18%	0.176	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	135.5	178.3	66.7	0	0	0	0	111	Y158 Y192	V140-Y158 HydrophobicContact CB-CD2 4.38Å; V140-Y158 HydrophobicContact CG1-CD2 3.69Å; V140-Y158 HydrophobicContact CG1-CE2 4.19Å; V140-Y158 HydrophobicContact CG1-CG 4.07Å; V140-Y158 HydrophobicContact CG2-CD2 3.82Å; V140-Y158 HydrophobicContact CG2-CE2 4.05Å; V140-Y192 HydrophobicContact CB-CD1 3.98Å; V140-Y192 HydrophobicContact CB-CE1 3.85Å; V140-Y192 HydrophobicContact CG2-CD1 4.35Å; V140-Y192 HydrophobicContact CG2-CE1 3.99Å
141	V	85.3	Confident	86.8	Confident	31 Å²	31	53.4 Å²	53.4	19%	0.188	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-47.2	172.8	-178.8	0	0	0	0	110	K157 Y158 I191 K193	V141-K157 CarbonylContact O-C 3.22Å; V141-K157 WeakPolarHBondContact O-CA 3.48Å; V141-Y158 PolarHBondContact O-N 3.3Å; V141-I191 HydrophobicContact CB-CG2 4.41Å; V141-I191 PolarHBondContact N-O 2.82Å; V141-K193 HydrophobicContact CG2-CB 3.84Å; V141-K193 HydrophobicContact CG2-CD 3.74Å; V141-K193 HydrophobicContact CG2-CG 3.59Å
142	R	87.8	Confident	87	Confident	36 Å²	36	56.5 Å²	56.5	14%	0.136	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	126.5	179.9	-173.2	171.7	66.4	86.2	15.6	109.2	E95 E155 R156 K157 L189 S190 I191	E95-R142 IonicContact OE1-NE 3.25Å; E95-R142 IonicContact OE2-NE 3.64Å; E95-R142 PolarHBondContact OE2-NE 2.7Å; R142-E155 IonicContact CZ-OE2 3.19Å; R142-E155 IonicContact NH1-OE1 2.75Å; R142-E155 PolarHBondContact NH1-OE1 3.01Å; R142-E155 IonicContact NH1-OE2 2.78Å; R142-E155 PolarHBondContact NH1-OE2 2.94Å; R142-R156 WeakPolarHBondContact CA-O 3.26Å; R142-K157 HydrophobicContact CB-CG 4.4Å; R142-K157 HydrophobicContact CG-CG 4.15Å; R142-L189 PolarHBondContact NH2-O 2.82Å; R142-S190 CarbonylContact O-C 3.49Å; R142-S190 VanDerWaalsContact O-CA 3.32Å; R142-S190 WeakPolarHBondContact O-CA 3.49Å; R142-I191 HydrophobicContact CB-CB 4.39Å; R142-I191 PolarHBondContact N-O 2.78Å; R142-I191 PolarHBondContact O-N 3.26Å
143	S	89.6	Confident	87.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.5	169.4	61.6	0	0	0	0	110.7	H145 E155 R156 Y158 S190	S143-H145 WeakPolarHBondContact CB-NE2 3.33Å; S143-H145 PolarHBondContact OG-CD2 2.98Å; S143-H145 PolarHBondContact OG-NE2 3.03Å; S143-E155 WeakPolarHBondContact O-CA 3.44Å; S143-R156 PolarHBondContact N-O 3.2Å; S143-R156 PolarHBondContact O-N 3.3Å; S143-R156 PolarHBondContact OG-O 2.95Å; S143-Y158 VanDerWaalsContact OG-CE2 3.28Å; S143-Y158 WeakPolarHBondContact OG-CE2 3.41Å; S143-Y158 PolarHBondContact OG-OH 3.41Å; S143-S190 WeakPolarHBondContact CA-OG 3.31Å
144	V	90.8	Very high	87.2	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.5	169.9	-176.3	0	0	0	0	108.5	E155 E186 L189 S190	V144-E155 HydrophobicContact CG2-CG 4.21Å; V144-E186 PolarHBondContact O-N 2.9Å; V144-L189 HydrophobicContact CB-CB 3.92Å; V144-L189 HydrophobicContact CG1-CB 4.25Å; V144-L189 HydrophobicContact CG1-CD1 4.26Å; V144-L189 HydrophobicContact CG2-CB 3.82Å; V144-L189 WeakPolarHBondContact CG2-O 3.48Å; V144-S190 PolarHBondContact N-OG 2.9Å
145	H	90.1	Very high	87.2	Confident	3 Å²	3	61.7 Å²	61.7	1%	0.014	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	137.8	179.3	-58.9	-104.4	0	0	0	109.2	S143 T153 M154 Y158 Y173 P174 L183 E184 T185	S143-H145 WeakPolarHBondContact CB-NE2 3.33Å; S143-H145 PolarHBondContact OG-CD2 2.98Å; S143-H145 PolarHBondContact OG-NE2 3.03Å; H145-T153 CarbonylContact O-C 3.51Å; H145-T153 VanDerWaalsContact O-CA 3.27Å; H145-T153 WeakPolarHBondContact O-CA 3.41Å; H145-M154 PolarHBondContact N-O 3.26Å; H145-M154 PolarHBondContact O-N 3.4Å; H145-Y158 PolarHBondContact NE2-OH 2.96Å; H145-Y173 WeakPolarHBondContact CE1-CB 3.48Å; H145-Y173 AromaticContact CE1-CD1 3.13Å; H145-Y173 WeakPolarHBondContact CE1-CD1 3.45Å; H145-Y173 AromaticContact CE1-CG 3.62Å; H145-Y173 AromaticContact NE2-CD1 3.65Å; H145-P174 VanDerWaalsContact CE1-CD 3.4Å; H145-P174 WeakPolarHBondContact CE1-CD 3.01Å; H145-P174 PolarHBondContact CE1-O 3.29Å; H145-P174 PolarHBondContact ND1-O 3.42Å; H145-P174 WeakPolarHBondContact NE2-CD 3.43Å; H145-L183 HydrophobicContact CB-CB 4.32Å; H145-L183 HydrophobicContact CB-CD2 3.86Å; H145-L183 HydrophobicContact CB-CG 4.48Å; H145-E184 CarbonylContact C-O 3.57Å; H145-E184 VanDerWaalsContact CA-O 3.23Å; H145-E184 WeakPolarHBondContact CA-O 3.38Å; H145-T185 WeakPolarHBondContact CE1-CG2 3.22Å; H145-T185 VanDerWaalsContact ND1-CG2 3.34Å; H145-T185 WeakPolarHBondContact ND1-CG2 3.42Å
146	Y	89.8	Confident	87.3	Confident	66 Å²	66	60.5 Å²	60.5	26%	0.259	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134	175	-179.6	-111.1	0	0	0	109.8	P148 K151 T153 E184 E186	Y146-P148 HydrophobicContact CD1-CG 4.19Å; Y146-P148 HydrophobicContact CE1-CB 4.3Å; Y146-P148 HydrophobicContact CE1-CG 4.24Å; Y146-P148 WeakPolarHBondContact O-CD 3.49Å; Y146-K151 HydrophobicContact CE2-CB 4.49Å; Y146-T153 HydrophobicContact CD2-CG2 3.94Å; Y146-E184 PolarHBondContact N-O 2.78Å; Y146-E184 PolarHBondContact O-N 3.4Å; Y146-E186 WeakPolarHBondContact CB-OE1 3.48Å
147	C	87.7	Confident	87	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.317	C	S	.	.			trans	-100.7	112	169	-179.2	0	0	0	0	109.9	A149 T150 K151 K152 D177 L183	C147-A149 PolarHBondContact O-N 3.32Å; C147-T150 VanDerWaalsContact CB-OG1 3.27Å; C147-T150 WeakPolarHBondContact CB-OG1 3.45Å; C147-T150 PolarHBondContact O-N 3.44Å; C147-T150 PolarHBondContact SG-OG1 2.72Å; C147-K151 VanDerWaalsContact O-CA 3.3Å; C147-K151 WeakPolarHBondContact O-CA 3.29Å; C147-K151 PolarHBondContact O-N 2.67Å; C147-K152 PolarHBondContact N-O 2.81Å; C147-K152 VanDerWaalsContact N-O 3.07Å; C147-D177 VanDerWaalsContact CB-OD2 3.28Å; C147-D177 WeakPolarHBondContact CB-OD2 3.31Å; C147-D177 PolarHBondContact SG-OD2 3.14Å; C147-L183 HydrophobicContact CB-CD2 3.94Å
148	P	86.9	Confident	86.8	Confident	70 Å²	70	59.5 Å²	59.5	46%	0.455	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.5	178.7	-25.5	35.3	0	0	0	114.3	Y146	Y146-P148 HydrophobicContact CD1-CG 4.19Å; Y146-P148 HydrophobicContact CE1-CB 4.3Å; Y146-P148 HydrophobicContact CE1-CG 4.24Å; Y146-P148 WeakPolarHBondContact O-CD 3.49Å
149	A	84.9	Confident	86.4	Confident	73 Å²	73	56.7 Å²	56.7	60%	0.603	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-44.6	-177.9	0	0	0	0	0	112.8	C147 N181	C147-A149 PolarHBondContact O-N 3.32Å; A149-N181 HydrophobicContact CB-CB 4.49Å
150	T	83.1	Confident	85.9	Confident	34 Å²	34	57.9 Å²	57.9	21%	0.209	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-14.2	-178.1	67.3	0	0	0	0	113.2	C147 K152 E179 N181	C147-T150 VanDerWaalsContact CB-OG1 3.27Å; C147-T150 WeakPolarHBondContact CB-OG1 3.45Å; C147-T150 PolarHBondContact O-N 3.44Å; C147-T150 PolarHBondContact SG-OG1 2.72Å; T150-K152 PolarHBondContact O-N 3.13Å; T150-K152 PolarHBondContact OG1-N 2.88Å; T150-E179 WeakPolarHBondContact CG2-OE2 3.43Å; T150-N181 WeakPolarHBondContact CG2-ND2 3.09Å
151	K	86.1	Confident	85.4	Confident	161 Å²	161	58.9 Å²	58.9	70%	0.7	30%	0.296	S	S	*	.			trans	57	17.7	-171.1	-54.5	-176.6	-180	179.8	0	114.2	Y146 C147	Y146-K151 HydrophobicContact CE2-CB 4.49Å; C147-K151 VanDerWaalsContact O-CA 3.3Å; C147-K151 WeakPolarHBondContact O-CA 3.29Å; C147-K151 PolarHBondContact O-N 2.67Å
152	K	86.9	Confident	85	Confident	117 Å²	117	58 Å²	58	51%	0.509	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-87.3	137.8	175.7	-62	171.9	-173.5	166.3	0	109.2	C147 T150 E179	C147-K152 PolarHBondContact N-O 2.81Å; C147-K152 VanDerWaalsContact N-O 3.07Å; T150-K152 PolarHBondContact O-N 3.13Å; T150-K152 PolarHBondContact OG1-N 2.88Å; K152-E179 IonicContact NZ-OE1 2.68Å
153	T	86.4	Confident	84.5	Confident	82 Å²	82	57.5 Å²	57.5	50%	0.503	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	121.6	164.3	48.2	0	0	0	0	109	H145 Y146	H145-T153 CarbonylContact O-C 3.51Å; H145-T153 VanDerWaalsContact O-CA 3.27Å; H145-T153 WeakPolarHBondContact O-CA 3.41Å; Y146-T153 HydrophobicContact CD2-CG2 3.94Å
154	M	85.3	Confident	83.5	Confident	66 Å²	66	59.4 Å²	59.4	33%	0.325	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	132.7	171.1	-68.4	-149.2	-53.3	0	0	110.6	H145 D177 L183	H145-M154 PolarHBondContact N-O 3.26Å; H145-M154 PolarHBondContact O-N 3.4Å; M154-D177 WeakPolarHBondContact CE-OD1 3.44Å; M154-L183 HydrophobicContact CE-CD1 3.44Å; M154-L183 VanDerWaalsContact CE-CD1 3.44Å; M154-L183 HydrophobicContact CE-CD2 4.13Å; M154-L183 HydrophobicContact CE-CG 4.39Å
155	E	86.4	Confident	82.4	Confident	118 Å²	118	63.1 Å²	63.1	55%	0.551	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	138	174	-53.1	-162	164.5	0	0	110.5	R142 S143 V144	R142-E155 IonicContact CZ-OE2 3.19Å; R142-E155 IonicContact NH1-OE1 2.75Å; R142-E155 PolarHBondContact NH1-OE1 3.01Å; R142-E155 IonicContact NH1-OE2 2.78Å; R142-E155 PolarHBondContact NH1-OE2 2.94Å; S143-E155 WeakPolarHBondContact O-CA 3.44Å; V144-E155 HydrophobicContact CG2-CG 4.21Å
156	R	84.8	Confident	80.8	Confident	89 Å²	89	66 Å²	66	34%	0.336	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	123.3	174.6	-168.8	177.2	-176.7	101.8	-1	110.1	R142 S143 Y158 S170	R142-R156 WeakPolarHBondContact CA-O 3.26Å; S143-R156 PolarHBondContact N-O 3.2Å; S143-R156 PolarHBondContact O-N 3.3Å; S143-R156 PolarHBondContact OG-O 2.95Å; R156-Y158 HydrophobicContact CG-CE1 4.42Å; R156-S170 PolarHBondContact NH2-OG 2.87Å
157	K	84.1	Confident	79.7	Confident	111 Å²	111	70.9 Å²	70.9	48%	0.483	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	141.9	171.2	-67.3	-169.6	170.8	-160.4	0	110.9	E95 V141 R142	E95-K157 WeakPolarHBondContact OE1-CE 3.5Å; E95-K157 IonicContact OE1-NZ 3.18Å; E95-K157 PolarHBondContact OE1-NZ 3.35Å; V141-K157 CarbonylContact O-C 3.22Å; V141-K157 WeakPolarHBondContact O-CA 3.48Å; R142-K157 HydrophobicContact CB-CG 4.4Å; R142-K157 HydrophobicContact CG-CG 4.15Å
158	Y	84.1	Confident	78.7	Confident	25 Å²	25	74.5 Å²	74.5	10%	0.098	39%	0.393	C	S	.	.			trans	-115	103.2	177.5	-63.3	-80.1	0	0	0	110.4	V140 V141 S143 H145 R156 S170 Y173 P174	V140-Y158 HydrophobicContact CB-CD2 4.38Å; V140-Y158 HydrophobicContact CG1-CD2 3.69Å; V140-Y158 HydrophobicContact CG1-CE2 4.19Å; V140-Y158 HydrophobicContact CG1-CG 4.07Å; V140-Y158 HydrophobicContact CG2-CD2 3.82Å; V140-Y158 HydrophobicContact CG2-CE2 4.05Å; V141-Y158 PolarHBondContact O-N 3.3Å; S143-Y158 VanDerWaalsContact OG-CE2 3.28Å; S143-Y158 WeakPolarHBondContact OG-CE2 3.41Å; S143-Y158 PolarHBondContact OG-OH 3.41Å; H145-Y158 PolarHBondContact NE2-OH 2.96Å; R156-Y158 HydrophobicContact CG-CE1 4.42Å; Y158-S170 WeakPolarHBondContact CE1-O 3.48Å; Y158-Y173 HydrophobicContact CE2-CD1 4.45Å; Y158-Y173 HydrophobicContact CE2-CE1 4.19Å; Y158-Y173 WeakPolarHBondContact OH-CA 3.46Å; Y158-Y173 WeakPolarHBondContact OH-CD1 3.24Å; Y158-P174 WeakPolarHBondContact OH-CD 3.42Å
159	T	80.4	Confident	77.9	Confident	37 Å²	37	73 Å²	73	23%	0.227	38%	0.384	C	S	.	.			trans	-92.1	143.3	166.6	49.4	0	0	0	0	109.7	D165 F167 S169	T159-D165 HydrophobicContact CG2-CB 3.98Å; T159-F167 VanDerWaalsContact CB-O 3.24Å; T159-F167 WeakPolarHBondContact CB-O 3.26Å; T159-F167 PolarHBondContact OG1-O 3.28Å; T159-S169 PolarHBondContact O-N 3.42Å; T159-S169 PolarHBondContact OG1-N 3.32Å
160	D	76.5	Confident	77.1	Confident	65 Å²	65	72.5 Å²	72.5	35%	0.348	38%	0.376	S	S	.	.			trans	-132.8	164.5	-178.5	177.7	28	0	0	0	109.2	K139 T162 S163	K139-D160 IonicContact NZ-OD2 3.39Å; K139-D160 PolarHBondContact NZ-OD2 2.96Å; D160-T162 PolarHBondContact O-N 3.45Å; D160-T162 PolarHBondContact OD2-OG1 3.39Å; D160-S163 PolarHBondContact N-OG 3.01Å; D160-S163 PolarHBondContact O-N 2.86Å; D160-S163 PolarHBondContact O-OG 2.96Å
161	M	75.7	Confident	76.3	Confident	51 Å²	51	75.2 Å²	75.2	25%	0.251	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-4.5	177.7	-159.7	62.8	62.9	0	0	113.4	P168 R241 L243	M161-P168 HydrophobicContact CE-CB 4.36Å; M161-P168 HydrophobicContact CE-CG 3.85Å; M161-R241 PolarHBondContact O-NE 2.82Å; M161-R241 PolarHBondContact O-NH2 3.08Å; M161-R241 PolarHBondContact SD-NH2 3.49Å; M161-L243 HydrophobicContact CB-CD2 3.75Å; M161-L243 HydrophobicContact CG-CD2 3.43Å; M161-L243 VanDerWaalsContact CG-CD2 3.43Å; M161-L243 WeakPolarHBondContact O-CD2 3.42Å
162	T	77.9	Confident	76	Confident	12 Å²	12	73.7 Å²	73.7	7%	0.074	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-12.6	173	55.3	0	0	0	0	114.1	K139 D160 I219 L243 I258 I260	K139-T162 PolarHBondContact NZ-OG1 2.87Å; D160-T162 PolarHBondContact O-N 3.45Å; D160-T162 PolarHBondContact OD2-OG1 3.39Å; T162-I219 HydrophobicContact CG2-CD1 3.58Å; T162-L243 HydrophobicContact CG2-CD1 4.14Å; T162-L243 HydrophobicContact CG2-CD2 4.46Å; T162-I258 HydrophobicContact CG2-CD1 4.25Å; T162-I260 WeakPolarHBondContact O-CD1 3.42Å
163	S	75.9	Confident	75.8	Confident	25 Å²	25	72.2 Å²	72.2	18%	0.175	39%	0.392	C	S	.	.	S	Bend	trans	-82.1	161.3	168.2	43.6	0	0	0	0	111	D160 D165 R241	D160-S163 PolarHBondContact N-OG 3.01Å; D160-S163 PolarHBondContact O-N 2.86Å; D160-S163 PolarHBondContact O-OG 2.96Å; S163-D165 PolarHBondContact O-N 3.18Å; S163-R241 PolarHBondContact O-NH1 3.48Å
164	L	69.8	Low	75.6	Confident	41 Å²	41	69.5 Å²	69.5	22%	0.215	38%	0.376	C	S	.	.	S	Bend	trans	-58.2	-33.8	179.5	-65.5	171.4	0	0	0	112.4	F69 L72	F69-L164 HydrophobicContact CD1-CD2 3.8Å; F69-L164 HydrophobicContact CE1-CD2 4.28Å; L72-L164 HydrophobicContact CD1-CD2 4.37Å
165	D	67.4	Low	75.5	Confident	79 Å²	79	71.3 Å²	71.3	42%	0.422	39%	0.39	S	S	.	.	S	Bend	trans	-60.5	142.1	173.6	-92.1	-34.8	0	0	0	113.5	T159 S163 R241	T159-D165 HydrophobicContact CG2-CB 3.98Å; S163-D165 PolarHBondContact O-N 3.18Å; D165-R241 PolarHBondContact O-NH2 3.33Å
166	A	56.6	Low	75.4	Confident	65 Å²	65	71.4 Å²	71.4	54%	0.537	39%	0.389	S	S	.	.	S	Bend	trans	-81.6	-19.1	-177	0	0	0	0	0	114.1	P168	A166-P168 WeakPolarHBondContact O-CD 3.37Å
167	F	67.6	Low	75.1	Confident	167 Å²	167	68 Å²	68	73%	0.732	38%	0.378	S	S	*	.			trans	-95.6	111.7	-172.7	-71.1	-79.6	0	0	0	112.1	T159 S169	T159-F167 VanDerWaalsContact CB-O 3.24Å; T159-F167 WeakPolarHBondContact CB-O 3.26Å; T159-F167 PolarHBondContact OG1-O 3.28Å; F167-S169 PolarHBondContact O-N 3.01Å
168	P	65.4	Low	75	Confident	76 Å²	76	72.2 Å²	72.2	49%	0.494	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-74.6	117.3	172.4	30.4	-33.3	0	0	0	110.3	M161 A166	M161-P168 HydrophobicContact CE-CB 4.36Å; M161-P168 HydrophobicContact CE-CG 3.85Å; A166-P168 WeakPolarHBondContact O-CD 3.37Å
169	S	69.6	Low	74.7	Confident	39 Å²	39	76.6 Å²	76.6	27%	0.273	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-71.9	155.5	168.5	-172	0	0	0	0	110.1	T159 F167 A171	T159-S169 PolarHBondContact O-N 3.42Å; T159-S169 PolarHBondContact OG1-N 3.32Å; F167-S169 PolarHBondContact O-N 3.01Å; S169-A171 PolarHBondContact O-N 3.38Å
170	S	69.1	Low	74.7	Confident	62 Å²	62	80.1 Å²	80.1	43%	0.434	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-67.4	118.8	170.1	51.2	0	0	0	0	109.6	R156 Y158 I172	R156-S170 PolarHBondContact NH2-OG 2.87Å; Y158-S170 WeakPolarHBondContact CE1-O 3.48Å; S170-I172 PolarHBondContact O-N 3.24Å
171	A	66.3	Low	75.1	Confident	91 Å²	91	79 Å²	79	75%	0.752	43%	0.432	S	S	*	.			trans	-71.6	25.4	-179.6	0	0	0	0	0	114.2	S169	S169-A171 PolarHBondContact O-N 3.38Å
172	I	80.6	Confident	75.5	Confident	129 Å²	129	81 Å²	81	66%	0.662	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-101.7	127.5	-178.3	-58.5	171.7	0	0	0	107.4	S170	S170-I172 PolarHBondContact O-N 3.24Å
173	Y	82.8	Confident	76	Confident	86 Å²	86	81.6 Å²	81.6	34%	0.337	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-65	129.8	171.8	-72.9	-78.4	0	0	0	110.5	H145 Y158 T175 T185	H145-Y173 WeakPolarHBondContact CE1-CB 3.48Å; H145-Y173 AromaticContact CE1-CD1 3.13Å; H145-Y173 WeakPolarHBondContact CE1-CD1 3.45Å; H145-Y173 AromaticContact CE1-CG 3.62Å; H145-Y173 AromaticContact NE2-CD1 3.65Å; Y158-Y173 HydrophobicContact CE2-CD1 4.45Å; Y158-Y173 HydrophobicContact CE2-CE1 4.19Å; Y158-Y173 WeakPolarHBondContact OH-CA 3.46Å; Y158-Y173 WeakPolarHBondContact OH-CD1 3.24Å; Y173-T175 PolarHBondContact O-N 3.5Å; Y173-T185 HydrophobicContact CD1-CG2 4.28Å
174	P	81.9	Confident	76.5	Confident	26 Å²	26	86.3 Å²	86.3	17%	0.169	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-65.2	117.1	172.3	27.6	-33.8	0	0	0	108.9	H145 Y158 L183	H145-P174 VanDerWaalsContact CE1-CD 3.4Å; H145-P174 WeakPolarHBondContact CE1-CD 3.01Å; H145-P174 PolarHBondContact CE1-O 3.29Å; H145-P174 PolarHBondContact ND1-O 3.42Å; H145-P174 WeakPolarHBondContact NE2-CD 3.43Å; Y158-P174 WeakPolarHBondContact OH-CD 3.42Å; P174-L183 HydrophobicContact CB-CD1 4.09Å
175	T	83.2	Confident	77.4	Confident	103 Å²	103	86.4 Å²	86.4	63%	0.632	47%	0.473	S	S	*	.			trans	-95.7	-11.1	178	51.1	0	0	0	0	112.9	Y173 L183	Y173-T175 PolarHBondContact O-N 3.5Å; T175-L183 PolarHBondContact O-N 3.23Å; T175-L183 VanDerWaalsContact O-N 3.13Å
176	K	83.7	Confident	78.4	Confident	121 Å²	121	85.8 Å²	85.8	53%	0.526	47%	0.468	S	S	.	.	B	Isolated β-bridge	trans	-141.8	147	179.7	-61.4	-172.9	-179.4	-173.2	0	112.1	N181 L183	K176-N181 CarbonylContact C-O 3.6Å; K176-N181 WeakPolarHBondContact CA-O 3.5Å; K176-L183 VanDerWaalsContact C-CD1 3.45Å
177	D	78.6	Confident	79.9	Confident	18 Å²	18	89 Å²	89	10%	0.096	47%	0.47	C	S	.	.			trans	-70.3	168.8	168.3	-78	-29.6	0	0	0	112.6	C147 M154 E179 N180 N181 L183	C147-D177 VanDerWaalsContact CB-OD2 3.28Å; C147-D177 WeakPolarHBondContact CB-OD2 3.31Å; C147-D177 PolarHBondContact SG-OD2 3.14Å; M154-D177 WeakPolarHBondContact CE-OD1 3.44Å; D177-E179 PolarHBondContact O-N 3Å; D177-N180 WeakPolarHBondContact O-CA 3.39Å; D177-N180 PolarHBondContact O-N 2.98Å; D177-N181 HydrophobicContact CB-CB 4.33Å; D177-N181 PolarHBondContact N-O 2.77Å; D177-L183 WeakPolarHBondContact OD1-CD2 3.49Å
178	E	80.9	Confident	80.8	Confident	199 Å²	199	85 Å²	85	93%	0.93	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.7	166	-58.8	-171.6	156.5	0	0	112.2	N180	E178-N180 VanDerWaalsContact C-N 3.28Å; E178-N180 PolarHBondContact O-N 3.48Å
179	E	77.8	Confident	81.8	Confident	116 Å²	116	86.1 Å²	86.1	54%	0.542	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	9.6	175	-64.4	172.8	-159.2	0	0	113.2	T150 K152 D177 N181	T150-E179 WeakPolarHBondContact CG2-OE2 3.43Å; K152-E179 IonicContact NZ-OE1 2.68Å; D177-E179 PolarHBondContact O-N 3Å; E179-N181 PolarHBondContact O-N 3.44Å; E179-N181 VanDerWaalsContact O-N 3.16Å; E179-N181 PolarHBondContact OE2-ND2 3.02Å
180	N	80.7	Confident	82.7	Confident	111 Å²	111	84.9 Å²	84.9	59%	0.594	47%	0.468	S	S	*	.			trans	62.2	6.1	-175.5	-87.2	-70.9	0	0	0	116.9	D177 E178	D177-N180 WeakPolarHBondContact O-CA 3.39Å; D177-N180 PolarHBondContact O-N 2.98Å; E178-N180 VanDerWaalsContact C-N 3.28Å; E178-N180 PolarHBondContact O-N 3.48Å
181	N	85.1	Confident	83.6	Confident	42 Å²	42	84.8 Å²	84.8	23%	0.225	46%	0.462	C	S	.	.			trans	-64.3	145	174.1	-63.5	-48.7	0	0	0	111.4	A149 T150 K176 D177 E179	A149-N181 HydrophobicContact CB-CB 4.49Å; T150-N181 WeakPolarHBondContact CG2-ND2 3.09Å; K176-N181 CarbonylContact C-O 3.6Å; K176-N181 WeakPolarHBondContact CA-O 3.5Å; D177-N181 HydrophobicContact CB-CB 4.33Å; D177-N181 PolarHBondContact N-O 2.77Å; E179-N181 PolarHBondContact O-N 3.44Å; E179-N181 VanDerWaalsContact O-N 3.16Å; E179-N181 PolarHBondContact OE2-ND2 3.02Å
182	P	84.6	Confident	84.7	Confident	94 Å²	94	84.8 Å²	84.8	61%	0.61	44%	0.443	S	S	*	.	B	Isolated β-bridge	trans	-69.5	140.2	176.7	29.8	-34.7	0	0	0	111.5
183	L	87.3	Confident	85.1	Confident	24 Å²	24	80 Å²	80	13%	0.126	42%	0.418	C	S	.	.			trans	-104.2	137	175.7	-75.8	162.5	0	0	0	111.5	H145 C147 M154 P174 T175 K176 D177	H145-L183 HydrophobicContact CB-CB 4.32Å; H145-L183 HydrophobicContact CB-CD2 3.86Å; H145-L183 HydrophobicContact CB-CG 4.48Å; C147-L183 HydrophobicContact CB-CD2 3.94Å; M154-L183 HydrophobicContact CE-CD1 3.44Å; M154-L183 VanDerWaalsContact CE-CD1 3.44Å; M154-L183 HydrophobicContact CE-CD2 4.13Å; M154-L183 HydrophobicContact CE-CG 4.39Å; P174-L183 HydrophobicContact CB-CD1 4.09Å; T175-L183 PolarHBondContact O-N 3.23Å; T175-L183 VanDerWaalsContact O-N 3.13Å; K176-L183 VanDerWaalsContact C-CD1 3.45Å; D177-L183 WeakPolarHBondContact OD1-CD2 3.49Å
184	E	87.8	Confident	85.4	Confident	123 Å²	123	79.7 Å²	79.7	58%	0.575	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	136.7	170.2	-170.9	164.7	-171.1	0	0	109.7	H145 Y146	H145-E184 CarbonylContact C-O 3.57Å; H145-E184 VanDerWaalsContact CA-O 3.23Å; H145-E184 WeakPolarHBondContact CA-O 3.38Å; Y146-E184 PolarHBondContact N-O 2.78Å; Y146-E184 PolarHBondContact O-N 3.4Å
185	T	87.9	Confident	85.8	Confident	43 Å²	43	80.3 Å²	80.3	26%	0.264	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	116.6	-178.2	27.9	0	0	0	0	110.4	H145 Y173 F187	H145-T185 WeakPolarHBondContact CE1-CG2 3.22Å; H145-T185 VanDerWaalsContact ND1-CG2 3.34Å; H145-T185 WeakPolarHBondContact ND1-CG2 3.42Å; Y173-T185 HydrophobicContact CD1-CG2 4.28Å; T185-F187 PolarHBondContact O-N 2.87Å; T185-F187 WeakPolarHBondContact OG1-CZ 3.48Å
186	E	88.6	Confident	86.1	Confident	67 Å²	67	75.6 Å²	75.6	31%	0.313	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	88.6	175.5	-67.7	-166.5	167.7	0	0	110	V144 Y146 G188 L189 S190	V144-E186 PolarHBondContact O-N 2.9Å; Y146-E186 WeakPolarHBondContact CB-OE1 3.48Å; E186-G188 PolarHBondContact O-N 3.33Å; E186-L189 PolarHBondContact O-N 3.23Å; E186-L189 VanDerWaalsContact OE2-CD1 3.32Å; E186-L189 WeakPolarHBondContact OE2-CD1 3.32Å; E186-S190 PolarHBondContact O-N 2.96Å; E186-S190 PolarHBondContact O-OG 3.26Å
187	F	87.8	Confident	86.4	Confident	133 Å²	133	72.2 Å²	72.2	58%	0.583	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	-30.6	-179.5	-61.2	-70	0	0	0	113.4	T185 S190	T185-F187 PolarHBondContact O-N 2.87Å; T185-F187 WeakPolarHBondContact OG1-CZ 3.48Å; F187-S190 PolarHBondContact O-N 2.89Å
188	G	87.9	Confident	87	Confident	82 Å²	82	71.4 Å²	71.4	85%	0.845	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	-24.3	-178.7	0	0	0	0	0	115.3	E186	E186-G188 PolarHBondContact O-N 3.33Å
189	L	86.5	Confident	87.5	Confident	100 Å²	100	63.1 Å²	63.1	52%	0.524	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-9	173.9	-60.9	-175.1	0	0	0	112.6	R142 V144 E186	R142-L189 PolarHBondContact NH2-O 2.82Å; V144-L189 HydrophobicContact CB-CB 3.92Å; V144-L189 HydrophobicContact CG1-CB 4.25Å; V144-L189 HydrophobicContact CG1-CD1 4.26Å; V144-L189 HydrophobicContact CG2-CB 3.82Å; V144-L189 WeakPolarHBondContact CG2-O 3.48Å; E186-L189 PolarHBondContact O-N 3.23Å; E186-L189 VanDerWaalsContact OE2-CD1 3.32Å; E186-L189 WeakPolarHBondContact OE2-CD1 3.32Å
190	S	88.6	Confident	88.2	Confident	12 Å²	12	57.6 Å²	57.6	8%	0.084	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	137.3	177.4	-62.2	0	0	0	0	110.7	R142 S143 V144 E186 F187	R142-S190 CarbonylContact O-C 3.49Å; R142-S190 VanDerWaalsContact O-CA 3.32Å; R142-S190 WeakPolarHBondContact O-CA 3.49Å; S143-S190 WeakPolarHBondContact CA-OG 3.31Å; V144-S190 PolarHBondContact N-OG 2.9Å; E186-S190 PolarHBondContact O-N 2.96Å; E186-S190 PolarHBondContact O-OG 3.26Å; F187-S190 PolarHBondContact O-N 2.89Å
191	I	87.9	Confident	88.7	Confident	61 Å²	61	55.3 Å²	55.3	31%	0.313	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128.4	-176.8	-65.2	175.6	0	0	0	110	E95 V141 R142	E95-I191 VanDerWaalsContact OE2-CD1 3.28Å; E95-I191 WeakPolarHBondContact OE2-CD1 3.32Å; V141-I191 HydrophobicContact CB-CG2 4.41Å; V141-I191 PolarHBondContact N-O 2.82Å; R142-I191 HydrophobicContact CB-CB 4.39Å; R142-I191 PolarHBondContact N-O 2.78Å; R142-I191 PolarHBondContact O-N 3.26Å
192	Y	88.5	Confident	88.9	Confident	91 Å²	91	53.7 Å²	53.7	36%	0.357	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	147.2	175.1	-57.6	-85.9	0	0	0	109.3	K139 V140	K139-Y192 CarbonylContact O-C 3.58Å; K139-Y192 WeakPolarHBondContact O-CA 3.39Å; V140-Y192 HydrophobicContact CB-CD1 3.98Å; V140-Y192 HydrophobicContact CB-CE1 3.85Å; V140-Y192 HydrophobicContact CG2-CD1 4.35Å; V140-Y192 HydrophobicContact CG2-CE1 3.99Å
193	K	88.1	Confident	88.9	Confident	29 Å²	29	49.6 Å²	49.6	13%	0.126	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.2	171.1	68.6	173.8	-172.4	171.4	0	110.7	P138 K139 V141 D221 N222	P138-K193 CarbonylContact C-O 3.54Å; P138-K193 WeakPolarHBondContact CA-O 3.5Å; K139-K193 HydrophobicContact CB-CG 4.13Å; K139-K193 HydrophobicContact CG-CG 4.5Å; K139-K193 PolarHBondContact N-O 2.95Å; K139-K193 PolarHBondContact O-N 3.17Å; V141-K193 HydrophobicContact CG2-CB 3.84Å; V141-K193 HydrophobicContact CG2-CD 3.74Å; V141-K193 HydrophobicContact CG2-CG 3.59Å; K193-D221 IonicContact NZ-OD1 3.53Å; K193-D221 IonicContact NZ-OD2 3.77Å; K193-D221 PolarHBondContact NZ-OD2 3.32Å; K193-N222 VanDerWaalsContact CB-OD1 3.3Å; K193-N222 WeakPolarHBondContact CB-OD1 3.18Å
194	D	90.9	Very high	88.5	Confident	79 Å²	79	52.6 Å²	52.6	42%	0.422	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.6	172.8	-68.4	-44.5	0	0	0	110.7	V136 D221 N222 V225	V136-D194 HydrophobicContact CG1-CB 3.93Å; D194-D221 WeakPolarHBondContact O-CA 3.37Å; D194-N222 PolarHBondContact O-N 3.23Å; D194-V225 HydrophobicContact CB-CB 4.5Å; D194-V225 HydrophobicContact CB-CG2 4.1Å
195	H	89.7	Confident	88	Confident	38 Å²	38	52.5 Å²	52.5	18%	0.176	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.8	-178.4	168.1	-80.3	0	0	0	109.6	R137 K139 I219 D221	R137-H195 PolarHBondContact N-O 2.75Å; R137-H195 PolarHBondContact O-N 2.83Å; K139-H195 HydrophobicContact CB-CB 4.16Å; H195-I219 VanDerWaalsContact CD2-CG2 3.47Å; H195-I219 WeakPolarHBondContact CD2-CG2 3.46Å; H195-I219 WeakPolarHBondContact NE2-CG2 3.42Å; H195-D221 IonicContact CD2-OD1 3.56Å; H195-D221 PolarHBondContact CD2-OD1 3.24Å; H195-D221 IonicContact CG-OD1 2.72Å
196	Q	89.7	Confident	87.4	Confident	5 Å²	5	54 Å²	54	2%	0.023	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.3	179.5	-172.5	179.8	33.1	0	0	110.3	S134 I198 L220 V225	S134-Q196 WeakPolarHBondContact O-CG 3.44Å; S134-Q196 PolarHBondContact O-NE2 2.92Å; Q196-I198 HydrophobicContact CG-CG2 4.43Å; Q196-L220 HydrophobicContact CB-CB 4.42Å; Q196-L220 PolarHBondContact N-O 2.66Å; Q196-L220 PolarHBondContact O-N 3.11Å; Q196-V225 HydrophobicContact CB-CG1 4.04Å; Q196-V225 HydrophobicContact CB-CG2 3.99Å
197	T	89.8	Confident	86.9	Confident	50 Å²	50	52 Å²	52	31%	0.307	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	135.2	170.8	53.1	0	0	0	0	110.3	S134 I218 I219	S134-T197 WeakPolarHBondContact CB-O 3.41Å; S134-T197 WeakPolarHBondContact CB-OG1 3.46Å; S134-T197 PolarHBondContact N-O 3.32Å; T197-I218 WeakPolarHBondContact CA-O 3.48Å; T197-I219 HydrophobicContact CG2-CG1 4.37Å
198	I	91.9	Very high	86.6	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153.3	173.4	69.2	167.8	0	0	0	109.8	I130 K132 C133 Q196 V200 I218 L220 V228	I130-I198 HydrophobicContact CD1-CD1 4.19Å; I130-I198 HydrophobicContact CG1-CD1 4.26Å; K132-I198 CarbonylContact O-C 3.49Å; K132-I198 VanDerWaalsContact O-CA 3.28Å; K132-I198 WeakPolarHBondContact O-CA 3.44Å; C133-I198 HydrophobicContact CB-CG2 4.31Å; Q196-I198 HydrophobicContact CG-CG2 4.43Å; I198-V200 HydrophobicContact CD1-CG2 4.1Å; I198-I218 HydrophobicContact CD1-CB 4.29Å; I198-I218 HydrophobicContact CD1-CD1 4.45Å; I198-I218 HydrophobicContact CG1-CB 3.75Å; I198-I218 HydrophobicContact CG1-CG2 4.35Å; I198-I218 PolarHBondContact N-O 3.24Å; I198-I218 PolarHBondContact O-N 3.27Å; I198-L220 HydrophobicContact CD1-CD1 4.09Å; I198-L220 HydrophobicContact CD1-CD2 4.13Å; I198-L220 HydrophobicContact CD1-CG 4.24Å; I198-L220 HydrophobicContact CG1-CD1 4.44Å; I198-L220 HydrophobicContact CG1-CG 4.31Å; I198-L220 HydrophobicContact CG2-CD1 3.81Å; I198-L220 HydrophobicContact CG2-CG 4.27Å; I198-V228 HydrophobicContact CD1-CG2 4.18Å
199	T	91.2	Very high	86.3	Confident	25 Å²	25	49.9 Å²	49.9	15%	0.153	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.4	173	66.2	0	0	0	0	110.4	T131 K132 V216 D217	T131-T199 PolarHBondContact N-O 3.37Å; T131-T199 PolarHBondContact OG1-O 3.06Å; T131-T199 PolarHBondContact OG1-OG1 2.93Å; K132-T199 HydrophobicContact CB-CG2 4.4Å; K132-T199 VanDerWaalsContact CB-OG1 3.23Å; K132-T199 WeakPolarHBondContact CB-OG1 3.49Å; K132-T199 WeakPolarHBondContact CG-OG1 3.3Å; K132-T199 PolarHBondContact N-OG1 2.8Å; K132-T199 PolarHBondContact O-N 2.87Å; T199-V216 WeakPolarHBondContact CA-O 3.44Å; T199-D217 WeakPolarHBondContact CG2-OD1 3.49Å
200	V	91.9	Very high	86.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.6	177.2	171.2	0	0	0	0	109.4	P112 I129 I130 I198 S215 V216 I218 V234	P112-V200 HydrophobicContact CG-CG1 4.43Å; I129-V200 WeakPolarHBondContact O-CA 3.46Å; I130-V200 HydrophobicContact CG1-CG2 3.84Å; I198-V200 HydrophobicContact CD1-CG2 4.1Å; V200-S215 CarbonylContact O-C 3.54Å; V200-S215 WeakPolarHBondContact O-CA 3.49Å; V200-V216 HydrophobicContact CB-CG1 4.26Å; V200-V216 PolarHBondContact N-O 3.4Å; V200-V216 PolarHBondContact O-N 3.37Å; V200-I218 HydrophobicContact CB-CD1 3.83Å; V200-I218 HydrophobicContact CG2-CD1 3.46Å; V200-I218 VanDerWaalsContact CG2-CD1 3.46Å; V200-I218 HydrophobicContact CG2-CG1 4.42Å; V200-V234 HydrophobicContact CG2-CG2 4.11Å
201	Q	90.7	Very high	86.1	Confident	63 Å²	63	54.4 Å²	54.4	29%	0.294	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146.5	177.6	-172.9	171.7	42.1	0	0	110.3	G128 I129 T131 P213	G128-Q201 CarbonylContact C-O 3.51Å; G128-Q201 WeakPolarHBondContact CA-O 3.22Å; I129-Q201 PolarHBondContact N-O 3.17Å; I129-Q201 PolarHBondContact O-N 2.88Å; T131-Q201 HydrophobicContact CG2-CB 3.56Å; T131-Q201 HydrophobicContact CG2-CG 4.38Å; T131-Q201 VanDerWaalsContact CG2-OE1 3.23Å; Q201-P213 HydrophobicContact CG-CB 4.11Å; Q201-P213 HydrophobicContact CG-CG 4.48Å
202	E	90.3	Very high	85.9	Confident	7 Å²	7	58.5 Å²	58.5	3%	0.033	34%	0.34	C	S	.	.			trans	-54.6	139.1	171.2	-178.7	171.5	-118.9	0	0	111.5	S111 P112 R113 P213 R214	S111-E202 PolarHBondContact OG-OE1 3.11Å; P112-E202 HydrophobicContact CG-CB 4.43Å; R113-E202 WeakPolarHBondContact CB-OE1 3.44Å; R113-E202 IonicContact CZ-OE2 2.71Å; R113-E202 IonicContact NE-OE1 2.75Å; R113-E202 PolarHBondContact NE-OE1 2.94Å; R113-E202 IonicContact NE-OE2 3.23Å; R113-E202 PolarHBondContact NE-OE2 3.28Å; R113-E202 IonicContact NH2-OE2 2.95Å; R113-E202 PolarHBondContact NH2-OE2 3.23Å; E202-P213 HydrophobicContact CB-CB 4.4Å; E202-R214 PolarHBondContact N-O 3.27Å
203	M	84.6	Confident	85.9	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.044	34%	0.336	C	S	.	.			trans	-62.4	129.6	178.1	-57.9	-175.9	-175.9	0	0	109.7	E127 I129 E205 K206 A207	E127-M203 HydrophobicContact CB-CE 4.17Å; I129-M203 HydrophobicContact CG1-CG 4.24Å; M203-E205 PolarHBondContact O-N 3.4Å; M203-K206 HydrophobicContact CB-CG 4.5Å; M203-K206 PolarHBondContact O-N 3.46Å; M203-K206 HydrophobicContact SD-CD 4.48Å; M203-A207 PolarHBondContact O-N 3.2Å
204	P	78.4	Confident	85.9	Confident	86 Å²	86	62 Å²	62	56%	0.558	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-64.3	-27.2	-174.5	25.8	-34.6	0	0	0	112.6	I129 K206 A207	I129-P204 HydrophobicContact CD1-CG 4.46Å; P204-K206 VanDerWaalsContact C-N 3.26Å; P204-K206 PolarHBondContact O-N 2.96Å; P204-A207 PolarHBondContact O-N 2.84Å
205	E	77.6	Confident	85.9	Confident	122 Å²	122	61.9 Å²	61.9	57%	0.57	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-62.5	-30.4	173.8	-67.4	159.3	-173.6	0	0	112.7	M203 R233	M203-E205 PolarHBondContact O-N 3.4Å; E205-R233 IonicContact OE1-CZ 2.7Å; E205-R233 IonicContact OE1-NH1 2.7Å; E205-R233 IonicContact OE1-NH2 3.44Å; E205-R233 PolarHBondContact OE1-NH2 3.32Å; E205-R233 IonicContact OE2-CZ 2.66Å; E205-R233 IonicContact OE2-NH1 3.78Å; E205-R233 PolarHBondContact OE2-NH1 3.11Å; E205-R233 IonicContact OE2-NH2 3.81Å; E205-R233 PolarHBondContact OE2-NH2 2.92Å
206	K	75.6	Confident	86	Confident	75 Å²	75	60.5 Å²	60.5	33%	0.326	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-95.1	-7.6	179.7	-66.8	-178.8	169.2	-179.5	0	113	E127 M203 P204	E127-K206 WeakPolarHBondContact OE1-CD 3.28Å; E127-K206 WeakPolarHBondContact OE1-CE 3.36Å; E127-K206 IonicContact OE1-NZ 3.25Å; E127-K206 PolarHBondContact OE1-NZ 3.5Å; E127-K206 IonicContact OE2-NZ 2.87Å; E127-K206 PolarHBondContact OE2-NZ 3.11Å; M203-K206 HydrophobicContact CB-CG 4.5Å; M203-K206 PolarHBondContact O-N 3.46Å; M203-K206 HydrophobicContact SD-CD 4.48Å; P204-K206 VanDerWaalsContact C-N 3.26Å; P204-K206 PolarHBondContact O-N 2.96Å
207	A	78.1	Confident	86.1	Confident	24 Å²	24	62.1 Å²	62.1	20%	0.198	37%	0.365	C	S	.	.	S	Bend	trans	-81.4	129.1	-176.3	0	0	0	0	0	111.4	M203 P204 A209 P213	M203-A207 PolarHBondContact O-N 3.2Å; P204-A207 PolarHBondContact O-N 2.84Å; A207-A209 PolarHBondContact O-N 3.05Å; A207-P213 HydrophobicContact CB-CB 4.46Å
208	P	81.1	Confident	86.2	Confident	62 Å²	62	59.8 Å²	59.8	40%	0.403	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-63.2	130.3	175.8	25.9	-34.8	0	0	0	111.2	R113 G210 Q211	R113-P208 VanDerWaalsContact CZ-CD 3.49Å; P208-G210 PolarHBondContact O-N 3.33Å; P208-Q211 PolarHBondContact O-N 3.45Å
209	A	80.6	Confident	86.3	Confident	109 Å²	109	60.2 Å²	60.2	90%	0.901	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	134.8	-178.4	0	0	0	0	0	112	A207	A207-A209 PolarHBondContact O-N 3.05Å
210	G	83.6	Confident	86.3	Confident	89 Å²	89	59 Å²	59	92%	0.918	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	-4.6	179.5	0	0	0	0	0	115.8	P208	P208-G210 PolarHBondContact O-N 3.33Å
211	Q	87.2	Confident	86.2	Confident	117 Å²	117	59.9 Å²	59.9	55%	0.547	35%	0.35	S	S	.	.	S	Bend	trans	-113.8	144	171.7	-63	-170	16.6	0	0	112.3	P208	P208-Q211 PolarHBondContact O-N 3.45Å
212	L	84.9	Confident	86	Confident	147 Å²	147	58.8 Å²	58.8	77%	0.77	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-66.9	130.8	173.9	-65.6	172.9	0	0	0	110.5
213	P	87.3	Confident	85.8	Confident	43 Å²	43	61.9 Å²	61.9	28%	0.279	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-63.3	135.8	175.2	23.3	-31.6	0	0	0	111.1	Q201 E202 A207	Q201-P213 HydrophobicContact CG-CB 4.11Å; Q201-P213 HydrophobicContact CG-CG 4.48Å; E202-P213 HydrophobicContact CB-CB 4.4Å; A207-P213 HydrophobicContact CB-CB 4.46Å
214	R	90.1	Very high	86	Confident	152 Å²	152	61.9 Å²	61.9	57%	0.574	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-84.8	154.7	-178.2	-60.4	-61.2	-177.1	170.5	-0.6	111.2	E202	E202-R214 PolarHBondContact N-O 3.27Å
215	S	90.8	Very high	86.5	Confident	75 Å²	75	58.9 Å²	58.9	52%	0.524	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150	177.9	57.8	0	0	0	0	111.4	V200	V200-S215 CarbonylContact O-C 3.54Å; V200-S215 WeakPolarHBondContact O-CA 3.49Å
216	V	91.3	Very high	87	Confident	9 Å²	9	58 Å²	58	6%	0.055	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.3	175.5	60.6	0	0	0	0	110	P112 L115 V126 T199 V200 I218	P112-V216 HydrophobicContact CB-CB 4.48Å; P112-V216 HydrophobicContact CB-CG1 4.12Å; P112-V216 HydrophobicContact CG-CG1 4.11Å; L115-V216 HydrophobicContact CD2-CB 4.33Å; L115-V216 HydrophobicContact CD2-CG2 3.79Å; V126-V216 HydrophobicContact CG1-CG1 4.22Å; T199-V216 WeakPolarHBondContact CA-O 3.44Å; V200-V216 HydrophobicContact CB-CG1 4.26Å; V200-V216 PolarHBondContact N-O 3.4Å; V200-V216 PolarHBondContact O-N 3.37Å; V216-I218 HydrophobicContact CG1-CD1 4.47Å; V216-I218 HydrophobicContact CG1-CG1 4.31Å
217	D	91.6	Very high	87.5	Confident	39 Å²	39	57.3 Å²	57.3	21%	0.209	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130	174.6	-63	-15.9	0	0	0	109.5	T199 R256 I258 M259	T199-D217 WeakPolarHBondContact CG2-OD1 3.49Å; D217-R256 IonicContact OD2-CZ 3.08Å; D217-R256 VanDerWaalsContact OD2-CZ 3.23Å; D217-R256 IonicContact OD2-NE 2.74Å; D217-R256 PolarHBondContact OD2-NE 3.5Å; D217-R256 IonicContact OD2-NH2 3.16Å; D217-R256 PolarHBondContact OD2-NH2 3.45Å; D217-I258 HydrophobicContact CB-CG2 4.36Å; D217-I258 WeakPolarHBondContact O-CA 3.21Å; D217-M259 PolarHBondContact O-N 2.9Å
218	I	92.8	Very high	87.8	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.3	-179.9	-50.5	179.9	0	0	0	109	T197 I198 V200 V216 L220 V236 M259 A261	T197-I218 WeakPolarHBondContact CA-O 3.48Å; I198-I218 HydrophobicContact CD1-CB 4.29Å; I198-I218 HydrophobicContact CD1-CD1 4.45Å; I198-I218 HydrophobicContact CG1-CB 3.75Å; I198-I218 HydrophobicContact CG1-CG2 4.35Å; I198-I218 PolarHBondContact N-O 3.24Å; I198-I218 PolarHBondContact O-N 3.27Å; V200-I218 HydrophobicContact CB-CD1 3.83Å; V200-I218 HydrophobicContact CG2-CD1 3.46Å; V200-I218 VanDerWaalsContact CG2-CD1 3.46Å; V200-I218 HydrophobicContact CG2-CG1 4.42Å; V216-I218 HydrophobicContact CG1-CD1 4.47Å; V216-I218 HydrophobicContact CG1-CG1 4.31Å; I218-L220 HydrophobicContact CG2-CD2 4.21Å; I218-V236 HydrophobicContact CD1-CB 3.99Å; I218-V236 HydrophobicContact CD1-CG1 4.14Å; I218-V236 HydrophobicContact CD1-CG2 3.88Å; I218-V236 HydrophobicContact CG2-CG1 4.01Å; I218-M259 CarbonylContact C-O 3.6Å; I218-M259 VanDerWaalsContact CA-O 3.3Å; I218-M259 WeakPolarHBondContact CA-O 3.35Å; I218-M259 HydrophobicContact CD1-CE 3.47Å; I218-M259 VanDerWaalsContact CD1-CE 3.47Å; I218-M259 HydrophobicContact CG1-CB 4.3Å; I218-M259 HydrophobicContact CG1-CE 3.85Å; I218-M259 HydrophobicContact CG2-CB 4.5Å; I218-M259 HydrophobicContact CG2-CE 4.21Å; I218-A261 HydrophobicContact CG2-CB 3.95Å
219	I	92.6	Very high	87.9	Confident	10 Å²	10	59.4 Å²	59.4	5%	0.051	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.4	173.2	-54.5	-174.4	0	0	0	109.1	T162 H195 T197 I258 M259 A261	T162-I219 HydrophobicContact CG2-CD1 3.58Å; H195-I219 VanDerWaalsContact CD2-CG2 3.47Å; H195-I219 WeakPolarHBondContact CD2-CG2 3.46Å; H195-I219 WeakPolarHBondContact NE2-CG2 3.42Å; T197-I219 HydrophobicContact CG2-CG1 4.37Å; I219-I258 HydrophobicContact CD1-CD1 3.63Å; I219-I258 HydrophobicContact CG1-CD1 4.41Å; I219-M259 PolarHBondContact N-O 3.26Å; I219-A261 WeakPolarHBondContact O-CB 3.2Å; I219-A261 PolarHBondContact O-N 3.29Å
220	L	91.5	Very high	87.9	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.3	169.1	-50	-176.7	0	0	0	108.2	Q196 I198 I218 L224 V225 V228 A261 V264	Q196-L220 HydrophobicContact CB-CB 4.42Å; Q196-L220 PolarHBondContact N-O 2.66Å; Q196-L220 PolarHBondContact O-N 3.11Å; I198-L220 HydrophobicContact CD1-CD1 4.09Å; I198-L220 HydrophobicContact CD1-CD2 4.13Å; I198-L220 HydrophobicContact CD1-CG 4.24Å; I198-L220 HydrophobicContact CG1-CD1 4.44Å; I198-L220 HydrophobicContact CG1-CG 4.31Å; I198-L220 HydrophobicContact CG2-CD1 3.81Å; I198-L220 HydrophobicContact CG2-CG 4.27Å; I218-L220 HydrophobicContact CG2-CD2 4.21Å; L220-L224 HydrophobicContact CB-CB 4.14Å; L220-L224 WeakPolarHBondContact CD1-O 3.44Å; L220-L224 HydrophobicContact CD2-CB 4.46Å; L220-V225 HydrophobicContact CB-CG2 4.39Å; L220-V228 HydrophobicContact CD1-CG2 3.96Å; L220-A261 HydrophobicContact CD2-CB 3.56Å; L220-V264 HydrophobicContact CD2-CG2 3.75Å
221	D	89.1	Confident	87.6	Confident	19 Å²	19	54.6 Å²	54.6	10%	0.102	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	147.5	175.7	-83.8	-13	0	0	0	110.1	R45 K193 D194 H195	R45-D221 PolarHBondContact NH2-O 2.73Å; K193-D221 IonicContact NZ-OD1 3.53Å; K193-D221 IonicContact NZ-OD2 3.77Å; K193-D221 PolarHBondContact NZ-OD2 3.32Å; D194-D221 WeakPolarHBondContact O-CA 3.37Å; H195-D221 IonicContact CD2-OD1 3.56Å; H195-D221 PolarHBondContact CD2-OD1 3.24Å; H195-D221 IonicContact CG-OD1 2.72Å
222	N	87.3	Confident	87.3	Confident	40 Å²	40	50 Å²	50	21%	0.214	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	58	-128.3	174.4	-55.6	-51.2	0	0	0	113.3	F98 K193 D194 L224 V225	F98-N222 WeakPolarHBondContact CE2-ND2 3.45Å; F98-N222 VanDerWaalsContact CZ-ND2 3.3Å; F98-N222 WeakPolarHBondContact CZ-ND2 3.49Å; K193-N222 VanDerWaalsContact CB-OD1 3.3Å; K193-N222 WeakPolarHBondContact CB-OD1 3.18Å; D194-N222 PolarHBondContact O-N 3.23Å; N222-L224 PolarHBondContact O-N 3.21Å; N222-L224 VanDerWaalsContact O-N 3.09Å; N222-V225 VanDerWaalsContact O-CB 3.25Å; N222-V225 WeakPolarHBondContact O-CB 3.28Å; N222-V225 VanDerWaalsContact O-CG2 3.23Å; N222-V225 WeakPolarHBondContact O-CG2 3.42Å; N222-V225 PolarHBondContact O-N 2.98Å
223	D	86.8	Confident	87.3	Confident	71 Å²	71	47.3 Å²	47.3	38%	0.38	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-62.8	-9.5	-176.4	59.1	-57.4	0	0	0	115.5	R45 V225	R45-D223 VanDerWaalsContact CB-OD2 3.32Å; R45-D223 WeakPolarHBondContact CB-OD2 3.5Å; R45-D223 WeakPolarHBondContact CD-OD2 3.46Å; R45-D223 IonicContact CZ-OD1 3.78Å; R45-D223 VanDerWaalsContact CZ-OD1 3.25Å; R45-D223 IonicContact CZ-OD2 2.87Å; R45-D223 VanDerWaalsContact NE-CG 3.31Å; R45-D223 IonicContact NE-OD1 2.87Å; R45-D223 PolarHBondContact NE-OD1 3.15Å; R45-D223 IonicContact NE-OD2 2.91Å; R45-D223 PolarHBondContact NE-OD2 2.7Å; R45-D223 IonicContact NH2-OD1 3.95Å; R45-D223 PolarHBondContact NH2-OD1 3.07Å; R45-D223 IonicContact NH2-OD2 3.49Å; D223-V225 VanDerWaalsContact C-N 3.35Å
224	L	87.5	Confident	87.4	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.052	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-83	-11.6	171.9	-67.7	-178.1	0	0	0	113.6	R45 L220 N222 V227 A261 V264	R45-L224 VanDerWaalsContact NH1-CD1 3.29Å; L220-L224 HydrophobicContact CB-CB 4.14Å; L220-L224 WeakPolarHBondContact CD1-O 3.44Å; L220-L224 HydrophobicContact CD2-CB 4.46Å; N222-L224 PolarHBondContact O-N 3.21Å; N222-L224 VanDerWaalsContact O-N 3.09Å; L224-V227 WeakPolarHBondContact O-CG2 3.4Å; L224-A261 HydrophobicContact CD1-CB 3.91Å; L224-A261 WeakPolarHBondContact CD1-O 3.28Å; L224-V264 HydrophobicContact CD1-CG2 4.09Å; L224-V264 HydrophobicContact CD2-CB 4.26Å; L224-V264 HydrophobicContact CD2-CG2 4.19Å
225	V	89.4	Confident	87.4	Confident	23 Å²	23	38.5 Å²	38.5	14%	0.139	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	140.8	-176.8	173.1	0	0	0	0	111.4	V136 D194 Q196 L220 N222 D223 V227	V136-V225 HydrophobicContact CB-CG1 4.03Å; V136-V225 HydrophobicContact CG1-CG1 3.62Å; V136-V225 HydrophobicContact CG2-CG1 3.3Å; D194-V225 HydrophobicContact CB-CB 4.5Å; D194-V225 HydrophobicContact CB-CG2 4.1Å; Q196-V225 HydrophobicContact CB-CG1 4.04Å; Q196-V225 HydrophobicContact CB-CG2 3.99Å; L220-V225 HydrophobicContact CB-CG2 4.39Å; N222-V225 VanDerWaalsContact O-CB 3.25Å; N222-V225 WeakPolarHBondContact O-CB 3.28Å; N222-V225 VanDerWaalsContact O-CG2 3.23Å; N222-V225 WeakPolarHBondContact O-CG2 3.42Å; N222-V225 PolarHBondContact O-N 2.98Å; D223-V225 VanDerWaalsContact C-N 3.35Å; V225-V227 PolarHBondContact O-N 2.88Å
226	D	87.9	Confident	87.4	Confident	104 Å²	104	34.9 Å²	34.9	56%	0.556	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	9.6	-177.4	-154.2	45.6	0	0	0	116.1	V228	D226-V228 PolarHBondContact O-N 3.25Å
227	V	85.9	Confident	87.4	Confident	60 Å²	60	34.6 Å²	34.6	36%	0.364	19%	0.187	S	C	.	.	S	Bend	trans	-59.2	-35.4	171.7	173.8	0	0	0	0	110.7	L224 V225 Q266	L224-V227 WeakPolarHBondContact O-CG2 3.4Å; V225-V227 PolarHBondContact O-N 2.88Å; V227-Q266 PolarHBondContact O-NE2 3.35Å
228	V	84.5	Confident	87.4	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.006	18%	0.177	C	C	.	.			trans	-121.9	143.3	-166.3	-66	0	0	0	0	113.9	I130 C133 I198 L220 D226 V234 V264 Q266	I130-V228 HydrophobicContact CD1-CB 3.33Å; I130-V228 HydrophobicContact CD1-CG1 4.01Å; I130-V228 HydrophobicContact CD1-CG2 3.39Å; C133-V228 PolarHBondContact SG-O 3.38Å; I198-V228 HydrophobicContact CD1-CG2 4.18Å; L220-V228 HydrophobicContact CD1-CG2 3.96Å; D226-V228 PolarHBondContact O-N 3.25Å; V228-V234 HydrophobicContact CB-CG1 4.47Å; V228-V234 HydrophobicContact CG1-CG1 3.91Å; V228-V264 HydrophobicContact CG1-CG1 3.5Å; V228-V264 VanDerWaalsContact CG1-CG1 3.5Å; V228-Q266 HydrophobicContact CG1-CG 4.13Å
229	K	83.6	Confident	87.3	Confident	129 Å²	129	32.7 Å²	32.7	56%	0.561	18%	0.177	S	C	*	.			trans	-114.2	154.4	-176.5	-64.3	170.5	-176.3	172.7	0	111.6	G231 D232	K229-G231 PolarHBondContact O-N 2.82Å; K229-D232 WeakPolarHBondContact CB-OD2 3.15Å; K229-D232 PolarHBondContact N-OD2 3.35Å; K229-D232 WeakPolarHBondContact O-CB 3.42Å; K229-D232 PolarHBondContact O-N 3.03Å; K229-D232 VanDerWaalsContact O-N 3.12Å
230	P	81.3	Confident	87.2	Confident	58 Å²	58	32.8 Å²	32.8	38%	0.377	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	135.8	170.2	-22.7	34.3	0	0	0	110.8	I130 C133 L399	I130-P230 WeakPolarHBondContact O-CA 3.41Å; C133-P230 HydrophobicContact CB-CG 4.38Å; P230-L399 VanDerWaalsContact O-CD2 3.22Å; P230-L399 WeakPolarHBondContact O-CD2 3.42Å
231	G	76.4	Confident	87.1	Confident	38 Å²	38	34 Å²	34	39%	0.392	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.7	-16.8	-174.1	0	0	0	0	0	115	I130 K229	I130-G231 PolarHBondContact O-N 2.94Å; K229-G231 PolarHBondContact O-N 2.82Å
232	D	81.8	Confident	86.9	Confident	22 Å²	22	35.2 Å²	35.2	12%	0.118	19%	0.19	C	C	.	.			trans	-71.7	137.4	178.7	-69.7	-31.1	0	0	0	111.7	I129 I130 K229 V234	I129-D232 WeakPolarHBondContact CA-O 3.24Å; I130-D232 PolarHBondContact N-O 2.99Å; I130-D232 VanDerWaalsContact N-O 3.1Å; K229-D232 WeakPolarHBondContact CB-OD2 3.15Å; K229-D232 PolarHBondContact N-OD2 3.35Å; K229-D232 WeakPolarHBondContact O-CB 3.42Å; K229-D232 PolarHBondContact O-N 3.03Å; K229-D232 VanDerWaalsContact O-N 3.12Å; D232-V234 HydrophobicContact CB-CG1 4.19Å
233	R	84.2	Confident	86.8	Confident	90 Å²	90	35.1 Å²	35.1	34%	0.34	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.4	167	-62.7	-177	-174	-138.1	-0.5	108.8	I129 E205 M267 S268	I129-R233 HydrophobicContact CG1-CG 4.2Å; E205-R233 IonicContact OE1-CZ 2.7Å; E205-R233 IonicContact OE1-NH1 2.7Å; E205-R233 IonicContact OE1-NH2 3.44Å; E205-R233 PolarHBondContact OE1-NH2 3.32Å; E205-R233 IonicContact OE2-CZ 2.66Å; E205-R233 IonicContact OE2-NH1 3.78Å; E205-R233 PolarHBondContact OE2-NH1 3.11Å; E205-R233 IonicContact OE2-NH2 3.81Å; E205-R233 PolarHBondContact OE2-NH2 2.92Å; R233-M267 HydrophobicContact CB-CB 4.09Å; R233-M267 WeakPolarHBondContact O-CB 3.48Å; R233-M267 PolarHBondContact O-N 3.29Å; R233-S268 PolarHBondContact O-N 2.98Å
234	V	88.7	Confident	86.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.7	-175.4	-59.3	0	0	0	0	112.2	G128 I130 V200 V228 D232 V236 Q266	G128-V234 PolarHBondContact N-O 2.89Å; G128-V234 PolarHBondContact O-N 2.87Å; I130-V234 HydrophobicContact CD1-CB 4.3Å; I130-V234 HydrophobicContact CD1-CG1 3.6Å; I130-V234 HydrophobicContact CD1-CG2 3.75Å; I130-V234 HydrophobicContact CG1-CG1 4.33Å; I130-V234 HydrophobicContact CG1-CG2 3.7Å; V200-V234 HydrophobicContact CG2-CG2 4.11Å; V228-V234 HydrophobicContact CB-CG1 4.47Å; V228-V234 HydrophobicContact CG1-CG1 3.91Å; D232-V234 HydrophobicContact CB-CG1 4.19Å; V234-V236 HydrophobicContact CG2-CG2 4.02Å; V234-Q266 HydrophobicContact CG1-CG 4.31Å
235	Q	90.3	Very high	85.9	Confident	9 Å²	9	35.6 Å²	35.6	4%	0.042	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	113.8	170.7	-178.8	-176.8	26.3	0	0	106.4	H109 C125 V126 K265 M267	H109-Q235 PolarHBondContact CE1-NE2 3.08Å; H109-Q235 VanDerWaalsContact CE1-NE2 3.35Å; H109-Q235 PolarHBondContact ND1-NE2 3.22Å; C125-Q235 WeakPolarHBondContact SG-CG 3.28Å; C125-Q235 PolarHBondContact SG-NE2 2.95Å; V126-Q235 WeakPolarHBondContact O-CA 3.45Å; Q235-K265 HydrophobicContact CB-CB 4.35Å; Q235-K265 PolarHBondContact N-O 2.85Å; Q235-K265 PolarHBondContact O-N 2.92Å; Q235-M267 HydrophobicContact CB-CG 4.09Å; Q235-M267 HydrophobicContact CB-SD 4.09Å
236	V	91.5	Very high	85	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125	-178.1	-175.3	0	0	0	0	109.2	V126 I218 V234 M259 A261 V264	V126-V236 PolarHBondContact N-O 3.38Å; V126-V236 PolarHBondContact O-N 3.15Å; I218-V236 HydrophobicContact CD1-CB 3.99Å; I218-V236 HydrophobicContact CD1-CG1 4.14Å; I218-V236 HydrophobicContact CD1-CG2 3.88Å; I218-V236 HydrophobicContact CG2-CG1 4.01Å; V234-V236 HydrophobicContact CG2-CG2 4.02Å; V236-M259 HydrophobicContact CB-CE 3.81Å; V236-M259 HydrophobicContact CG1-CE 3.64Å; V236-A261 HydrophobicContact CG1-CB 3.67Å; V236-V264 HydrophobicContact CG1-CG2 4.06Å; V236-V264 HydrophobicContact CG2-CG1 4.28Å; V236-V264 HydrophobicContact CG2-CG2 4.22Å
237	I	91.4	Very high	84.1	Confident	3 Å²	3	46 Å²	46	2%	0.015	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.9	176.5	-65.9	160	0	0	0	107.2	L101 F105 M123 V124 C125 C262 H263	L101-I237 HydrophobicContact CB-CG2 4.4Å; L101-I237 WeakPolarHBondContact O-CD1 3.4Å; F105-I237 HydrophobicContact CD2-CD1 4.38Å; F105-I237 HydrophobicContact CD2-CG1 4.45Å; F105-I237 HydrophobicContact CE1-CG2 3.94Å; F105-I237 HydrophobicContact CE2-CD1 3.56Å; F105-I237 HydrophobicContact CE2-CG1 3.84Å; F105-I237 HydrophobicContact CE2-CG2 3.96Å; F105-I237 HydrophobicContact CZ-CB 4.39Å; F105-I237 HydrophobicContact CZ-CD1 4.11Å; F105-I237 HydrophobicContact CZ-CG1 4.15Å; F105-I237 HydrophobicContact CZ-CG2 3.36Å; M123-I237 HydrophobicContact CG-CG2 4.31Å; M123-I237 HydrophobicContact SD-CG2 3.97Å; V124-I237 WeakPolarHBondContact O-CA 3.46Å; C125-I237 HydrophobicContact CB-CG1 4.03Å; I237-C262 PolarHBondContact O-N 3.13Å; I237-H263 HydrophobicContact CB-CB 4.43Å; I237-H263 PolarHBondContact N-O 3.25Å; I237-H263 PolarHBondContact O-N 3.39Å
238	G	91.4	Very high	83.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	171.6	-172.8	0	0	0	0	0	114.6	V124 I260	V124-G238 PolarHBondContact N-O 3.12Å; V124-G238 PolarHBondContact O-N 3.34Å; G238-I260 CarbonylContact C-O 3.52Å; G238-I260 WeakPolarHBondContact CA-O 3.44Å
239	T	90.3	Very high	82.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.6	176.1	59.2	0	0	0	0	110.2	A68 L72 M123 M259 I260	A68-T239 HydrophobicContact CB-CG2 3.46Å; A68-T239 VanDerWaalsContact CB-CG2 3.46Å; L72-T239 HydrophobicContact CD1-CG2 3.67Å; M123-T239 HydrophobicContact CE-CG2 3.86Å; T239-M259 WeakPolarHBondContact O-CA 3.34Å; T239-M259 WeakPolarHBondContact O-CG 3.44Å; T239-I260 PolarHBondContact N-O 3.45Å; T239-I260 PolarHBondContact O-N 3.44Å
240	Y	91.1	Very high	82.2	Confident	12 Å²	12	52.4 Å²	52.4	5%	0.047	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.5	-179.2	-173.7	-132.4	0	0	0	111.5	L115 L119 L120 G121 S122 T257 I258	L115-Y240 HydrophobicContact CD1-CD2 4.39Å; L115-Y240 HydrophobicContact CD1-CG 4.43Å; L115-Y240 HydrophobicContact CD2-CD2 4.03Å; L115-Y240 HydrophobicContact CD2-CE1 4.29Å; L115-Y240 HydrophobicContact CD2-CE2 3.43Å; L115-Y240 VanDerWaalsContact CD2-CE2 3.43Å; L115-Y240 HydrophobicContact CG-CD2 4.44Å; L115-Y240 HydrophobicContact CG-CE1 4.14Å; L115-Y240 HydrophobicContact CG-CE2 4.1Å; L119-Y240 HydrophobicContact CB-CD1 4.28Å; L120-Y240 HydrophobicContact CD2-CD1 3.72Å; L120-Y240 HydrophobicContact CD2-CE1 3.69Å; L120-Y240 HydrophobicContact CD2-CG 4.43Å; L120-Y240 HydrophobicContact CG-CD1 4.15Å; L120-Y240 HydrophobicContact CG-CE1 4.13Å; G121-Y240 PolarHBondContact N-O 2.84Å; S122-Y240 PolarHBondContact O-N 2.93Å; Y240-T257 HydrophobicContact CE2-CG2 4.38Å; Y240-T257 WeakPolarHBondContact OH-CB 3.32Å; Y240-T257 WeakPolarHBondContact OH-CG2 3.4Å; Y240-T257 PolarHBondContact OH-OG1 3.42Å; Y240-T257 VanDerWaalsContact OH-OG1 3.09Å; Y240-I258 VanDerWaalsContact CD2-O 3.28Å; Y240-I258 WeakPolarHBondContact CD2-O 3.25Å
241	R	88.1	Confident	82	Confident	24 Å²	24	53.7 Å²	53.7	9%	0.091	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	152	-173.4	-165.6	169.1	-177.2	160.3	-12.6	111.7	F69 M161 S163 D165 I258	F69-R241 HydrophobicContact CZ-CB 4.14Å; F69-R241 HydrophobicContact CZ-CG 4.12Å; M161-R241 PolarHBondContact O-NE 2.82Å; M161-R241 PolarHBondContact O-NH2 3.08Å; M161-R241 PolarHBondContact SD-NH2 3.49Å; S163-R241 PolarHBondContact O-NH1 3.48Å; D165-R241 PolarHBondContact O-NH2 3.33Å; R241-I258 HydrophobicContact CB-CG1 4.23Å; R241-I258 PolarHBondContact N-O 2.89Å; R241-I258 PolarHBondContact O-N 2.91Å
242	C	86.5	Confident	82.2	Confident	45 Å²	45	54.7 Å²	54.7	30%	0.304	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.4	167.8	55.7	0	0	0	0	110.8	L120 F255 T257	L120-C242 HydrophobicContact CD2-CB 4.1Å; C242-F255 HydrophobicContact CB-CB 4.13Å; C242-T257 HydrophobicContact CB-CG2 4.25Å
243	L	84.3	Confident	82	Confident	38 Å²	38	57.1 Å²	57.1	20%	0.199	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125	172.9	-66	-174.6	0	0	0	109.8	M161 T162 G245 R256 I258	M161-L243 HydrophobicContact CB-CD2 3.75Å; M161-L243 HydrophobicContact CG-CD2 3.43Å; M161-L243 VanDerWaalsContact CG-CD2 3.43Å; M161-L243 WeakPolarHBondContact O-CD2 3.42Å; T162-L243 HydrophobicContact CG2-CD1 4.14Å; T162-L243 HydrophobicContact CG2-CD2 4.46Å; L243-G245 PolarHBondContact O-N 3.38Å; L243-R256 PolarHBondContact N-O 2.94Å; L243-R256 PolarHBondContact O-N 2.99Å; L243-R256 VanDerWaalsContact O-N 3.09Å; L243-I258 HydrophobicContact CD1-CD1 3.71Å; L243-I258 HydrophobicContact CD1-CG1 4.28Å; L243-I258 HydrophobicContact CD1-CG2 4.22Å; L243-I258 HydrophobicContact CD2-CD1 4.05Å; L243-I258 HydrophobicContact CG-CD1 3.73Å; L243-I258 HydrophobicContact CG-CG1 4Å
244	P	82.9	Confident	82	Confident	54 Å²	54	57.9 Å²	57.9	35%	0.351	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.4	177.2	29.4	-33	0	0	0	111.8	K246 F255	P244-K246 PolarHBondContact O-N 3.44Å; P244-F255 HydrophobicContact CB-CD1 4.02Å; P244-F255 HydrophobicContact CB-CE1 3.96Å
245	G	72.1	Confident	81.8	Confident	37 Å²	37	63.3 Å²	63.3	38%	0.381	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	97.7	174.4	0	0	0	0	0	112	L243 S252	L243-G245 PolarHBondContact O-N 3.38Å; G245-S252 PolarHBondContact O-N 3.33Å
246	K	71.4	Confident	81.6	Confident	158 Å²	158	68.7 Å²	68.7	69%	0.687	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.1	170.4	-64	-177.2	-178.2	179.8	0	109.9	P244	P244-K246 PolarHBondContact O-N 3.44Å
247	K	67.5	Low	81.5	Confident	188 Å²	188	71.3 Å²	71.3	82%	0.817	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	114.5	170.6	-75	-171.3	176.5	-176.4	0	108.9	G249 F250	K247-G249 PolarHBondContact O-N 3.24Å; K247-F250 PolarHBondContact N-O 3.07Å
248	G	66.4	Low	81.4	Confident	75 Å²	75	71.4 Å²	71.4	77%	0.773	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	39.1	176.9	0	0	0	0	0	114.6	F250	G248-F250 WeakPolarHBondContact O-CD2 3.49Å; G248-F250 PolarHBondContact O-N 2.99Å
249	G	73.1	Confident	81.4	Confident	76 Å²	76	71.5 Å²	71.5	78%	0.784	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	-28.2	179.2	0	0	0	0	0	114.9	K247	K247-G249 PolarHBondContact O-N 3.24Å
250	F	76	Confident	81.4	Confident	174 Å²	174	72.2 Å²	72.2	76%	0.763	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	132	171.1	-60.6	-81.4	0	0	0	110.6	K247 G248	K247-F250 PolarHBondContact N-O 3.07Å; G248-F250 WeakPolarHBondContact O-CD2 3.49Å; G248-F250 PolarHBondContact O-N 2.99Å
251	T	77.4	Confident	81.5	Confident	85 Å²	85	72 Å²	72	52%	0.521	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	127.9	170.3	-169.5	0	0	0	0	109
252	S	79.6	Confident	81.5	Confident	58 Å²	58	71.3 Å²	71.3	41%	0.406	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	149.5	166.7	-170.6	0	0	0	0	109.3	G245 T254 F255	G245-S252 PolarHBondContact O-N 3.33Å; S252-T254 PolarHBondContact O-N 3.23Å; S252-T254 PolarHBondContact OG-N 3.47Å; S252-T254 PolarHBondContact OG-OG1 3.26Å; S252-F255 WeakPolarHBondContact O-CE1 3.5Å
253	G	78.5	Confident	81.7	Confident	74 Å²	74	70.3 Å²	70.3	76%	0.763	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	-7.6	168.7	0	0	0	0	0	113.4
254	T	83.6	Confident	82	Confident	106 Å²	106	69 Å²	69	65%	0.65	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	122	171.4	51.5	0	0	0	0	110.6	S252	S252-T254 PolarHBondContact O-N 3.23Å; S252-T254 PolarHBondContact OG-N 3.47Å; S252-T254 PolarHBondContact OG-OG1 3.26Å
255	F	85.4	Confident	82.2	Confident	114 Å²	114	69 Å²	69	50%	0.5	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	140	177.8	-55.9	-37.4	0	0	0	110.5	C242 P244 S252	C242-F255 HydrophobicContact CB-CB 4.13Å; P244-F255 HydrophobicContact CB-CD1 4.02Å; P244-F255 HydrophobicContact CB-CE1 3.96Å; S252-F255 WeakPolarHBondContact O-CE1 3.5Å
256	R	86	Confident	82.8	Confident	121 Å²	121	69.4 Å²	69.4	46%	0.457	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.2	170.1	-175.7	179.9	-174	163.7	3	106.9	D217 L243 E386	D217-R256 IonicContact OD2-CZ 3.08Å; D217-R256 VanDerWaalsContact OD2-CZ 3.23Å; D217-R256 IonicContact OD2-NE 2.74Å; D217-R256 PolarHBondContact OD2-NE 3.5Å; D217-R256 IonicContact OD2-NH2 3.16Å; D217-R256 PolarHBondContact OD2-NH2 3.45Å; L243-R256 PolarHBondContact N-O 2.94Å; L243-R256 PolarHBondContact O-N 2.99Å; L243-R256 VanDerWaalsContact O-N 3.09Å; R256-E386 IonicContact CZ-OE1 2.73Å; R256-E386 IonicContact NH1-OE1 2.98Å; R256-E386 PolarHBondContact NH1-OE1 3.46Å; R256-E386 IonicContact NH2-OE1 3.1Å; R256-E386 PolarHBondContact NH2-OE1 2.85Å; R256-E386 VanDerWaalsContact NH2-OE1 3.08Å
257	T	87.6	Confident	82.8	Confident	55 Å²	55	66.2 Å²	66.2	34%	0.337	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	142.6	174.8	55.8	0	0	0	0	110.3	Y240 C242	Y240-T257 HydrophobicContact CE2-CG2 4.38Å; Y240-T257 WeakPolarHBondContact OH-CB 3.32Å; Y240-T257 WeakPolarHBondContact OH-CG2 3.4Å; Y240-T257 PolarHBondContact OH-OG1 3.42Å; Y240-T257 VanDerWaalsContact OH-OG1 3.09Å; C242-T257 HydrophobicContact CB-CG2 4.25Å
258	I	90.7	Very high	82.6	Confident	6 Å²	6	58.9 Å²	58.9	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	158.3	-179.5	59.6	160.5	0	0	0	109	T162 D217 I219 Y240 R241 L243 I260	T162-I258 HydrophobicContact CG2-CD1 4.25Å; D217-I258 HydrophobicContact CB-CG2 4.36Å; D217-I258 WeakPolarHBondContact O-CA 3.21Å; I219-I258 HydrophobicContact CD1-CD1 3.63Å; I219-I258 HydrophobicContact CG1-CD1 4.41Å; Y240-I258 VanDerWaalsContact CD2-O 3.28Å; Y240-I258 WeakPolarHBondContact CD2-O 3.25Å; R241-I258 HydrophobicContact CB-CG1 4.23Å; R241-I258 PolarHBondContact N-O 2.89Å; R241-I258 PolarHBondContact O-N 2.91Å; L243-I258 HydrophobicContact CD1-CD1 3.71Å; L243-I258 HydrophobicContact CD1-CG1 4.28Å; L243-I258 HydrophobicContact CD1-CG2 4.22Å; L243-I258 HydrophobicContact CD2-CD1 4.05Å; L243-I258 HydrophobicContact CG-CD1 3.73Å; L243-I258 HydrophobicContact CG-CG1 4Å; I258-I260 HydrophobicContact CD1-CG1 4.34Å
259	M	90.6	Very high	81.9	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.5	165.5	-169.9	170.1	61.9	0	0	110	V124 V126 D217 I218 I219 V236 T239	V124-M259 HydrophobicContact CG2-SD 3.58Å; V124-M259 VanDerWaalsContact CG2-SD 3.58Å; V126-M259 HydrophobicContact CB-CE 3.86Å; V126-M259 HydrophobicContact CB-SD 4.38Å; V126-M259 HydrophobicContact CG2-CE 3.73Å; V126-M259 HydrophobicContact CG2-SD 3.61Å; D217-M259 PolarHBondContact O-N 2.9Å; I218-M259 CarbonylContact C-O 3.6Å; I218-M259 VanDerWaalsContact CA-O 3.3Å; I218-M259 WeakPolarHBondContact CA-O 3.35Å; I218-M259 HydrophobicContact CD1-CE 3.47Å; I218-M259 VanDerWaalsContact CD1-CE 3.47Å; I218-M259 HydrophobicContact CG1-CB 4.3Å; I218-M259 HydrophobicContact CG1-CE 3.85Å; I218-M259 HydrophobicContact CG2-CB 4.5Å; I218-M259 HydrophobicContact CG2-CE 4.21Å; I219-M259 PolarHBondContact N-O 3.26Å; V236-M259 HydrophobicContact CB-CE 3.81Å; V236-M259 HydrophobicContact CG1-CE 3.64Å; T239-M259 WeakPolarHBondContact O-CA 3.34Å; T239-M259 WeakPolarHBondContact O-CG 3.44Å
260	I	91.5	Very high	80.8	Confident	16 Å²	16	60.9 Å²	60.9	8%	0.082	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.8	173.1	-59.7	163.4	0	0	0	106.8	T162 G238 T239 I258	T162-I260 WeakPolarHBondContact O-CD1 3.42Å; G238-I260 CarbonylContact C-O 3.52Å; G238-I260 WeakPolarHBondContact CA-O 3.44Å; T239-I260 PolarHBondContact N-O 3.45Å; T239-I260 PolarHBondContact O-N 3.44Å; I258-I260 HydrophobicContact CD1-CG1 4.34Å
261	A	91.9	Very high	79.7	Confident	7 Å²	7	58.5 Å²	58.5	6%	0.058	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.1	-174.8	0	0	0	0	0	112.3	I218 I219 L220 L224 V236 V264	I218-A261 HydrophobicContact CG2-CB 3.95Å; I219-A261 WeakPolarHBondContact O-CB 3.2Å; I219-A261 PolarHBondContact O-N 3.29Å; L220-A261 HydrophobicContact CD2-CB 3.56Å; L224-A261 HydrophobicContact CD1-CB 3.91Å; L224-A261 WeakPolarHBondContact CD1-O 3.28Å; V236-A261 HydrophobicContact CG1-CB 3.67Å; A261-V264 HydrophobicContact CB-CG2 4.2Å
262	C	88.9	Confident	78.2	Confident	10 Å²	10	58.1 Å²	58.1	7%	0.068	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-37.1	170	-57.8	0	0	0	0	110.8	R45 G100 I237	R45-C262 PolarHBondContact NH1-O 3.38Å; G100-C262 WeakPolarHBondContact CA-O 3.47Å; I237-C262 PolarHBondContact O-N 3.13Å
263	H	90.7	Very high	77	Confident	24 Å²	24	57.3 Å²	57.3	11%	0.111	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	151.6	175.4	-173	64.5	0	0	0	111.6	I237	I237-H263 HydrophobicContact CB-CB 4.43Å; I237-H263 PolarHBondContact N-O 3.25Å; I237-H263 PolarHBondContact O-N 3.39Å
264	V	89.5	Confident	75.9	Confident	10 Å²	10	58.2 Å²	58.2	6%	0.061	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	108	179.1	177.8	0	0	0	0	108.7	L220 L224 V228 V236 A261	L220-V264 HydrophobicContact CD2-CG2 3.75Å; L224-V264 HydrophobicContact CD1-CG2 4.09Å; L224-V264 HydrophobicContact CD2-CB 4.26Å; L224-V264 HydrophobicContact CD2-CG2 4.19Å; V228-V264 HydrophobicContact CG1-CG1 3.5Å; V228-V264 VanDerWaalsContact CG1-CG1 3.5Å; V236-V264 HydrophobicContact CG1-CG2 4.06Å; V236-V264 HydrophobicContact CG2-CG1 4.28Å; V236-V264 HydrophobicContact CG2-CG2 4.22Å; A261-V264 HydrophobicContact CB-CG2 4.2Å
265	K	87	Confident	75	Confident	54 Å²	54	56.3 Å²	56.3	24%	0.235	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.2	175.6	-175.1	167	179.5	169.7	0	109	E102 Q235 M267	E102-K265 WeakPolarHBondContact OE1-CD 3.3Å; E102-K265 WeakPolarHBondContact OE1-CE 3.39Å; E102-K265 IonicContact OE1-NZ 3.65Å; E102-K265 PolarHBondContact OE1-NZ 3.29Å; Q235-K265 HydrophobicContact CB-CB 4.35Å; Q235-K265 PolarHBondContact N-O 2.85Å; Q235-K265 PolarHBondContact O-N 2.92Å; K265-M267 PolarHBondContact O-N 2.94Å
266	Q	84.5	Confident	74.6	Confident	46 Å²	46	52.9 Å²	52.9	22%	0.215	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	111.5	173	-73	175.9	-7.9	0	0	109.5	V227 V228 V234 S268 K269	V227-Q266 PolarHBondContact O-NE2 3.35Å; V228-Q266 HydrophobicContact CG1-CG 4.13Å; V234-Q266 HydrophobicContact CG1-CG 4.31Å; Q266-S268 PolarHBondContact O-N 2.89Å; Q266-K269 HydrophobicContact CB-CG 4.14Å
267	M	73.4	Confident	74.2	Confident	91 Å²	91	51 Å²	51	45%	0.448	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-35.7	170.9	-59.3	-85.3	-76.9	0	0	110	R233 Q235 K265 K269	R233-M267 HydrophobicContact CB-CB 4.09Å; R233-M267 WeakPolarHBondContact O-CB 3.48Å; R233-M267 PolarHBondContact O-N 3.29Å; Q235-M267 HydrophobicContact CB-CG 4.09Å; Q235-M267 HydrophobicContact CB-SD 4.09Å; K265-M267 PolarHBondContact O-N 2.94Å; M267-K269 PolarHBondContact O-N 2.98Å
268	S	61.8	Low	73.8	Confident	33 Å²	33	53.5 Å²	53.5	23%	0.231	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	29	-178	-149.9	0	0	0	0	114.8	R233 Q266 E270	R233-S268 PolarHBondContact O-N 2.98Å; Q266-S268 PolarHBondContact O-N 2.89Å; S268-E270 PolarHBondContact O-N 3.22Å
269	K	52.5	Low	73.1	Confident	133 Å²	133	54 Å²	54	58%	0.578	31%	0.306	S	S	*	.			trans	-75.8	53.8	171	-87	-174.8	175.4	180	0	111.9	Q266 M267 V271 S272	Q266-K269 HydrophobicContact CB-CG 4.14Å; M267-K269 PolarHBondContact O-N 2.98Å; K269-V271 PolarHBondContact O-N 2.7Å; K269-S272 PolarHBondContact O-N 3.35Å
270	E	50.3	Low	72.7	Confident	60 Å²	60	56.1 Å²	56.1	28%	0.28	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	16.3	173.1	-57.3	-166.3	117.1	0	0	113.9	S268 P362 R363 H572	S268-E270 PolarHBondContact O-N 3.22Å; E270-P362 HydrophobicContact CB-CB 3.98Å; E270-P362 VanDerWaalsContact CD-CB 3.4Å; E270-P362 HydrophobicContact CG-CB 4.3Å; E270-P362 WeakPolarHBondContact OE1-CA 3.48Å; E270-P362 WeakPolarHBondContact OE1-CB 3.32Å; E270-P362 WeakPolarHBondContact OE2-CA 3.35Å; E270-P362 WeakPolarHBondContact OE2-CB 3.42Å; E270-R363 PolarHBondContact OE2-N 3.39Å; E270-H572 PolarHBondContact O-CE1 3.34Å; E270-H572 PolarHBondContact O-ND1 3.37Å
271	V	51.5	Low	72.2	Confident	124 Å²	124	57 Å²	57	75%	0.752	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-11.9	176.8	-171.4	0	0	0	0	112	K269	K269-V271 PolarHBondContact O-N 2.7Å
272	S	46.7	Very low	71.7	Confident	78 Å²	78	59 Å²	59	55%	0.545	34%	0.336	S	S	.	.			trans	-144.8	76.7	172.7	63.1	0	0	0	0	110.9	K269 S274	K269-S272 PolarHBondContact O-N 3.35Å; S272-S274 PolarHBondContact O-N 2.91Å
273	Q	54.5	Low	71.3	Confident	41 Å²	41	58.8 Å²	58.8	19%	0.192	33%	0.334	C	S	.	.			trans	-59.1	121	145.2	-74.9	167.3	-1.5	0	0	105.8	F275 R568	Q273-F275 HydrophobicContact CB-CZ 4.4Å; Q273-F275 WeakPolarHBondContact O-CD2 3.28Å; Q273-F275 WeakPolarHBondContact O-CE2 2.79Å; Q273-F275 PolarHBondContact O-N 3.11Å; Q273-R568 VanDerWaalsContact NE2-NE 3.11Å
274	S	55.4	Low	70.9	Confident	92 Å²	92	64 Å²	64	64%	0.643	35%	0.353	S	S	*	.			trans	-61	100.6	176.3	32.7	0	0	0	0	108.3	S272 S276	S272-S274 PolarHBondContact O-N 2.91Å; S274-S276 PolarHBondContact O-N 2.76Å
275	F	65.6	Low	70.5	Confident	66 Å²	66	68 Å²	68	29%	0.289	37%	0.374	S	S	.	.			trans	-75.5	106.2	177	-65.3	-70.7	0	0	0	108.2	Q273 V280 K569 H572 I573	Q273-F275 HydrophobicContact CB-CZ 4.4Å; Q273-F275 WeakPolarHBondContact O-CD2 3.28Å; Q273-F275 WeakPolarHBondContact O-CE2 2.79Å; Q273-F275 PolarHBondContact O-N 3.11Å; F275-V280 HydrophobicContact CB-CG2 4.02Å; F275-K569 HydrophobicContact CE1-CB 4.25Å; F275-K569 HydrophobicContact CE1-CG 4.22Å; F275-H572 AromaticContact CE2-CD2 3.83Å; F275-H572 HydrophobicContact CZ-CB 4.28Å; F275-H572 AromaticContact CZ-CD2 3.58Å; F275-I573 HydrophobicContact CD1-CD1 3.87Å; F275-I573 HydrophobicContact CD1-CG1 4.26Å; F275-I573 HydrophobicContact CE1-CD1 3.73Å; F275-I573 HydrophobicContact CE1-CG1 3.66Å; F275-I573 HydrophobicContact CE2-CG1 4.43Å; F275-I573 HydrophobicContact CZ-CD1 4.3Å; F275-I573 HydrophobicContact CZ-CG1 3.76Å
276	S	75.5	Confident	70.2	Confident	42 Å²	42	66.3 Å²	66.3	29%	0.294	37%	0.367	S	S	.	.			trans	-59.6	148.6	163.5	176.3	0	0	0	0	109.3	S274 D278 D279 V280	S274-S276 PolarHBondContact O-N 2.76Å; S276-D278 PolarHBondContact O-N 3.21Å; S276-D278 PolarHBondContact OG-N 2.98Å; S276-D279 WeakPolarHBondContact O-CB 3.41Å; S276-D279 PolarHBondContact O-N 2.93Å; S276-V280 PolarHBondContact O-N 2.86Å
277	A	78.3	Confident	69.7	Low	81 Å²	81	65.8 Å²	65.8	67%	0.669	37%	0.368	S	S	*	.	H	α-helix	trans	-54.8	-33.1	171.7	0	0	0	0	0	111.4	V280 A281	A277-V280 PolarHBondContact O-N 2.86Å; A277-A281 WeakPolarHBondContact O-CB 3.48Å; A277-A281 PolarHBondContact O-N 3.4Å
278	D	79.2	Confident	69.8	Low	108 Å²	108	70.1 Å²	70.1	58%	0.578	38%	0.38	S	S	*	.	H	α-helix	trans	-70.4	-35.3	177.3	-64.3	-27.6	0	0	0	112.7	S276 A281 K282	S276-D278 PolarHBondContact O-N 3.21Å; S276-D278 PolarHBondContact OG-N 2.98Å; D278-A281 WeakPolarHBondContact O-CB 3.11Å; D278-A281 PolarHBondContact O-N 2.92Å; D278-K282 WeakPolarHBondContact O-CB 3.49Å; D278-K282 VanDerWaalsContact O-CG 3.26Å; D278-K282 WeakPolarHBondContact O-CG 3.41Å; D278-K282 PolarHBondContact O-N 2.78Å
279	D	77.1	Confident	70.2	Confident	16 Å²	16	71.7 Å²	71.7	9%	0.086	39%	0.388	C	S	.	.	H	α-helix	trans	-64.2	-44.1	174.7	-73	-9.1	0	0	0	110.6	S276 A281 K282 I283 K569	S276-D279 WeakPolarHBondContact O-CB 3.41Å; S276-D279 PolarHBondContact O-N 2.93Å; D279-A281 VanDerWaalsContact C-N 3.29Å; D279-A281 PolarHBondContact O-N 2.89Å; D279-K282 PolarHBondContact O-N 3.47Å; D279-I283 WeakPolarHBondContact O-CB 3.43Å; D279-I283 VanDerWaalsContact O-CG1 3.25Å; D279-I283 WeakPolarHBondContact O-CG1 3.39Å; D279-I283 PolarHBondContact O-N 2.89Å; D279-K569 IonicContact OD2-NZ 2.72Å; D279-K569 PolarHBondContact OD2-NZ 3.1Å
280	V	80.1	Confident	70.3	Confident	47 Å²	47	74.3 Å²	74.3	29%	0.285	39%	0.394	S	S	.	.	H	α-helix	trans	-64.3	-36.8	175.7	-178.4	0	0	0	0	110.7	F275 S276 A277 R284 I573	F275-V280 HydrophobicContact CB-CG2 4.02Å; S276-V280 PolarHBondContact O-N 2.86Å; A277-V280 PolarHBondContact O-N 2.86Å; V280-R284 VanDerWaalsContact O-CB 3.22Å; V280-R284 WeakPolarHBondContact O-CB 3.28Å; V280-R284 PolarHBondContact O-N 3.37Å; V280-I573 HydrophobicContact CG2-CD1 4.44Å
281	A	82.6	Confident	70.2	Confident	35 Å²	35	76.6 Å²	76.6	29%	0.289	42%	0.417	S	S	.	.	H	α-helix	trans	-66.1	-46.8	174.1	0	0	0	0	0	112.2	A277 D278 D279 I283 R284 N285	A277-A281 WeakPolarHBondContact O-CB 3.48Å; A277-A281 PolarHBondContact O-N 3.4Å; D278-A281 WeakPolarHBondContact O-CB 3.11Å; D278-A281 PolarHBondContact O-N 2.92Å; D279-A281 VanDerWaalsContact C-N 3.29Å; D279-A281 PolarHBondContact O-N 2.89Å; A281-I283 PolarHBondContact O-N 2.95Å; A281-R284 PolarHBondContact O-N 2.87Å; A281-N285 WeakPolarHBondContact O-CB 3.28Å; A281-N285 PolarHBondContact O-N 3.45Å; A281-N285 PolarHBondContact O-ND2 3.24Å
282	K	80.6	Confident	70.4	Confident	49 Å²	49	74.5 Å²	74.5	21%	0.213	40%	0.404	C	S	.	.	H	α-helix	trans	-57.4	-47.2	174.7	-72.5	171.9	-179.1	-179.7	0	111.3	D278 D279 N285 F286 L541 I543 F566	D278-K282 WeakPolarHBondContact O-CB 3.49Å; D278-K282 VanDerWaalsContact O-CG 3.26Å; D278-K282 WeakPolarHBondContact O-CG 3.41Å; D278-K282 PolarHBondContact O-N 2.78Å; D279-K282 PolarHBondContact O-N 3.47Å; K282-N285 PolarHBondContact O-N 3.35Å; K282-F286 WeakPolarHBondContact O-CB 3.45Å; K282-F286 PolarHBondContact O-N 3.4Å; K282-L541 PolarHBondContact NZ-O 2.84Å; K282-I543 HydrophobicContact CB-CD1 4Å; K282-I543 HydrophobicContact CB-CG1 4.41Å; K282-I543 HydrophobicContact CD-CD1 4.31Å; K282-I543 HydrophobicContact CD-CG1 4.31Å; K282-I543 HydrophobicContact CG-CD1 4.03Å; K282-F566 HydrophobicContact CB-CE2 4.46Å
283	I	80.9	Confident	71.5	Confident	4 Å²	4	76.1 Å²	76.1	2%	0.021	41%	0.406	C	S	.	.	H	α-helix	trans	-63.4	-43.1	178.1	-73	170.5	0	0	0	111.6	D279 A281 F286 S287 F566 K569 Y570 I573 M632	D279-I283 WeakPolarHBondContact O-CB 3.43Å; D279-I283 VanDerWaalsContact O-CG1 3.25Å; D279-I283 WeakPolarHBondContact O-CG1 3.39Å; D279-I283 PolarHBondContact O-N 2.89Å; A281-I283 PolarHBondContact O-N 2.95Å; I283-F286 PolarHBondContact O-N 3.25Å; I283-S287 PolarHBondContact O-N 3.29Å; I283-F566 HydrophobicContact CD1-CE2 4.49Å; I283-F566 HydrophobicContact CG1-CD2 4.5Å; I283-F566 HydrophobicContact CG1-CE2 3.6Å; I283-F566 HydrophobicContact CG1-CZ 3.8Å; I283-K569 HydrophobicContact CD1-CB 4.3Å; I283-Y570 HydrophobicContact CG1-CD2 4.34Å; I283-Y570 HydrophobicContact CG2-CD2 3.79Å; I283-Y570 HydrophobicContact CG2-CE2 3.95Å; I283-I573 HydrophobicContact CD1-CD1 3.67Å; I283-I573 HydrophobicContact CG2-CD1 4.39Å; I283-M632 HydrophobicContact CG2-CE 3.56Å; I283-M632 HydrophobicContact CG2-SD 3.75Å
284	R	81.5	Confident	72.7	Confident	133 Å²	133	75 Å²	75	50%	0.502	40%	0.402	S	S	.	.	H	α-helix	trans	-65.1	-39.8	176.3	-173.4	-176.4	-62.2	153.3	2.4	112.2	V280 A281 R288	V280-R284 VanDerWaalsContact O-CB 3.22Å; V280-R284 WeakPolarHBondContact O-CB 3.28Å; V280-R284 PolarHBondContact O-N 3.37Å; A281-R284 PolarHBondContact O-N 2.87Å; R284-R288 WeakPolarHBondContact O-CB 3.49Å; R284-R288 WeakPolarHBondContact O-CG 3.48Å; R284-R288 PolarHBondContact O-N 3.37Å
285	N	82.3	Confident	74	Confident	96 Å²	96	70.9 Å²	70.9	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-68	-37.5	176.6	-69.7	-15.5	0	0	0	111.4	A281 K282 R288 T289	A281-N285 WeakPolarHBondContact O-CB 3.28Å; A281-N285 PolarHBondContact O-N 3.45Å; A281-N285 PolarHBondContact O-ND2 3.24Å; K282-N285 PolarHBondContact O-N 3.35Å; N285-R288 PolarHBondContact O-N 2.86Å; N285-T289 PolarHBondContact O-N 2.64Å; N285-T289 PolarHBondContact O-OG1 2.75Å
286	F	79.3	Confident	74.9	Confident	17 Å²	17	70.3 Å²	70.3	8%	0.075	37%	0.373	C	S	.	.	H	α-helix	trans	-62.3	-49.7	173.1	-174.7	-110.3	0	0	0	111.8	K282 I283 R288 T289 V294 L562 F566 Y570	K282-F286 WeakPolarHBondContact O-CB 3.45Å; K282-F286 PolarHBondContact O-N 3.4Å; I283-F286 PolarHBondContact O-N 3.25Å; F286-R288 VanDerWaalsContact C-N 3.3Å; F286-R288 PolarHBondContact O-N 3.37Å; F286-T289 WeakPolarHBondContact O-CB 3.49Å; F286-T289 PolarHBondContact O-N 3.37Å; F286-T289 VanDerWaalsContact O-N 3.11Å; F286-V294 HydrophobicContact CD1-CG1 4.33Å; F286-V294 HydrophobicContact CE1-CG1 3.66Å; F286-V294 HydrophobicContact CZ-CG1 4.19Å; F286-L562 HydrophobicContact CE1-CD1 4.04Å; F286-L562 HydrophobicContact CE1-CD2 4.45Å; F286-L562 HydrophobicContact CE2-CD2 3.82Å; F286-L562 HydrophobicContact CZ-CD1 3.72Å; F286-L562 HydrophobicContact CZ-CD2 3.81Å; F286-L562 HydrophobicContact CZ-CG 4.3Å; F286-F566 HydrophobicContact CB-CZ 4.26Å; F286-F566 HydrophobicContact CD1-CE1 4.13Å; F286-F566 HydrophobicContact CD1-CZ 4.43Å; F286-F566 HydrophobicContact CG-CE1 4.31Å; F286-F566 HydrophobicContact CG-CZ 4.34Å; F286-Y570 HydrophobicContact CD1-CD2 4.28Å; F286-Y570 AromaticContact CD1-CE2 3.82Å; F286-Y570 HydrophobicContact CD1-CE2 3.82Å; F286-Y570 HydrophobicContact CE1-CE2 4.39Å
287	S	74.8	Confident	75.3	Confident	36 Å²	36	69.3 Å²	69.3	25%	0.252	36%	0.363	S	S	.	.	H	α-helix	trans	-57.9	-37.3	174.5	161.2	0	0	0	0	113.1	I283 T289 R631	I283-S287 PolarHBondContact O-N 3.29Å; S287-T289 VanDerWaalsContact C-N 3.29Å; S287-T289 PolarHBondContact O-N 3.42Å; S287-R631 PolarHBondContact OG-O 3.18Å
288	R	75.2	Confident	75.5	Confident	182 Å²	182	65.5 Å²	65.5	69%	0.687	33%	0.332	S	S	*	.	H	α-helix	trans	-74.2	-11.5	178	-75.9	175.8	172.8	-172.3	-4.8	114.8	R284 N285 F286 R290	R284-R288 WeakPolarHBondContact O-CB 3.49Å; R284-R288 WeakPolarHBondContact O-CG 3.48Å; R284-R288 PolarHBondContact O-N 3.37Å; N285-R288 PolarHBondContact O-N 2.86Å; F286-R288 VanDerWaalsContact C-N 3.3Å; F286-R288 PolarHBondContact O-N 3.37Å; R288-R290 VanDerWaalsContact C-N 3.26Å; R288-R290 PolarHBondContact O-N 3.4Å
289	T	71.1	Confident	75.8	Confident	66 Å²	66	60.5 Å²	60.5	41%	0.405	31%	0.306	S	S	.	.			trans	-77.9	76.4	-177.3	-57.6	0	0	0	0	110.4	N285 F286 S287 S291	N285-T289 PolarHBondContact O-N 2.64Å; N285-T289 PolarHBondContact O-OG1 2.75Å; F286-T289 WeakPolarHBondContact O-CB 3.49Å; F286-T289 PolarHBondContact O-N 3.37Å; F286-T289 VanDerWaalsContact O-N 3.11Å; S287-T289 VanDerWaalsContact C-N 3.29Å; S287-T289 PolarHBondContact O-N 3.42Å; T289-S291 PolarHBondContact O-N 3.15Å; T289-S291 VanDerWaalsContact O-N 3.08Å
290	R	54.4	Low	76.1	Confident	188 Å²	188	65.3 Å²	65.3	71%	0.709	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-3.1	-171.3	-156.5	172	-175.9	125.5	4.3	115.2	R288	R288-R290 VanDerWaalsContact C-N 3.26Å; R288-R290 PolarHBondContact O-N 3.4Å
291	S	48.4	Very low	76.2	Confident	108 Å²	108	63.2 Å²	63.2	76%	0.755	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-4	-176.6	54.7	0	0	0	0	115	T289	T289-S291 PolarHBondContact O-N 3.15Å; T289-S291 VanDerWaalsContact O-N 3.08Å
292	V	54.5	Low	76	Confident	79 Å²	79	61.8 Å²	61.8	48%	0.479	30%	0.298	S	S	.	.	S	Bend	trans	-138	134.3	174.6	-177.7	0	0	0	0	108.5	V294	V292-V294 PolarHBondContact O-N 2.96Å
293	N	70.8	Confident	76	Confident	112 Å²	112	59.5 Å²	59.5	60%	0.599	29%	0.288	S	S	*	.			trans	-62.7	94.9	177.4	-73	-10.9	0	0	0	110.7	F295 N296 Q297	N293-F295 PolarHBondContact O-N 3.23Å; N293-F295 VanDerWaalsContact O-N 3.15Å; N293-N296 HydrophobicContact CB-CB 4.07Å; N293-N296 WeakPolarHBondContact O-CB 3.37Å; N293-N296 PolarHBondContact O-N 3.07Å; N293-Q297 PolarHBondContact O-N 3.44Å; N293-Q297 VanDerWaalsContact O-N 3.08Å
294	V	78.1	Confident	75.8	Confident	18 Å²	18	60.8 Å²	60.8	11%	0.109	30%	0.296	C	S	.	.	H	α-helix	trans	-50.5	-41.6	-176.5	174.7	0	0	0	0	111.5	F286 V292 Q297 L298	F286-V294 HydrophobicContact CD1-CG1 4.33Å; F286-V294 HydrophobicContact CE1-CG1 3.66Å; F286-V294 HydrophobicContact CZ-CG1 4.19Å; V292-V294 PolarHBondContact O-N 2.96Å; V294-Q297 PolarHBondContact O-N 3.27Å; V294-L298 HydrophobicContact CG1-CD1 3.78Å; V294-L298 HydrophobicContact CG1-CG 4.32Å; V294-L298 WeakPolarHBondContact O-CB 3.49Å; V294-L298 WeakPolarHBondContact O-CG 3.41Å; V294-L298 PolarHBondContact O-N 3.19Å
295	F	83.9	Confident	75.7	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-44.1	176.9	-175.7	-114.2	0	0	0	113.5	N293 Q297 L298 A299 K314 L317 C318 H627 A630 V643	N293-F295 PolarHBondContact O-N 3.23Å; N293-F295 VanDerWaalsContact O-N 3.15Å; F295-Q297 VanDerWaalsContact C-N 3.33Å; F295-Q297 PolarHBondContact O-N 3.43Å; F295-L298 PolarHBondContact O-N 3.47Å; F295-A299 WeakPolarHBondContact O-CB 3.36Å; F295-A299 PolarHBondContact O-N 2.83Å; F295-K314 HydrophobicContact CD1-CD 4.47Å; F295-K314 HydrophobicContact CD1-CG 4.2Å; F295-K314 HydrophobicContact CE1-CB 3.7Å; F295-K314 HydrophobicContact CE1-CD 3.83Å; F295-K314 HydrophobicContact CE1-CG 3.51Å; F295-K314 HydrophobicContact CZ-CB 3.71Å; F295-K314 HydrophobicContact CZ-CG 4Å; F295-L317 HydrophobicContact CD2-CD2 3.69Å; F295-L317 HydrophobicContact CE2-CB 4.49Å; F295-L317 HydrophobicContact CE2-CD2 3.72Å; F295-L317 HydrophobicContact CE2-CG 4.2Å; F295-C318 VanDerWaalsContact CZ-SG 3.58Å; F295-H627 AromaticContact CD1-CD2 3.48Å; F295-H627 VanDerWaalsContact CD1-CD2 3.48Å; F295-H627 WeakPolarHBondContact CD1-CD2 3.34Å; F295-H627 AromaticContact CD1-NE2 3.41Å; F295-H627 WeakPolarHBondContact CD1-NE2 3.46Å; F295-H627 AromaticContact CD2-CD2 3.64Å; F295-H627 AromaticContact CE1-CD2 3.69Å; F295-H627 AromaticContact CE2-CD2 3.86Å; F295-H627 AromaticContact CG-CD2 3.45Å; F295-H627 VanDerWaalsContact CG-CD2 3.45Å; F295-H627 WeakPolarHBondContact CG-CD2 3.48Å; F295-H627 AromaticContact CG-NE2 3.42Å; F295-H627 WeakPolarHBondContact CG-NE2 3.43Å; F295-H627 AromaticContact CZ-CD2 3.89Å; F295-A630 HydrophobicContact CD2-CB 3.86Å; F295-A630 HydrophobicContact CE2-CB 4.49Å; F295-V643 HydrophobicContact CD1-CG1 4.26Å; F295-V643 HydrophobicContact CE1-CG1 3.94Å
296	N	84	Confident	75.8	Confident	53 Å²	53	52.4 Å²	52.4	28%	0.283	26%	0.264	S	S	.	.	H	α-helix	trans	-66	-37.5	175.7	-70.6	-17.9	0	0	0	111.2	N293 A299 R300 K314	N293-N296 HydrophobicContact CB-CB 4.07Å; N293-N296 WeakPolarHBondContact O-CB 3.37Å; N293-N296 PolarHBondContact O-N 3.07Å; N296-A299 PolarHBondContact O-N 3.05Å; N296-R300 WeakPolarHBondContact O-CB 3.38Å; N296-R300 WeakPolarHBondContact O-CG 3.38Å; N296-R300 PolarHBondContact O-N 2.68Å; N296-K314 WeakPolarHBondContact OD1-CE 3.43Å; N296-K314 PolarHBondContact OD1-NZ 2.96Å
297	Q	83.3	Confident	75.9	Confident	21 Å²	21	55 Å²	55	10%	0.098	28%	0.277	C	S	.	.	H	α-helix	trans	-68.6	-41.5	179	-161.1	64.5	12	0	0	112.1	N293 V294 F295 S301 K560	N293-Q297 PolarHBondContact O-N 3.44Å; N293-Q297 VanDerWaalsContact O-N 3.08Å; V294-Q297 PolarHBondContact O-N 3.27Å; F295-Q297 VanDerWaalsContact C-N 3.33Å; F295-Q297 PolarHBondContact O-N 3.43Å; Q297-S301 VanDerWaalsContact O-CB 3.28Å; Q297-S301 WeakPolarHBondContact O-CB 3.36Å; Q297-S301 PolarHBondContact O-N 3.24Å; Q297-S301 PolarHBondContact O-OG 3.34Å; Q297-K560 PolarHBondContact NE2-O 3.45Å
298	L	84.2	Confident	76.2	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-45.2	172.3	-72.1	164.6	0	0	0	111.2	V294 F295 R300 S301 L302 L317 L562 M567 Y570	V294-L298 HydrophobicContact CG1-CD1 3.78Å; V294-L298 HydrophobicContact CG1-CG 4.32Å; V294-L298 WeakPolarHBondContact O-CB 3.49Å; V294-L298 WeakPolarHBondContact O-CG 3.41Å; V294-L298 PolarHBondContact O-N 3.19Å; F295-L298 PolarHBondContact O-N 3.47Å; L298-R300 PolarHBondContact O-N 3.44Å; L298-S301 CarbonylContact O-C 3.55Å; L298-S301 PolarHBondContact O-N 3.37Å; L298-L302 PolarHBondContact O-N 2.81Å; L298-L317 HydrophobicContact CB-CD1 4.4Å; L298-L317 HydrophobicContact CB-CD2 3.44Å; L298-L317 VanDerWaalsContact CB-CD2 3.44Å; L298-L317 HydrophobicContact CD1-CD2 4.34Å; L298-L562 HydrophobicContact CD2-CD1 3.55Å; L298-L562 HydrophobicContact CG-CD1 4.2Å; L298-M567 HydrophobicContact CD2-SD 3.7Å; L298-Y570 HydrophobicContact CD1-CD1 4.2Å; L298-Y570 HydrophobicContact CD1-CE1 3.71Å; L298-Y570 HydrophobicContact CD2-CD1 4.1Å; L298-Y570 HydrophobicContact CD2-CE1 4.37Å
299	A	84.9	Confident	76.6	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.033	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-41.7	179.3	0	0	0	0	0	112.5	F295 N296 L302 K313 K314 L317	F295-A299 WeakPolarHBondContact O-CB 3.36Å; F295-A299 PolarHBondContact O-N 2.83Å; N296-A299 PolarHBondContact O-N 3.05Å; A299-L302 WeakPolarHBondContact O-CB 3Å; A299-L302 PolarHBondContact O-N 3.47Å; A299-K313 HydrophobicContact CB-CB 4.29Å; A299-K313 WeakPolarHBondContact O-CB 3.29Å; A299-K313 WeakPolarHBondContact O-CD 2.94Å; A299-K314 HydrophobicContact CB-CG 3.83Å; A299-L317 HydrophobicContact CB-CD2 4.45Å
300	R	82.2	Confident	77.4	Confident	117 Å²	117	48.9 Å²	48.9	44%	0.442	26%	0.257	S	S	.	.	H	α-helix	trans	-67.3	-39.9	173.6	-73.3	177	175.7	-175.2	-1	112.5	N296 L298 L302 D310 D559	N296-R300 WeakPolarHBondContact O-CB 3.38Å; N296-R300 WeakPolarHBondContact O-CG 3.38Å; N296-R300 PolarHBondContact O-N 2.68Å; L298-R300 PolarHBondContact O-N 3.44Å; R300-L302 PolarHBondContact O-N 3.3Å; R300-D310 IonicContact NE-OD2 2.81Å; R300-D310 IonicContact NH2-OD2 3.2Å; R300-D559 IonicContact NH1-OD2 3.9Å
301	S	82.4	Confident	79	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-72	-14.4	177.1	-54.5	0	0	0	0	113.4	Q297 L298 L562 M567	Q297-S301 VanDerWaalsContact O-CB 3.28Å; Q297-S301 WeakPolarHBondContact O-CB 3.36Å; Q297-S301 PolarHBondContact O-N 3.24Å; Q297-S301 PolarHBondContact O-OG 3.34Å; L298-S301 CarbonylContact O-C 3.55Å; L298-S301 PolarHBondContact O-N 3.37Å; S301-L562 PolarHBondContact OG-N 3.25Å; S301-L562 VanDerWaalsContact OG-N 3.15Å; S301-M567 WeakPolarHBondContact O-CE 3.42Å
302	L	79.3	Confident	81	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-74	174.9	-170.1	72.2	0	0	0	109.8	L298 A299 R300 P304 I316 L320 Y356 T360 M567	L298-L302 PolarHBondContact O-N 2.81Å; A299-L302 WeakPolarHBondContact O-CB 3Å; A299-L302 PolarHBondContact O-N 3.47Å; R300-L302 PolarHBondContact O-N 3.3Å; L302-P304 WeakPolarHBondContact O-CD 3.28Å; L302-I316 HydrophobicContact CD2-CB 4.03Å; L302-I316 HydrophobicContact CD2-CG2 3.61Å; L302-L320 HydrophobicContact CD1-CD1 3.67Å; L302-L320 HydrophobicContact CD2-CD1 4.34Å; L302-Y356 HydrophobicContact CD1-CD1 4.41Å; L302-Y356 HydrophobicContact CD1-CE1 4.12Å; L302-Y356 HydrophobicContact CG-CD1 4.28Å; L302-Y356 HydrophobicContact CG-CE1 4.22Å; L302-Y356 WeakPolarHBondContact O-CE1 3.34Å; L302-Y356 PolarHBondContact O-OH 3.22Å; L302-T360 HydrophobicContact CD1-CG2 4.1Å; L302-M567 HydrophobicContact CB-CE 4.23Å; L302-M567 HydrophobicContact CD1-CE 4.05Å
303	A	79.5	Confident	82.7	Confident	1 Å²	1	36 Å²	36	1%	0.008	19%	0.185	C	C	.	.			trans	-108.1	87.9	178.8	0	0	0	0	0	110.8	S305 I306 K313 L353	A303-S305 VanDerWaalsContact C-N 3.32Å; A303-I306 HydrophobicContact CB-CB 4.41Å; A303-I306 HydrophobicContact CB-CD1 4.4Å; A303-K313 HydrophobicContact CB-CD 4.35Å; A303-K313 WeakPolarHBondContact O-CE 3.47Å; A303-K313 PolarHBondContact O-NZ 3.46Å; A303-L353 HydrophobicContact CB-CD2 4.3Å
304	P	77.5	Confident	83.6	Confident	31 Å²	31	31.8 Å²	31.8	20%	0.201	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-26.2	174.6	30	-35.4	0	0	0	111.9	L302 I306 H499 I561	L302-P304 WeakPolarHBondContact O-CD 3.28Å; P304-I306 VanDerWaalsContact C-N 3.27Å; P304-I306 PolarHBondContact O-N 3.28Å; P304-H499 PolarHBondContact O-CE1 2.89Å; P304-H499 PolarHBondContact O-NE2 3.03Å; P304-H499 VanDerWaalsContact O-NE2 3.09Å; P304-I561 HydrophobicContact CB-CD1 4.17Å
305	S	80.5	Confident	84.2	Confident	39 Å²	39	30.9 Å²	30.9	27%	0.273	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-14.5	-179	55.1	0	0	0	0	114.8	A303	A303-S305 VanDerWaalsContact C-N 3.32Å
306	I	83.4	Confident	84.6	Confident	14 Å²	14	30.7 Å²	30.7	7%	0.072	16%	0.155	C	C	.	.	S	Bend	trans	-113.9	119.9	-175.9	-61.3	173.9	0	0	0	108	A303 P304 K313 A349 Q352 L353	A303-I306 HydrophobicContact CB-CB 4.41Å; A303-I306 HydrophobicContact CB-CD1 4.4Å; P304-I306 VanDerWaalsContact C-N 3.27Å; P304-I306 PolarHBondContact O-N 3.28Å; I306-K313 PolarHBondContact O-NZ 3.39Å; I306-A349 HydrophobicContact CD1-CB 4.16Å; I306-A349 HydrophobicContact CG1-CB 4.38Å; I306-A349 HydrophobicContact CG2-CB 4.19Å; I306-Q352 HydrophobicContact CD1-CB 4.09Å; I306-Q352 HydrophobicContact CD1-CG 4.13Å; I306-L353 HydrophobicContact CD1-CD2 3.63Å; I306-L353 HydrophobicContact CD1-CG 3.74Å
307	H	81.8	Confident	84.9	Confident	73 Å²	73	28.2 Å²	28.2	34%	0.338	14%	0.142	S	C	.	.			trans	-75	149	174.4	-164	-105.4	0	0	0	111.2	E495 I496 H499	H307-E495 IonicContact CE1-OE2 3.64Å; H307-E495 PolarHBondContact CE1-OE2 3.18Å; H307-E495 VanDerWaalsContact CE1-OE2 3.25Å; H307-I496 HydrophobicContact CB-CG1 4.18Å; H307-H499 HydrophobicContact CB-CB 4.24Å
308	G	80.8	Confident	85.3	Confident	29 Å²	29	27.3 Å²	27.3	30%	0.299	14%	0.137	S	C	.	.	S	Bend	trans	68.4	-159.3	179.3	0	0	0	0	0	115.8	D310 K313	G308-D310 PolarHBondContact O-N 2.69Å; G308-K313 WeakPolarHBondContact O-CE 3.22Å; G308-K313 PolarHBondContact O-NZ 3.36Å
309	H	84.4	Confident	85.6	Confident	65 Å²	65	27.4 Å²	27.4	30%	0.301	14%	0.138	S	C	.	.			trans	55.3	36.9	-179.9	-57.8	-55.6	0	0	0	116.4	Y311 I312 K313 M484	H309-Y311 VanDerWaalsContact C-N 3.32Å; H309-Y311 PolarHBondContact O-N 2.77Å; H309-I312 HydrophobicContact CB-CB 4.27Å; H309-I312 HydrophobicContact CB-CD1 4.23Å; H309-I312 HydrophobicContact CB-CG1 4.43Å; H309-I312 PolarHBondContact O-N 3.4Å; H309-K313 PolarHBondContact O-N 3.3Å; H309-K313 VanDerWaalsContact O-N 3.09Å; H309-M484 VanDerWaalsContact CD2-CE 3.49Å; H309-M484 WeakPolarHBondContact CD2-CE 3.42Å; H309-M484 WeakPolarHBondContact NE2-CE 3.33Å
310	D	86.3	Confident	85.9	Confident	61 Å²	61	27.3 Å²	27.3	33%	0.326	14%	0.137	S	C	.	.	H	α-helix	trans	-52.2	-42.4	-178.2	-78.8	13.7	0	0	0	113.7	R300 G308 I312 K313 K314	R300-D310 IonicContact NE-OD2 2.81Å; R300-D310 IonicContact NH2-OD2 3.2Å; G308-D310 PolarHBondContact O-N 2.69Å; D310-I312 VanDerWaalsContact C-N 3.32Å; D310-I312 PolarHBondContact O-N 2.82Å; D310-K313 PolarHBondContact O-N 3.26Å; D310-K314 WeakPolarHBondContact O-CB 3.35Å; D310-K314 VanDerWaalsContact O-CG 3.3Å; D310-K314 WeakPolarHBondContact O-CG 3.43Å; D310-K314 PolarHBondContact O-N 3.12Å
311	Y	88.5	Confident	86.2	Confident	87 Å²	87	22 Å²	22	34%	0.341	12%	0.117	S	C	.	.	H	α-helix	trans	-61.6	-36.2	176.6	-66	-71.6	0	0	0	113.6	H309 K314 A315 L647 F650	H309-Y311 VanDerWaalsContact C-N 3.32Å; H309-Y311 PolarHBondContact O-N 2.77Å; Y311-K314 HydrophobicContact CD1-CD 4.42Å; Y311-K314 WeakPolarHBondContact O-CB 3.41Å; Y311-A315 WeakPolarHBondContact O-CB 3.47Å; Y311-A315 PolarHBondContact O-N 2.87Å; Y311-L647 HydrophobicContact CD1-CD2 3.94Å; Y311-L647 WeakPolarHBondContact O-CD2 3.4Å; Y311-F650 HydrophobicContact CD1-CG 4.48Å; Y311-F650 HydrophobicContact CD2-CD1 4.02Å; Y311-F650 AromaticContact CD2-CD2 3.82Å; Y311-F650 HydrophobicContact CD2-CD2 3.82Å; Y311-F650 AromaticContact CD2-CE1 3.94Å; Y311-F650 HydrophobicContact CD2-CE1 3.94Å; Y311-F650 AromaticContact CD2-CE2 3.73Å; Y311-F650 HydrophobicContact CD2-CE2 3.73Å; Y311-F650 AromaticContact CD2-CG 3.97Å; Y311-F650 HydrophobicContact CD2-CG 3.97Å; Y311-F650 AromaticContact CD2-CZ 3.79Å; Y311-F650 HydrophobicContact CD2-CZ 3.79Å; Y311-F650 AromaticContact CE2-CD2 3.92Å; Y311-F650 HydrophobicContact CE2-CD2 3.92Å; Y311-F650 AromaticContact CE2-CE2 3.98Å; Y311-F650 HydrophobicContact CE2-CE2 3.98Å; Y311-F650 HydrophobicContact CE2-CG 4.37Å; Y311-F650 HydrophobicContact CE2-CZ 4.49Å; Y311-F650 AromaticContact CG-CD1 3.91Å; Y311-F650 HydrophobicContact CG-CD1 3.91Å; Y311-F650 HydrophobicContact CG-CD2 4.35Å; Y311-F650 HydrophobicContact CG-CE1 4.12Å; Y311-F650 HydrophobicContact CG-CG 4.03Å; Y311-F650 HydrophobicContact CG-CZ 4.44Å
312	I	90.6	Very high	86.3	Confident	6 Å²	6	22.2 Å²	22.2	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-73.4	-39.9	179	-57.7	-179.3	0	0	0	109.6	H309 D310 A315 I316 L342 L353 F482 M484	H309-I312 HydrophobicContact CB-CB 4.27Å; H309-I312 HydrophobicContact CB-CD1 4.23Å; H309-I312 HydrophobicContact CB-CG1 4.43Å; H309-I312 PolarHBondContact O-N 3.4Å; D310-I312 VanDerWaalsContact C-N 3.32Å; D310-I312 PolarHBondContact O-N 2.82Å; I312-A315 PolarHBondContact O-N 2.72Å; I312-I316 HydrophobicContact CG2-CD1 3.95Å; I312-I316 HydrophobicContact CG2-CG1 4.45Å; I312-I316 VanDerWaalsContact O-CG1 3.28Å; I312-I316 WeakPolarHBondContact O-CG1 3.43Å; I312-I316 PolarHBondContact O-N 2.89Å; I312-L342 HydrophobicContact CG2-CD2 3.67Å; I312-L353 HydrophobicContact CG2-CD1 4.22Å; I312-F482 HydrophobicContact CD1-CB 3.95Å; I312-F482 HydrophobicContact CD1-CG 4.22Å; I312-F482 HydrophobicContact CG1-CB 4.11Å; I312-F482 HydrophobicContact CG1-CD1 4.03Å; I312-F482 HydrophobicContact CG1-CD2 4.13Å; I312-F482 HydrophobicContact CG1-CG 3.81Å; I312-F482 HydrophobicContact CG2-CD2 4.46Å; I312-M484 HydrophobicContact CD1-CE 3.74Å; I312-M484 HydrophobicContact CD1-CG 3.55Å; I312-M484 HydrophobicContact CD1-SD 3.68Å
313	K	90.1	Very high	86.5	Confident	11 Å²	11	22.5 Å²	22.5	5%	0.048	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-42	173.7	-62.1	178.9	-170.8	177.9	0	112	A299 A303 I306 G308 H309 D310 I316 L317	A299-K313 HydrophobicContact CB-CB 4.29Å; A299-K313 WeakPolarHBondContact O-CB 3.29Å; A299-K313 WeakPolarHBondContact O-CD 2.94Å; A303-K313 HydrophobicContact CB-CD 4.35Å; A303-K313 WeakPolarHBondContact O-CE 3.47Å; A303-K313 PolarHBondContact O-NZ 3.46Å; I306-K313 PolarHBondContact O-NZ 3.39Å; G308-K313 WeakPolarHBondContact O-CE 3.22Å; G308-K313 PolarHBondContact O-NZ 3.36Å; H309-K313 PolarHBondContact O-N 3.3Å; H309-K313 VanDerWaalsContact O-N 3.09Å; D310-K313 PolarHBondContact O-N 3.26Å; K313-I316 PolarHBondContact O-N 3.16Å; K313-L317 WeakPolarHBondContact O-CB 3.43Å; K313-L317 PolarHBondContact O-N 3.23Å
314	K	90	Very high	86.9	Confident	23 Å²	23	24.1 Å²	24.1	10%	0.1	13%	0.134	C	C	.	.	H	α-helix	trans	-57.1	-48	171.7	-74.8	174.5	174.4	-170	0	111.6	F295 N296 A299 D310 Y311 L317 C318 L647	F295-K314 HydrophobicContact CD1-CD 4.47Å; F295-K314 HydrophobicContact CD1-CG 4.2Å; F295-K314 HydrophobicContact CE1-CB 3.7Å; F295-K314 HydrophobicContact CE1-CD 3.83Å; F295-K314 HydrophobicContact CE1-CG 3.51Å; F295-K314 HydrophobicContact CZ-CB 3.71Å; F295-K314 HydrophobicContact CZ-CG 4Å; N296-K314 WeakPolarHBondContact OD1-CE 3.43Å; N296-K314 PolarHBondContact OD1-NZ 2.96Å; A299-K314 HydrophobicContact CB-CG 3.83Å; D310-K314 WeakPolarHBondContact O-CB 3.35Å; D310-K314 VanDerWaalsContact O-CG 3.3Å; D310-K314 WeakPolarHBondContact O-CG 3.43Å; D310-K314 PolarHBondContact O-N 3.12Å; Y311-K314 HydrophobicContact CD1-CD 4.42Å; Y311-K314 WeakPolarHBondContact O-CB 3.41Å; K314-L317 WeakPolarHBondContact O-CB 3.33Å; K314-L317 PolarHBondContact O-N 3.46Å; K314-C318 PolarHBondContact O-N 3.2Å; K314-L647 HydrophobicContact CB-CD1 4.43Å; K314-L647 HydrophobicContact CB-CD2 3.91Å; K314-L647 HydrophobicContact CD-CD2 4.25Å
315	A	91.1	Very high	87.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-41.8	179.3	0	0	0	0	0	113.3	Y311 I312 L317 C318 M319 L480 F482	Y311-A315 WeakPolarHBondContact O-CB 3.47Å; Y311-A315 PolarHBondContact O-N 2.87Å; I312-A315 PolarHBondContact O-N 2.72Å; A315-L317 VanDerWaalsContact C-N 3.3Å; A315-L317 PolarHBondContact O-N 2.95Å; A315-C318 PolarHBondContact O-N 3.25Å; A315-M319 PolarHBondContact O-N 3.09Å; A315-L480 HydrophobicContact CB-CD1 3.65Å; A315-F482 HydrophobicContact CB-CE2 3.4Å; A315-F482 VanDerWaalsContact CB-CE2 3.4Å; A315-F482 HydrophobicContact CB-CZ 3.51Å
316	I	91.8	Very high	87.6	Confident	1 Å²	1	29 Å²	29	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-62.5	-39.1	173.8	-67.5	169	0	0	0	110.3	L302 I312 K313 M319 L320 L353 V357 L448	L302-I316 HydrophobicContact CD2-CB 4.03Å; L302-I316 HydrophobicContact CD2-CG2 3.61Å; I312-I316 HydrophobicContact CG2-CD1 3.95Å; I312-I316 HydrophobicContact CG2-CG1 4.45Å; I312-I316 VanDerWaalsContact O-CG1 3.28Å; I312-I316 WeakPolarHBondContact O-CG1 3.43Å; I312-I316 PolarHBondContact O-N 2.89Å; K313-I316 PolarHBondContact O-N 3.16Å; I316-M319 HydrophobicContact CG2-CE 4.13Å; I316-M319 WeakPolarHBondContact O-CB 3.26Å; I316-M319 PolarHBondContact O-N 2.79Å; I316-L320 HydrophobicContact CG2-CD1 4.19Å; I316-L320 HydrophobicContact CG2-CG 4.36Å; I316-L320 WeakPolarHBondContact O-CB 3.45Å; I316-L320 VanDerWaalsContact O-CG 3.28Å; I316-L320 WeakPolarHBondContact O-CG 3.47Å; I316-L320 PolarHBondContact O-N 3.15Å; I316-L353 HydrophobicContact CD1-CB 4.47Å; I316-L353 HydrophobicContact CD1-CD2 4.26Å; I316-V357 HydrophobicContact CG2-CG2 3.39Å; I316-L448 HydrophobicContact CG1-CD1 4.42Å
317	L	90.8	Very high	87.8	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-43.5	173.9	179.8	63.9	0	0	0	112.1	F295 L298 A299 K313 K314 A315 M319 L320 L321	F295-L317 HydrophobicContact CD2-CD2 3.69Å; F295-L317 HydrophobicContact CE2-CB 4.49Å; F295-L317 HydrophobicContact CE2-CD2 3.72Å; F295-L317 HydrophobicContact CE2-CG 4.2Å; L298-L317 HydrophobicContact CB-CD1 4.4Å; L298-L317 HydrophobicContact CB-CD2 3.44Å; L298-L317 VanDerWaalsContact CB-CD2 3.44Å; L298-L317 HydrophobicContact CD1-CD2 4.34Å; A299-L317 HydrophobicContact CB-CD2 4.45Å; K313-L317 WeakPolarHBondContact O-CB 3.43Å; K313-L317 PolarHBondContact O-N 3.23Å; K314-L317 WeakPolarHBondContact O-CB 3.33Å; K314-L317 PolarHBondContact O-N 3.46Å; A315-L317 VanDerWaalsContact C-N 3.3Å; A315-L317 PolarHBondContact O-N 2.95Å; L317-M319 VanDerWaalsContact C-N 3.34Å; L317-M319 PolarHBondContact O-N 2.91Å; L317-L320 PolarHBondContact O-N 2.71Å; L317-L321 HydrophobicContact CD1-CD1 4.4Å; L317-L321 HydrophobicContact CG-CD1 4.26Å; L317-L321 WeakPolarHBondContact O-CG 3.44Å; L317-L321 PolarHBondContact O-N 3.03Å
318	C	91.1	Very high	88.2	Confident	1 Å²	1	34 Å²	34	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-42.4	173.5	-70	0	0	0	0	112.2	F295 K314 A315 L321 G322 I338 L623 A626	F295-C318 VanDerWaalsContact CZ-SG 3.58Å; K314-C318 PolarHBondContact O-N 3.2Å; A315-C318 PolarHBondContact O-N 3.25Å; C318-L321 PolarHBondContact O-N 3.11Å; C318-G322 PolarHBondContact O-N 3.28Å; C318-I338 HydrophobicContact CB-CD1 4.19Å; C318-L623 HydrophobicContact CB-CD2 3.9Å; C318-A626 HydrophobicContact CB-CB 3.88Å
319	M	91.7	Very high	88.6	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-41.7	174.1	178	-167.7	76.1	0	0	112.1	A315 I316 L317 L321 G322 I338 V340 V357 V404 L448	A315-M319 PolarHBondContact O-N 3.09Å; I316-M319 HydrophobicContact CG2-CE 4.13Å; I316-M319 WeakPolarHBondContact O-CB 3.26Å; I316-M319 PolarHBondContact O-N 2.79Å; L317-M319 VanDerWaalsContact C-N 3.34Å; L317-M319 PolarHBondContact O-N 2.91Å; M319-L321 VanDerWaalsContact C-N 3.29Å; M319-L321 PolarHBondContact O-N 3.26Å; M319-G322 PolarHBondContact O-N 2.88Å; M319-I338 WeakPolarHBondContact CG-O 3.44Å; M319-V340 HydrophobicContact CB-CG2 4.26Å; M319-V340 HydrophobicContact SD-CB 4.39Å; M319-V340 HydrophobicContact SD-CG2 4.1Å; M319-V357 HydrophobicContact CE-CG1 4.19Å; M319-V404 HydrophobicContact CE-CG1 3.93Å; M319-V404 HydrophobicContact SD-CG1 4.46Å; M319-L448 HydrophobicContact CE-CB 3.98Å; M319-L448 HydrophobicContact CE-CD1 4.25Å; M319-L448 HydrophobicContact CE-CD2 4.1Å; M319-L448 HydrophobicContact CE-CG 4.33Å; M319-L448 HydrophobicContact SD-CB 3.86Å; M319-L448 HydrophobicContact SD-CD1 4.15Å; M319-L448 HydrophobicContact SD-CG 4.49Å
320	L	89.4	Confident	88.7	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-63.6	-32.4	177.2	-74.4	173.8	0	0	0	113	L302 I316 L317 V357 A361 V404 I571 K575	L302-L320 HydrophobicContact CD1-CD1 3.67Å; L302-L320 HydrophobicContact CD2-CD1 4.34Å; I316-L320 HydrophobicContact CG2-CD1 4.19Å; I316-L320 HydrophobicContact CG2-CG 4.36Å; I316-L320 WeakPolarHBondContact O-CB 3.45Å; I316-L320 VanDerWaalsContact O-CG 3.28Å; I316-L320 WeakPolarHBondContact O-CG 3.47Å; I316-L320 PolarHBondContact O-N 3.15Å; L317-L320 PolarHBondContact O-N 2.71Å; L320-V357 HydrophobicContact CD2-CG1 4.28Å; L320-A361 HydrophobicContact CD2-CB 3.47Å; L320-A361 VanDerWaalsContact CD2-CB 3.47Å; L320-V404 HydrophobicContact CD2-CG2 4.35Å; L320-I571 HydrophobicContact CD1-CD1 4.4Å; L320-K575 WeakPolarHBondContact O-CE 3.5Å
321	L	88.6	Confident	88.5	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-80.6	-31.8	175.5	-67.5	166.9	0	0	0	112.6	L317 C318 M319 I571 A574 A626 K629 A630	L317-L321 HydrophobicContact CD1-CD1 4.4Å; L317-L321 HydrophobicContact CG-CD1 4.26Å; L317-L321 WeakPolarHBondContact O-CG 3.44Å; L317-L321 PolarHBondContact O-N 3.03Å; C318-L321 PolarHBondContact O-N 3.11Å; M319-L321 VanDerWaalsContact C-N 3.29Å; M319-L321 PolarHBondContact O-N 3.26Å; L321-I571 HydrophobicContact CD2-CG1 4.41Å; L321-I571 HydrophobicContact CD2-CG2 4.36Å; L321-A574 HydrophobicContact CD2-CB 3.5Å; L321-A574 VanDerWaalsContact CD2-CB 3.5Å; L321-A626 WeakPolarHBondContact CD1-O 3.46Å; L321-K629 PolarHBondContact O-NZ 2.83Å; L321-A630 HydrophobicContact CD1-CB 3.52Å
322	G	85.1	Confident	88.3	Confident	9 Å²	9	45.6 Å²	45.6	9%	0.093	25%	0.254	C	S	.	.			trans	65.9	156.8	-174.7	0	0	0	0	0	113.2	C318 M319 K629	C318-G322 PolarHBondContact O-N 3.28Å; M319-G322 PolarHBondContact O-N 2.88Å; G322-K629 WeakPolarHBondContact O-CD 3.49Å; G322-K629 WeakPolarHBondContact O-CE 3.49Å; G322-K629 PolarHBondContact O-NZ 2.84Å
323	G	83.6	Confident	88	Confident	10 Å²	10	48.2 Å²	48.2	10%	0.103	26%	0.264	C	S	.	.			trans	-76	-163.2	170.8	0	0	0	0	0	112.6	G336 K629	G323-G336 WeakPolarHBondContact CA-O 3.5Å; G323-G336 PolarHBondContact N-O 3.44Å; G323-K629 PolarHBondContact O-NZ 2.96Å
324	V	88.1	Confident	87.8	Confident	35 Å²	35	51 Å²	51	21%	0.212	28%	0.279	C	S	.	.			trans	-104.3	119.3	175.3	179.7	0	0	0	0	109.2	T578 P579	V324-T578 HydrophobicContact CG1-CG2 4.29Å; V324-P579 HydrophobicContact CG2-CG 4.38Å
325	E	87	Confident	87.8	Confident	58 Å²	58	51.2 Å²	51.2	27%	0.271	28%	0.279	S	S	.	.			trans	-65.6	134.1	168.4	-63.7	-170.2	-161.8	0	0	110	R333	E325-R333 IonicContact OE1-NH2 3.82Å; E325-R333 PolarHBondContact OE1-NH2 3.2Å; E325-R333 IonicContact OE2-CZ 3.71Å; E325-R333 IonicContact OE2-NE 2.7Å; E325-R333 PolarHBondContact OE2-NE 3.21Å; E325-R333 IonicContact OE2-NH2 3.74Å; E325-R333 PolarHBondContact OE2-NH2 2.8Å
326	K	85.8	Confident	87.5	Confident	113 Å²	113	51.3 Å²	51.3	49%	0.491	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.4	172.5	-67.8	-174.2	178.9	-178.2	0	110	R333 I334	K326-R333 WeakPolarHBondContact O-CA 3.49Å; K326-I334 HydrophobicContact CB-CB 4.5Å; K326-I334 PolarHBondContact N-O 3.32Å; K326-I334 PolarHBondContact O-N 2.84Å
327	V	86.8	Confident	87.5	Confident	106 Å²	106	52.5 Å²	52.5	64%	0.642	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.7	167.3	-178.4	0	0	0	0	106.7	R333	V327-R333 HydrophobicContact CG2-CG 4.32Å
328	L	89.9	Confident	87.6	Confident	87 Å²	87	52.4 Å²	52.4	46%	0.455	29%	0.285	S	S	.	.			trans	-82.4	154.6	175.4	-65.4	166.3	0	0	0	109.4	N330 G331 T332 I334	L328-N330 PolarHBondContact O-N 2.91Å; L328-N330 VanDerWaalsContact O-N 3.11Å; L328-G331 PolarHBondContact O-N 3.36Å; L328-T332 WeakPolarHBondContact CD1-OG1 3.26Å; L328-T332 PolarHBondContact N-O 3.33Å; L328-I334 HydrophobicContact CD1-CD1 4.21Å
329	E	89.5	Confident	87.6	Confident	201 Å²	201	52.6 Å²	52.6	94%	0.939	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.4	179.6	-61.2	-178.9	168.9	0	0	112.4	G331	E329-G331 PolarHBondContact O-N 2.87Å; E329-G331 VanDerWaalsContact O-N 3.1Å
330	N	87.8	Confident	87.7	Confident	148 Å²	148	52.4 Å²	52.4	79%	0.791	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	4.3	175.5	-60.1	-5	0	0	0	114.1	L328 T332	L328-N330 PolarHBondContact O-N 2.91Å; L328-N330 VanDerWaalsContact O-N 3.11Å; N330-T332 PolarHBondContact O-N 2.91Å
331	G	81.2	Confident	87.8	Confident	60 Å²	60	52.3 Å²	52.3	62%	0.619	29%	0.285	S	S	*	.	S	Bend	trans	77.3	-2.2	-179.2	0	0	0	0	0	115.2	L328 E329	L328-G331 PolarHBondContact O-N 3.36Å; E329-G331 PolarHBondContact O-N 2.87Å; E329-G331 VanDerWaalsContact O-N 3.1Å
332	T	85.1	Confident	87.9	Confident	77 Å²	77	52.1 Å²	52.1	47%	0.472	28%	0.284	S	S	.	.			trans	-73.1	138	170.9	45.3	0	0	0	0	110.5	L328 N330	L328-T332 WeakPolarHBondContact CD1-OG1 3.26Å; L328-T332 PolarHBondContact N-O 3.33Å; N330-T332 PolarHBondContact O-N 2.91Å
333	R	83.5	Confident	88.1	Confident	60 Å²	60	51.7 Å²	51.7	23%	0.226	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.3	-178.2	175	173.4	169.4	-100.4	-5.1	109.8	E325 K326 V327 R444	E325-R333 IonicContact OE1-NH2 3.82Å; E325-R333 PolarHBondContact OE1-NH2 3.2Å; E325-R333 IonicContact OE2-CZ 3.71Å; E325-R333 IonicContact OE2-NE 2.7Å; E325-R333 PolarHBondContact OE2-NE 3.21Å; E325-R333 IonicContact OE2-NH2 3.74Å; E325-R333 PolarHBondContact OE2-NH2 2.8Å; K326-R333 WeakPolarHBondContact O-CA 3.49Å; V327-R333 HydrophobicContact CG2-CG 4.32Å; R333-R444 VanDerWaalsContact NH2-CG 3.29Å
334	I	86.7	Confident	88.3	Confident	70 Å²	70	51.2 Å²	51.2	36%	0.359	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.6	173.3	-59.3	171.8	0	0	0	108	K326 L328	K326-I334 HydrophobicContact CB-CB 4.5Å; K326-I334 PolarHBondContact N-O 3.32Å; K326-I334 PolarHBondContact O-N 2.84Å; L328-I334 HydrophobicContact CD1-CD1 4.21Å
335	R	88.6	Confident	88.3	Confident	28 Å²	28	50.3 Å²	50.3	11%	0.106	27%	0.268	C	S	.	.			trans	-67.3	133.4	180	76.4	-177.6	-164.6	-177.2	4	110.8	M425 R477 D479 R622	R335-M425 PolarHBondContact NH1-O 2.84Å; R335-R477 PolarHBondContact NH2-O 2.85Å; R335-D479 IonicContact CZ-OD1 3.94Å; R335-D479 IonicContact NH2-OD1 2.82Å; R335-D479 PolarHBondContact NH2-OD1 3.35Å; R335-R622 PolarHBondContact O-NE 2.83Å; R335-R622 PolarHBondContact O-NH2 2.81Å; R335-R622 VanDerWaalsContact O-NH2 3.12Å
336	G	86.3	Confident	88.2	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.01	28%	0.277	C	S	.	.			trans	-97.5	-11.7	174.8	0	0	0	0	0	114	G323	G323-G336 WeakPolarHBondContact CA-O 3.5Å; G323-G336 PolarHBondContact N-O 3.44Å
337	D	90.8	Very high	88	Confident	27 Å²	27	51.4 Å²	51.4	14%	0.144	30%	0.295	C	S	.	.			trans	-78	144.8	-173.4	-55.1	-53.1	0	0	0	112.1	R622	D337-R622 VanDerWaalsContact O-CD 3.29Å; D337-R622 WeakPolarHBondContact O-CD 3.25Å
338	I	92.1	Very high	87.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.27	C	S	.	.			trans	-107	129.9	179.9	-62	161.8	0	0	0	108	C318 M319 V340 S446 D479 R622 L623 A626	C318-I338 HydrophobicContact CB-CD1 4.19Å; M319-I338 WeakPolarHBondContact CG-O 3.44Å; I338-V340 HydrophobicContact CG2-CG2 4.21Å; I338-S446 WeakPolarHBondContact O-CB 3.29Å; I338-D479 HydrophobicContact CG2-CB 4.16Å; I338-R622 HydrophobicContact CD1-CB 4.11Å; I338-R622 HydrophobicContact CG1-CB 3.73Å; I338-L623 HydrophobicContact CD1-CD2 4.06Å; I338-A626 HydrophobicContact CD1-CB 4.06Å
339	N	92.8	Very high	87.6	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	26%	0.262	C	S	.	.			trans	-109.9	131.6	178	-60.7	-53.8	0	0	0	110.5	M425 V447 F478 D479 L480	N339-M425 HydrophobicContact CB-CE 3.68Å; N339-V447 WeakPolarHBondContact CA-O 3.36Å; N339-V447 PolarHBondContact OD1-N 3.35Å; N339-F478 HydrophobicContact CB-CD1 3.87Å; N339-F478 HydrophobicContact CB-CE1 4.4Å; N339-D479 PolarHBondContact O-N 3.11Å; N339-L480 PolarHBondContact O-N 3.36Å; N339-L480 VanDerWaalsContact O-N 3.17Å
340	V	92.3	Very high	87.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.3	-174.8	-176.3	0	0	0	0	110.4	M319 I338 L342 V447 L448 A449 L480 F482	M319-V340 HydrophobicContact CB-CG2 4.26Å; M319-V340 HydrophobicContact SD-CB 4.39Å; M319-V340 HydrophobicContact SD-CG2 4.1Å; I338-V340 HydrophobicContact CG2-CG2 4.21Å; V340-L342 HydrophobicContact CG1-CD2 4.07Å; V340-V447 PolarHBondContact N-O 2.92Å; V340-L448 HydrophobicContact CB-CD1 3.86Å; V340-L448 HydrophobicContact CG1-CD1 4.09Å; V340-L448 WeakPolarHBondContact O-CA 3.48Å; V340-A449 PolarHBondContact O-N 3.42Å; V340-L480 WeakPolarHBondContact CA-O 3.49Å; V340-L480 HydrophobicContact CG2-CB 4.41Å; V340-F482 HydrophobicContact CG1-CD2 3.84Å; V340-F482 HydrophobicContact CG1-CE2 3.9Å
341	L	91.4	Very high	87.4	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.5	175.1	178.5	61.5	0	0	0	110.7	I343 A449 A451 L475 F478 L480 L481 F482	L341-I343 HydrophobicContact CD2-CD1 3.75Å; L341-I343 HydrophobicContact CD2-CG1 4.26Å; L341-I343 HydrophobicContact CG-CD1 3.98Å; L341-I343 HydrophobicContact CG-CG1 4.09Å; L341-A449 WeakPolarHBondContact CA-O 3.4Å; L341-A449 HydrophobicContact CD1-CB 3.67Å; L341-A451 HydrophobicContact CD1-CB 4.2Å; L341-L475 HydrophobicContact CD2-CD2 4.25Å; L341-F478 HydrophobicContact CB-CB 4.33Å; L341-F478 HydrophobicContact CB-CD1 3.81Å; L341-F478 HydrophobicContact CB-CD2 4.34Å; L341-F478 HydrophobicContact CB-CE1 4.18Å; L341-F478 HydrophobicContact CB-CG 3.9Å; L341-F478 HydrophobicContact CD2-CD2 4.15Å; L341-F478 HydrophobicContact CD2-CE2 4.34Å; L341-F478 HydrophobicContact CD2-CG 4.5Å; L341-L480 PolarHBondContact N-O 3.22Å; L341-L481 HydrophobicContact CD2-CD1 4.24Å; L341-L481 HydrophobicContact CD2-CG 4.36Å; L341-F482 PolarHBondContact O-N 3.23Å
342	L	91.3	Very high	87.7	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	105.4	175.4	-54.2	-177	0	0	0	109.8	I312 V340 K350 L353 L448 A449 A450 A451 F482 M484	I312-L342 HydrophobicContact CG2-CD2 3.67Å; V340-L342 HydrophobicContact CG1-CD2 4.07Å; L342-K350 HydrophobicContact CB-CD 4.31Å; L342-K350 HydrophobicContact CB-CG 4.41Å; L342-L353 HydrophobicContact CD1-CB 4.43Å; L342-L353 HydrophobicContact CD1-CD1 4.03Å; L342-L448 HydrophobicContact CD1-CD1 4.46Å; L342-L448 HydrophobicContact CG-CD1 4.47Å; L342-A449 PolarHBondContact N-O 3.08Å; L342-A450 CarbonylContact O-C 3.41Å; L342-A450 WeakPolarHBondContact O-CA 3.26Å; L342-A451 PolarHBondContact O-N 2.75Å; L342-F482 HydrophobicContact CD2-CB 4.05Å; L342-F482 HydrophobicContact CD2-CD2 3.93Å; L342-F482 HydrophobicContact CD2-CG 4.45Å; L342-M484 HydrophobicContact CB-SD 4.33Å; L342-M484 HydrophobicContact CD2-SD 4.46Å
343	I	89.1	Confident	87.9	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	148	171.4	-68.1	143.3	0	0	0	108.3	L341 A451 Y458 I468 L481 F482 I483 M484	L341-I343 HydrophobicContact CD2-CD1 3.75Å; L341-I343 HydrophobicContact CD2-CG1 4.26Å; L341-I343 HydrophobicContact CG-CD1 3.98Å; L341-I343 HydrophobicContact CG-CG1 4.09Å; I343-A451 HydrophobicContact CG1-CB 4.1Å; I343-Y458 HydrophobicContact CG2-CD2 4.45Å; I343-I468 HydrophobicContact CD1-CD1 3.56Å; I343-I468 HydrophobicContact CD1-CG1 3.77Å; I343-I468 HydrophobicContact CD1-CG2 4.24Å; I343-I468 HydrophobicContact CG1-CG1 4.38Å; I343-I468 HydrophobicContact CG2-CG1 4.28Å; I343-L481 HydrophobicContact CD1-CD1 3.89Å; I343-L481 HydrophobicContact CD1-CD2 3.7Å; I343-L481 HydrophobicContact CD1-CG 3.75Å; I343-F482 PolarHBondContact N-O 3.02Å; I343-I483 WeakPolarHBondContact O-CA 3.32Å; I343-M484 PolarHBondContact O-N 3.15Å
344	G	88.6	Confident	88.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.7	179.9	172.3	0	0	0	0	0	113.5	K350 A451 P453 M484	G344-K350 VanDerWaalsContact C-NZ 3.3Å; G344-K350 WeakPolarHBondContact O-CE 2.95Å; G344-K350 PolarHBondContact O-NZ 3.13Å; G344-A451 PolarHBondContact N-O 2.89Å; G344-P453 WeakPolarHBondContact O-CD 3.44Å; G344-M484 WeakPolarHBondContact CA-O 3.45Å
345	D	88.2	Confident	88.3	Confident	15 Å²	15	29 Å²	29	8%	0.08	16%	0.163	C	C	.	.			trans	-65.8	159.4	175.7	-58	-50.6	0	0	0	111.2	V348 K350 R457 Y458 M484 D486	D345-V348 HydrophobicContact CB-CG2 3.99Å; D345-K350 WeakPolarHBondContact O-CE 3.33Å; D345-K350 PolarHBondContact O-NZ 3.48Å; D345-R457 WeakPolarHBondContact OD1-CA 3.29Å; D345-Y458 PolarHBondContact OD1-N 3.36Å; D345-M484 PolarHBondContact N-O 3.38Å; D345-D486 HydrophobicContact CB-CB 4.28Å; D345-D486 PolarHBondContact OD2-N 3.31Å; D345-D486 VanDerWaalsContact OD2-N 3.11Å
346	P	84.8	Confident	88.2	Confident	71 Å²	71	29 Å²	29	46%	0.461	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	160.1	162.8	27.8	-35.6	0	0	0	109.8	V348 G456	P346-V348 VanDerWaalsContact C-N 3.26Å; P346-V348 PolarHBondContact O-N 3.07Å; P346-G456 WeakPolarHBondContact CD-O 3.03Å
347	S	81	Confident	88.4	Confident	124 Å²	124	29.1 Å²	29.1	87%	0.867	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.8	-14.2	-178.1	-48.2	0	0	0	0	117.3	A349	S347-A349 PolarHBondContact O-N 2.66Å
348	V	83.9	Confident	88.1	Confident	17 Å²	17	29.8 Å²	29.8	10%	0.103	17%	0.166	C	C	.	.	S	Bend	trans	-77.9	44.3	179.8	-157.5	0	0	0	0	113.5	D345 P346 K350 M484 D486	D345-V348 HydrophobicContact CB-CG2 3.99Å; P346-V348 VanDerWaalsContact C-N 3.26Å; P346-V348 PolarHBondContact O-N 3.07Å; V348-K350 PolarHBondContact O-N 3.07Å; V348-M484 HydrophobicContact CB-CB 4.43Å; V348-M484 HydrophobicContact CG1-CB 3.95Å; V348-M484 HydrophobicContact CG1-CE 4.24Å; V348-D486 HydrophobicContact CG2-CB 4.16Å
349	A	83.8	Confident	87.6	Confident	37 Å²	37	36.8 Å²	36.8	31%	0.306	20%	0.199	S	C	.	.	S	Bend	trans	51	7.5	175.8	0	0	0	0	0	118.6	I306 S347 S351 Q352 L353	I306-A349 HydrophobicContact CD1-CB 4.16Å; I306-A349 HydrophobicContact CG1-CB 4.38Å; I306-A349 HydrophobicContact CG2-CB 4.19Å; S347-A349 PolarHBondContact O-N 2.66Å; A349-S351 PolarHBondContact O-N 3.1Å; A349-Q352 WeakPolarHBondContact O-CA 3.49Å; A349-Q352 VanDerWaalsContact O-CB 3.25Å; A349-Q352 WeakPolarHBondContact O-CB 3.19Å; A349-Q352 PolarHBondContact O-N 3.45Å; A349-L353 PolarHBondContact O-N 2.93Å; A349-L353 VanDerWaalsContact O-N 3.12Å
350	K	87.4	Confident	87	Confident	10 Å²	10	37.4 Å²	37.4	4%	0.043	20%	0.202	C	C	.	.	H	α-helix	trans	-51.1	-54.1	-174.3	-77.5	-178.9	-76.6	150	0	114.6	L342 G344 D345 V348 Q352 L353 L354 A450 A451 N452 M484	L342-K350 HydrophobicContact CB-CD 4.31Å; L342-K350 HydrophobicContact CB-CG 4.41Å; G344-K350 VanDerWaalsContact C-NZ 3.3Å; G344-K350 WeakPolarHBondContact O-CE 2.95Å; G344-K350 PolarHBondContact O-NZ 3.13Å; D345-K350 WeakPolarHBondContact O-CE 3.33Å; D345-K350 PolarHBondContact O-NZ 3.48Å; V348-K350 PolarHBondContact O-N 3.07Å; K350-Q352 PolarHBondContact O-N 3.16Å; K350-Q352 VanDerWaalsContact O-N 3.17Å; K350-L353 WeakPolarHBondContact O-CB 3.36Å; K350-L353 PolarHBondContact O-N 2.93Å; K350-L353 VanDerWaalsContact O-N 3.09Å; K350-L354 PolarHBondContact O-N 3.5Å; K350-L354 VanDerWaalsContact O-N 3.16Å; K350-A450 HydrophobicContact CB-CB 4.45Å; K350-A451 PolarHBondContact NZ-O 3.29Å; K350-N452 PolarHBondContact NZ-OD1 3.31Å; K350-M484 HydrophobicContact CD-SD 4.16Å; K350-M484 HydrophobicContact CG-CE 4.44Å; K350-M484 HydrophobicContact CG-SD 3.57Å; K350-M484 VanDerWaalsContact CG-SD 3.57Å
351	S	86.8	Confident	86.4	Confident	41 Å²	41	37.9 Å²	37.9	29%	0.287	21%	0.207	S	C	.	.	H	α-helix	trans	-63.8	-21.6	177.8	-51.2	0	0	0	0	113	A349 R355 D408	A349-S351 PolarHBondContact O-N 3.1Å; S351-R355 WeakPolarHBondContact O-CG 3.05Å; S351-R355 PolarHBondContact O-N 3.49Å; S351-R355 VanDerWaalsContact O-N 3.11Å; S351-D408 VanDerWaalsContact CB-OD2 3.24Å; S351-D408 WeakPolarHBondContact CB-OD2 3.49Å; S351-D408 PolarHBondContact OG-OD2 2.9Å
352	Q	87.5	Confident	85.4	Confident	85 Å²	85	39.1 Å²	39.1	40%	0.397	22%	0.215	S	C	.	.	H	α-helix	trans	-77.3	-34.5	174.7	-163	64.5	6	0	0	112	I306 A349 K350 R355 Y356	I306-Q352 HydrophobicContact CD1-CB 4.09Å; I306-Q352 HydrophobicContact CD1-CG 4.13Å; A349-Q352 WeakPolarHBondContact O-CA 3.49Å; A349-Q352 VanDerWaalsContact O-CB 3.25Å; A349-Q352 WeakPolarHBondContact O-CB 3.19Å; A349-Q352 PolarHBondContact O-N 3.45Å; K350-Q352 PolarHBondContact O-N 3.16Å; K350-Q352 VanDerWaalsContact O-N 3.17Å; Q352-R355 PolarHBondContact O-N 2.88Å; Q352-Y356 WeakPolarHBondContact O-CB 3.26Å; Q352-Y356 PolarHBondContact O-N 3.08Å
353	L	89.4	Confident	84.7	Confident	4 Å²	4	44 Å²	44	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-44.7	168.2	-71.1	168	0	0	0	111.1	A303 I306 I312 I316 L342 A349 K350 R355 Y356 V357 M484	A303-L353 HydrophobicContact CB-CD2 4.3Å; I306-L353 HydrophobicContact CD1-CD2 3.63Å; I306-L353 HydrophobicContact CD1-CG 3.74Å; I312-L353 HydrophobicContact CG2-CD1 4.22Å; I316-L353 HydrophobicContact CD1-CB 4.47Å; I316-L353 HydrophobicContact CD1-CD2 4.26Å; L342-L353 HydrophobicContact CD1-CB 4.43Å; L342-L353 HydrophobicContact CD1-CD1 4.03Å; A349-L353 PolarHBondContact O-N 2.93Å; A349-L353 VanDerWaalsContact O-N 3.12Å; K350-L353 WeakPolarHBondContact O-CB 3.36Å; K350-L353 PolarHBondContact O-N 2.93Å; K350-L353 VanDerWaalsContact O-N 3.09Å; L353-R355 PolarHBondContact O-N 3.49Å; L353-Y356 PolarHBondContact O-N 3.11Å; L353-V357 PolarHBondContact O-N 3.25Å; L353-M484 HydrophobicContact CD1-CE 3.93Å; L353-M484 HydrophobicContact CD1-SD 4.44Å
354	L	90.1	Very high	84.4	Confident	9 Å²	9	45 Å²	45	5%	0.047	24%	0.242	C	C	.	.	H	α-helix	trans	-58.4	-47.7	176.4	-65.8	-173.5	0	0	0	112.3	K350 Y356 V357 L358 C406 D408 L448 A450	K350-L354 PolarHBondContact O-N 3.5Å; K350-L354 VanDerWaalsContact O-N 3.16Å; L354-Y356 VanDerWaalsContact C-N 3.3Å; L354-Y356 PolarHBondContact O-N 3.3Å; L354-V357 PolarHBondContact O-N 3.28Å; L354-L358 PolarHBondContact O-N 3.28Å; L354-C406 HydrophobicContact CD2-CB 4.39Å; L354-D408 HydrophobicContact CD1-CB 3.58Å; L354-L448 HydrophobicContact CD2-CB 4.44Å; L354-L448 HydrophobicContact CD2-CD2 3.47Å; L354-L448 VanDerWaalsContact CD2-CD2 3.47Å; L354-L448 HydrophobicContact CD2-CG 3.54Å; L354-A450 HydrophobicContact CD1-CB 3.73Å; L354-A450 HydrophobicContact CD2-CB 4.45Å; L354-A450 HydrophobicContact CG-CB 4.24Å
355	R	88.3	Confident	84.3	Confident	136 Å²	136	47 Å²	47	51%	0.513	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-38.8	175.9	-72.5	178.2	-163.9	119.3	6.2	112.1	S351 Q352 L353 L358 H359	S351-R355 WeakPolarHBondContact O-CG 3.05Å; S351-R355 PolarHBondContact O-N 3.49Å; S351-R355 VanDerWaalsContact O-N 3.11Å; Q352-R355 PolarHBondContact O-N 2.88Å; L353-R355 PolarHBondContact O-N 3.49Å; R355-L358 WeakPolarHBondContact O-CB 2.75Å; R355-L358 PolarHBondContact O-N 3.2Å; R355-H359 PolarHBondContact O-CD2 3.23Å; R355-H359 PolarHBondContact O-N 3.04Å; R355-H359 VanDerWaalsContact O-N 3.13Å
356	Y	87.2	Confident	84.4	Confident	28 Å²	28	50.5 Å²	50.5	11%	0.11	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-43.6	179.5	-162	-85.1	0	0	0	112	L302 Q352 L353 L354 L358 H359 T360 K564	L302-Y356 HydrophobicContact CD1-CD1 4.41Å; L302-Y356 HydrophobicContact CD1-CE1 4.12Å; L302-Y356 HydrophobicContact CG-CD1 4.28Å; L302-Y356 HydrophobicContact CG-CE1 4.22Å; L302-Y356 WeakPolarHBondContact O-CE1 3.34Å; L302-Y356 PolarHBondContact O-OH 3.22Å; Q352-Y356 WeakPolarHBondContact O-CB 3.26Å; Q352-Y356 PolarHBondContact O-N 3.08Å; L353-Y356 PolarHBondContact O-N 3.11Å; L354-Y356 VanDerWaalsContact C-N 3.3Å; L354-Y356 PolarHBondContact O-N 3.3Å; Y356-L358 VanDerWaalsContact C-N 3.28Å; Y356-L358 PolarHBondContact O-N 2.67Å; Y356-H359 PolarHBondContact O-N 2.72Å; Y356-T360 WeakPolarHBondContact CD1-OG1 3.34Å; Y356-T360 HydrophobicContact CE1-CG2 4.47Å; Y356-T360 WeakPolarHBondContact CE1-OG1 3.46Å; Y356-T360 WeakPolarHBondContact O-CB 3.18Å; Y356-T360 PolarHBondContact O-N 3.13Å; Y356-T360 VanDerWaalsContact O-N 3.08Å; Y356-T360 PolarHBondContact O-OG1 3.39Å; Y356-K564 WeakPolarHBondContact OH-CE 3.47Å
357	V	88.6	Confident	84.5	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.012	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-40.6	173.9	170.6	0	0	0	0	111	I316 M319 L320 L353 L354 H359 T360 A361 V404 L448	I316-V357 HydrophobicContact CG2-CG2 3.39Å; M319-V357 HydrophobicContact CE-CG1 4.19Å; L320-V357 HydrophobicContact CD2-CG1 4.28Å; L353-V357 PolarHBondContact O-N 3.25Å; L354-V357 PolarHBondContact O-N 3.28Å; V357-H359 PolarHBondContact O-N 3.18Å; V357-T360 PolarHBondContact O-N 3.13Å; V357-A361 WeakPolarHBondContact O-CB 3.27Å; V357-A361 PolarHBondContact O-N 2.88Å; V357-V404 HydrophobicContact CG1-CG1 3.99Å; V357-L448 HydrophobicContact CB-CD2 3.99Å; V357-L448 HydrophobicContact CG1-CD2 4.03Å; V357-L448 HydrophobicContact CG2-CD2 3.79Å
358	L	84.9	Confident	84.9	Confident	41 Å²	41	44.9 Å²	44.9	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-39.3	177.8	179.8	139.3	0	0	0	114	L354 R355 Y356 A364 P366	L354-L358 PolarHBondContact O-N 3.28Å; R355-L358 WeakPolarHBondContact O-CB 2.75Å; R355-L358 PolarHBondContact O-N 3.2Å; Y356-L358 VanDerWaalsContact C-N 3.28Å; Y356-L358 PolarHBondContact O-N 2.67Å; L358-A364 HydrophobicContact CB-CB 4.39Å; L358-A364 HydrophobicContact CG-CB 4.37Å; L358-P366 HydrophobicContact CD1-CB 3.44Å; L358-P366 VanDerWaalsContact CD1-CB 3.44Å; L358-P366 VanDerWaalsContact CD1-CD 3.48Å; L358-P366 HydrophobicContact CD1-CG 3.52Å
359	H	81.3	Confident	84.8	Confident	147 Å²	147	44.2 Å²	44.2	68%	0.681	23%	0.231	S	C	*	.	H	α-helix	trans	-83.4	-15.5	177	-66.3	-64.7	0	0	0	114	R355 Y356 V357	R355-H359 PolarHBondContact O-CD2 3.23Å; R355-H359 PolarHBondContact O-N 3.04Å; R355-H359 VanDerWaalsContact O-N 3.13Å; Y356-H359 PolarHBondContact O-N 2.72Å; V357-H359 PolarHBondContact O-N 3.18Å
360	T	81.7	Confident	84.7	Confident	17 Å²	17	52.5 Å²	52.5	10%	0.104	26%	0.255	C	S	.	.	H	α-helix	trans	-96.4	-39.1	-176.5	-55.2	0	0	0	0	112.7	L302 Y356 V357	L302-T360 HydrophobicContact CD1-CG2 4.1Å; Y356-T360 WeakPolarHBondContact CD1-OG1 3.34Å; Y356-T360 HydrophobicContact CE1-CG2 4.47Å; Y356-T360 WeakPolarHBondContact CE1-OG1 3.46Å; Y356-T360 WeakPolarHBondContact O-CB 3.18Å; Y356-T360 PolarHBondContact O-N 3.13Å; Y356-T360 VanDerWaalsContact O-N 3.08Å; Y356-T360 PolarHBondContact O-OG1 3.39Å; V357-T360 PolarHBondContact O-N 3.13Å
361	A	78.2	Confident	84.1	Confident	11 Å²	11	55 Å²	55	9%	0.091	28%	0.282	C	S	.	.	S	Bend	trans	-86.3	129.7	-172.5	0	0	0	0	0	111.2	L320 V357 R363 A364 V404	L320-A361 HydrophobicContact CD2-CB 3.47Å; L320-A361 VanDerWaalsContact CD2-CB 3.47Å; V357-A361 WeakPolarHBondContact O-CB 3.27Å; V357-A361 PolarHBondContact O-N 2.88Å; A361-R363 PolarHBondContact O-N 3.48Å; A361-A364 HydrophobicContact CB-CB 4.23Å; A361-A364 PolarHBondContact O-N 2.88Å; A361-V404 HydrophobicContact CB-CG2 4.27Å
362	P	70.4	Confident	83.4	Confident	26 Å²	26	53.7 Å²	53.7	17%	0.169	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	138.1	167.9	27.9	-33.6	0	0	0	109.4	E270	E270-P362 HydrophobicContact CB-CB 3.98Å; E270-P362 VanDerWaalsContact CD-CB 3.4Å; E270-P362 HydrophobicContact CG-CB 4.3Å; E270-P362 WeakPolarHBondContact OE1-CA 3.48Å; E270-P362 WeakPolarHBondContact OE1-CB 3.32Å; E270-P362 WeakPolarHBondContact OE2-CA 3.35Å; E270-P362 WeakPolarHBondContact OE2-CB 3.42Å
363	R	76.6	Confident	82.6	Confident	102 Å²	102	52.6 Å²	52.6	39%	0.385	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	48.3	-175.1	-50.7	176.7	68.1	84.8	7.7	114.8	E270 A361 L399 D401 G403 V404	E270-R363 PolarHBondContact OE2-N 3.39Å; A361-R363 PolarHBondContact O-N 3.48Å; R363-L399 PolarHBondContact NH2-O 3.04Å; R363-D401 PolarHBondContact NE-O 2.71Å; R363-G403 WeakPolarHBondContact O-CA 3.32Å; R363-V404 PolarHBondContact O-N 3.1Å
364	A	84.3	Confident	81.6	Confident	23 Å²	23	53 Å²	53	19%	0.19	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	135.5	167.3	0	0	0	0	0	112.6	L358 A361 V404	L358-A364 HydrophobicContact CB-CB 4.39Å; L358-A364 HydrophobicContact CG-CB 4.37Å; A361-A364 HydrophobicContact CB-CB 4.23Å; A361-A364 PolarHBondContact O-N 2.88Å; A364-V404 WeakPolarHBondContact CA-O 3.28Å
365	I	86.8	Confident	80.7	Confident	41 Å²	41	56.5 Å²	56.5	21%	0.21	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.5	176.5	-61.7	-173.7	0	0	0	110.4	T367 A396 L399 A400 V404 C406	I365-T367 HydrophobicContact CG2-CG2 4.44Å; I365-A396 HydrophobicContact CG2-CB 3.94Å; I365-L399 HydrophobicContact CD1-CB 3.47Å; I365-L399 VanDerWaalsContact CD1-CB 3.47Å; I365-A400 HydrophobicContact CB-CB 4.45Å; I365-A400 HydrophobicContact CD1-CB 4.01Å; I365-A400 HydrophobicContact CG1-CB 4.21Å; I365-V404 PolarHBondContact N-O 3.16Å; I365-V404 VanDerWaalsContact N-O 3.1Å; I365-C406 PolarHBondContact O-N 3.09Å
366	P	89.6	Confident	80	Confident	89 Å²	89	51.8 Å²	51.8	58%	0.578	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	137.9	173.9	30.8	-27.5	0	0	0	110.6	L358	L358-P366 HydrophobicContact CD1-CB 3.44Å; L358-P366 VanDerWaalsContact CD1-CB 3.44Å; L358-P366 VanDerWaalsContact CD1-CD 3.48Å; L358-P366 HydrophobicContact CD1-CG 3.52Å
367	T	87.5	Confident	79.7	Confident	11 Å²	11	50.5 Å²	50.5	7%	0.067	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.3	174.4	50.7	0	0	0	0	108.8	I365 S372 L377 A396 V405 C406 I407 D408	I365-T367 HydrophobicContact CG2-CG2 4.44Å; T367-S372 WeakPolarHBondContact CB-OG 3.25Å; T367-L377 HydrophobicContact CG2-CD2 4.15Å; T367-A396 HydrophobicContact CG2-CB 3.62Å; T367-V405 HydrophobicContact CG2-CG1 4.34Å; T367-C406 PolarHBondContact N-O 3.12Å; T367-C406 PolarHBondContact OG1-O 3.36Å; T367-I407 WeakPolarHBondContact O-CA 3.44Å; T367-I407 WeakPolarHBondContact OG1-CG1 3.36Å; T367-D408 PolarHBondContact O-N 3.36Å
368	T	89.1	Confident	79.4	Confident	66 Å²	66	50.9 Å²	50.9	41%	0.405	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.8	174.2	62.2	0	0	0	0	109.1	R370 G371 S372 D408	T368-R370 PolarHBondContact O-N 3.49Å; T368-R370 VanDerWaalsContact O-N 3.12Å; T368-G371 PolarHBondContact O-N 2.94Å; T368-G371 VanDerWaalsContact O-N 3.13Å; T368-G371 WeakPolarHBondContact OG1-CA 3.38Å; T368-G371 PolarHBondContact OG1-N 2.91Å; T368-G371 VanDerWaalsContact OG1-N 3.13Å; T368-S372 PolarHBondContact N-OG 3.43Å; T368-S372 VanDerWaalsContact N-OG 3.08Å; T368-S372 VanDerWaalsContact O-CB 3.24Å; T368-S372 WeakPolarHBondContact O-CB 3.47Å; T368-S372 PolarHBondContact O-N 3.25Å; T368-S372 PolarHBondContact O-OG 3.2Å; T368-D408 CarbonylContact C-O 3.57Å; T368-D408 WeakPolarHBondContact CA-O 3.03Å
369	G	81.3	Confident	79.2	Confident	2 Å²	2	49 Å²	49	2%	0.021	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.6	-176	0	0	0	0	0	113.3	D408 M413	G369-D408 PolarHBondContact N-O 3.17Å; G369-M413 WeakPolarHBondContact O-CA 3.42Å
370	R	82.6	Confident	79.2	Confident	212 Å²	212	42.7 Å²	42.7	80%	0.8	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-33.6	176.2	-170.6	177.2	-177.8	-178	1.9	114.6	T368 K412	T368-R370 PolarHBondContact O-N 3.49Å; T368-R370 VanDerWaalsContact O-N 3.12Å; R370-K412 HydrophobicContact CB-CB 4.43Å
371	G	73.1	Confident	79.3	Confident	61 Å²	61	43.8 Å²	43.8	63%	0.629	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-20.6	-178.5	0	0	0	0	0	113.8	T368 S373	T368-G371 PolarHBondContact O-N 2.94Å; T368-G371 VanDerWaalsContact O-N 3.13Å; T368-G371 WeakPolarHBondContact OG1-CA 3.38Å; T368-G371 PolarHBondContact OG1-N 2.91Å; T368-G371 VanDerWaalsContact OG1-N 3.13Å; G371-S373 PolarHBondContact O-N 3.29Å
372	S	71.9	Confident	79.6	Confident	14 Å²	14	45 Å²	45	10%	0.098	27%	0.269	C	S	.	.			trans	-98.8	78.2	-172.9	-39.9	0	0	0	0	110.9	T367 T368 L377	T367-S372 WeakPolarHBondContact CB-OG 3.25Å; T368-S372 PolarHBondContact N-OG 3.43Å; T368-S372 VanDerWaalsContact N-OG 3.08Å; T368-S372 VanDerWaalsContact O-CB 3.24Å; T368-S372 WeakPolarHBondContact O-CB 3.47Å; T368-S372 PolarHBondContact O-N 3.25Å; T368-S372 PolarHBondContact O-OG 3.2Å; S372-L377 WeakPolarHBondContact O-CD1 3.11Å
373	S	70.8	Confident	80.2	Confident	63 Å²	63	48 Å²	48	44%	0.441	29%	0.288	S	S	.	.			trans	-58.4	155.9	166.8	68.4	0	0	0	0	111	G371 V375 G376 L377	G371-S373 PolarHBondContact O-N 3.29Å; S373-V375 PolarHBondContact O-N 2.96Å; S373-G376 CarbonylContact O-C 3.54Å; S373-G376 WeakPolarHBondContact O-CA 3.37Å; S373-G376 PolarHBondContact O-N 3.26Å; S373-L377 PolarHBondContact O-N 3.42Å
374	G	68.9	Low	80.2	Confident	12 Å²	12	45 Å²	45	12%	0.124	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-24.1	-178.3	0	0	0	0	0	113.7	T378 D417	G374-T378 PolarHBondContact O-N 2.82Å; G374-T378 PolarHBondContact O-OG1 3.19Å; G374-D417 WeakPolarHBondContact CA-OD1 3.49Å; G374-D417 VanDerWaalsContact N-CG 3.31Å; G374-D417 PolarHBondContact N-OD1 3.15Å
375	V	70.8	Confident	79.8	Confident	83 Å²	83	52.9 Å²	52.9	50%	0.503	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-43.3	170.2	-178.1	0	0	0	0	111.3	S373 A380	S373-V375 PolarHBondContact O-N 2.96Å; V375-A380 HydrophobicContact CG1-CB 3.44Å; V375-A380 VanDerWaalsContact CG1-CB 3.44Å
376	G	75.3	Confident	79.1	Confident	37 Å²	37	57 Å²	57	38%	0.381	33%	0.331	S	S	.	.	H	α-helix	trans	-81.3	-22.3	176.6	0	0	0	0	0	114.5	S373 G395 A396	S373-G376 CarbonylContact O-C 3.54Å; S373-G376 WeakPolarHBondContact O-CA 3.37Å; S373-G376 PolarHBondContact O-N 3.26Å; G376-G395 CarbonylContact O-C 3.48Å; G376-G395 WeakPolarHBondContact O-CA 3.38Å; G376-A396 PolarHBondContact O-N 2.91Å
377	L	80.2	Confident	78.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-80.5	-47.2	174.4	-72.6	171.2	0	0	0	112.7	T367 S372 S373 G395 A396 M397 M413 D417 I421	T367-L377 HydrophobicContact CG2-CD2 4.15Å; S372-L377 WeakPolarHBondContact O-CD1 3.11Å; S373-L377 PolarHBondContact O-N 3.42Å; L377-G395 CarbonylContact O-C 3.57Å; L377-A396 PolarHBondContact O-N 3.43Å; L377-M397 HydrophobicContact CB-CG 4.5Å; L377-M397 HydrophobicContact CB-SD 4.42Å; L377-M397 HydrophobicContact CD2-CG 4.36Å; L377-M397 WeakPolarHBondContact O-CB 3.12Å; L377-M397 WeakPolarHBondContact O-CG 3.42Å; L377-M397 PolarHBondContact O-N 3.26Å; L377-M413 HydrophobicContact CD1-CE 4.25Å; L377-M413 HydrophobicContact CD1-SD 4.41Å; L377-D417 HydrophobicContact CD1-CB 4.21Å; L377-I421 HydrophobicContact CD1-CD1 4.23Å; L377-I421 HydrophobicContact CD1-CG1 4.46Å
378	T	82.6	Confident	77.8	Confident	11 Å²	11	57 Å²	57	7%	0.067	34%	0.34	C	S	.	.	S	Bend	trans	-94.2	-91.3	-171.6	59.3	0	0	0	0	113.2	G374 G395 V398 A420 V430	G374-T378 PolarHBondContact O-N 2.82Å; G374-T378 PolarHBondContact O-OG1 3.19Å; T378-G395 WeakPolarHBondContact O-CA 3.29Å; T378-G395 PolarHBondContact O-N 3.47Å; T378-V398 VanDerWaalsContact O-CG2 3.28Å; T378-V398 WeakPolarHBondContact O-CG2 3.29Å; T378-A420 HydrophobicContact CG2-CB 3.68Å; T378-V430 HydrophobicContact CG2-CG1 4.14Å; T378-V430 HydrophobicContact CG2-CG2 4.39Å
379	A	79.8	Confident	77.4	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.008	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	154	164	0	0	0	0	0	110.8	L392 E393 I432 L441	A379-L392 HydrophobicContact CB-CD1 4.19Å; A379-L392 HydrophobicContact CB-CG 4.22Å; A379-E393 CarbonylContact C-O 3.54Å; A379-E393 WeakPolarHBondContact CA-O 3.37Å; A379-E393 WeakPolarHBondContact CB-O 3.44Å; A379-I432 HydrophobicContact CB-CD1 3.52Å; A379-L441 HydrophobicContact CB-CD1 3.62Å
380	A	82.3	Confident	77.4	Confident	14 Å²	14	65.3 Å²	65.3	12%	0.116	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.6	-179.2	0	0	0	0	0	110.4	V375 T382 L392 E393	V375-A380 HydrophobicContact CG1-CB 3.44Å; V375-A380 VanDerWaalsContact CG1-CB 3.44Å; A380-T382 HydrophobicContact CB-CG2 4.12Å; A380-L392 CarbonylContact O-C 3.55Å; A380-L392 WeakPolarHBondContact O-CA 3.35Å; A380-E393 HydrophobicContact CB-CB 4.33Å; A380-E393 PolarHBondContact N-O 2.85Å; A380-E393 PolarHBondContact O-N 3.38Å
381	V	84.1	Confident	77.3	Confident	41 Å²	41	58 Å²	58	25%	0.248	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	113.3	161.4	-178.5	0	0	0	0	107.2	R390 R391 L392 K434 A435 I437	V381-R390 HydrophobicContact CG1-CB 4.02Å; V381-R390 HydrophobicContact CG1-CG 4.41Å; V381-R391 CarbonylContact C-O 3.58Å; V381-R391 WeakPolarHBondContact CA-O 3.4Å; V381-L392 HydrophobicContact CG2-CD1 3.78Å; V381-K434 HydrophobicContact CG2-CB 4.19Å; V381-A435 HydrophobicContact CG1-CB 4.17Å; V381-I437 HydrophobicContact CG1-CD1 3.86Å; V381-I437 HydrophobicContact CG2-CD1 4.18Å
382	T	83.6	Confident	77.6	Confident	35 Å²	35	57.8 Å²	57.8	22%	0.215	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	151.7	174.4	67.2	0	0	0	0	110.3	A380 R390 R391 E393	A380-T382 HydrophobicContact CB-CG2 4.12Å; T382-R390 CarbonylContact O-C 3.5Å; T382-R390 WeakPolarHBondContact O-CA 3.37Å; T382-R391 PolarHBondContact N-O 2.98Å; T382-R391 WeakPolarHBondContact O-CG 3.18Å; T382-R391 PolarHBondContact O-N 2.88Å; T382-R391 VanDerWaalsContact O-O 3.13Å; T382-R391 WeakPolarHBondContact OG1-CG 3.36Å; T382-R391 PolarHBondContact OG1-NE 3.11Å; T382-R391 VanDerWaalsContact OG1-NE 3.15Å; T382-E393 WeakPolarHBondContact CB-OE1 3.19Å; T382-E393 HydrophobicContact CG2-CB 4.49Å; T382-E393 HydrophobicContact CG2-CG 4.14Å; T382-E393 VanDerWaalsContact CG2-OE1 3.32Å; T382-E393 WeakPolarHBondContact CG2-OE1 3.2Å; T382-E393 WeakPolarHBondContact CG2-OE2 3.09Å; T382-E393 VanDerWaalsContact OG1-CD 3.23Å; T382-E393 PolarHBondContact OG1-OE1 2.94Å
383	T	83.2	Confident	77.9	Confident	91 Å²	91	60.7 Å²	60.7	56%	0.558	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.3	170.7	47.9	0	0	0	0	108.8	E389 R390	T383-E389 WeakPolarHBondContact CA-O 2.92Å; T383-R390 HydrophobicContact CG2-CG 3.91Å
384	D	77.2	Confident	78.3	Confident	38 Å²	38	59.8 Å²	59.8	20%	0.203	33%	0.332	C	S	.	.			trans	-72.3	142.3	172.1	175.7	47.3	0	0	0	111	T387 G388 E389	D384-T387 WeakPolarHBondContact CB-OG1 3.43Å; D384-T387 WeakPolarHBondContact OD2-CB 3.24Å; D384-T387 WeakPolarHBondContact OD2-CG2 3.34Å; D384-T387 PolarHBondContact OD2-N 3.37Å; D384-T387 PolarHBondContact OD2-OG1 2.74Å; D384-G388 VanDerWaalsContact O-CA 3.28Å; D384-G388 WeakPolarHBondContact O-CA 3.14Å; D384-G388 PolarHBondContact O-N 3.37Å; D384-E389 PolarHBondContact N-O 3.09Å
385	Q	75.3	Confident	79	Confident	189 Å²	189	59.5 Å²	59.5	88%	0.883	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-26.1	-170.3	-65.6	-177	10	0	0	113.4
386	E	71.9	Confident	79.6	Confident	128 Å²	128	56.3 Å²	56.3	60%	0.598	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-29.9	176.5	-66.7	-168.7	163.2	0	0	111.7	R256	R256-E386 IonicContact CZ-OE1 2.73Å; R256-E386 IonicContact NH1-OE1 2.98Å; R256-E386 PolarHBondContact NH1-OE1 3.46Å; R256-E386 IonicContact NH2-OE1 3.1Å; R256-E386 PolarHBondContact NH2-OE1 2.85Å; R256-E386 VanDerWaalsContact NH2-OE1 3.08Å
387	T	72.1	Confident	80.1	Confident	43 Å²	43	54.5 Å²	54.5	26%	0.264	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-24	-172.2	61.9	0	0	0	0	114.8	D384 E389	D384-T387 WeakPolarHBondContact CB-OG1 3.43Å; D384-T387 WeakPolarHBondContact OD2-CB 3.24Å; D384-T387 WeakPolarHBondContact OD2-CG2 3.34Å; D384-T387 PolarHBondContact OD2-N 3.37Å; D384-T387 PolarHBondContact OD2-OG1 2.74Å; T387-E389 PolarHBondContact O-N 2.92Å; T387-E389 PolarHBondContact OG1-N 3.33Å
388	G	77.7	Confident	80.3	Confident	57 Å²	57	55.6 Å²	55.6	59%	0.588	30%	0.3	S	S	*	.			trans	74.5	0.1	-173.5	0	0	0	0	0	114.6	D384	D384-G388 VanDerWaalsContact O-CA 3.28Å; D384-G388 WeakPolarHBondContact O-CA 3.14Å; D384-G388 PolarHBondContact O-N 3.37Å
389	E	80.1	Confident	80.3	Confident	83 Å²	83	57.6 Å²	57.6	39%	0.388	31%	0.309	S	S	.	.			trans	-76.6	147.1	-178.7	-71.4	170.7	-146.4	0	0	111.8	R137 T383 D384 T387	R137-E389 IonicContact CZ-OE1 3.78Å; R137-E389 IonicContact NH2-OE1 2.7Å; R137-E389 PolarHBondContact NH2-OE1 2.98Å; T383-E389 WeakPolarHBondContact CA-O 2.92Å; D384-E389 PolarHBondContact N-O 3.09Å; T387-E389 PolarHBondContact O-N 2.92Å; T387-E389 PolarHBondContact OG1-N 3.33Å
390	R	82.1	Confident	80.6	Confident	159 Å²	159	57.5 Å²	57.5	60%	0.6	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	118	174.4	-68	178.4	-171.7	159.5	9.8	109.4	V381 T382 T383 A435 I437	V381-R390 HydrophobicContact CG1-CB 4.02Å; V381-R390 HydrophobicContact CG1-CG 4.41Å; T382-R390 CarbonylContact O-C 3.5Å; T382-R390 WeakPolarHBondContact O-CA 3.37Å; T383-R390 HydrophobicContact CG2-CG 3.91Å; R390-A435 PolarHBondContact NH1-O 3.06Å; R390-I437 HydrophobicContact CB-CD1 4.15Å
391	R	79.6	Confident	80.7	Confident	58 Å²	58	58.5 Å²	58.5	22%	0.219	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	160.9	175	67.1	-177.7	-167.8	159.2	5.9	111.1	V381 T382 E393	V381-R391 CarbonylContact C-O 3.58Å; V381-R391 WeakPolarHBondContact CA-O 3.4Å; T382-R391 PolarHBondContact N-O 2.98Å; T382-R391 WeakPolarHBondContact O-CG 3.18Å; T382-R391 PolarHBondContact O-N 2.88Å; T382-R391 VanDerWaalsContact O-O 3.13Å; T382-R391 WeakPolarHBondContact OG1-CG 3.36Å; T382-R391 PolarHBondContact OG1-NE 3.11Å; T382-R391 VanDerWaalsContact OG1-NE 3.15Å; R391-E393 IonicContact CZ-OE1 3.35Å; R391-E393 VanDerWaalsContact CZ-OE1 3.3Å; R391-E393 IonicContact NE-OE1 3.95Å; R391-E393 PolarHBondContact NE-OE1 3.19Å; R391-E393 IonicContact NH2-OE1 2.91Å; R391-E393 PolarHBondContact NH2-OE1 3.24Å
392	L	79.8	Confident	80.7	Confident	56 Å²	56	64.2 Å²	64.2	29%	0.293	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	112.9	177.8	-166.6	70	0	0	0	109	A379 A380 V381 I432 A439 L441	A379-L392 HydrophobicContact CB-CD1 4.19Å; A379-L392 HydrophobicContact CB-CG 4.22Å; A380-L392 CarbonylContact O-C 3.55Å; A380-L392 WeakPolarHBondContact O-CA 3.35Å; V381-L392 HydrophobicContact CG2-CD1 3.78Å; L392-I432 HydrophobicContact CD1-CD1 4.37Å; L392-A439 HydrophobicContact CD2-CB 3.86Å; L392-L441 HydrophobicContact CD2-CD1 3.88Å; L392-L441 HydrophobicContact CD2-CD2 4.02Å; L392-L441 HydrophobicContact CD2-CG 4.21Å
393	E	78.4	Confident	80.9	Confident	76 Å²	76	62.7 Å²	62.7	36%	0.355	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	118.7	173.1	-76.5	173.5	-157.6	0	0	109.5	A379 A380 T382 R391	A379-E393 CarbonylContact C-O 3.54Å; A379-E393 WeakPolarHBondContact CA-O 3.37Å; A379-E393 WeakPolarHBondContact CB-O 3.44Å; A380-E393 HydrophobicContact CB-CB 4.33Å; A380-E393 PolarHBondContact N-O 2.85Å; A380-E393 PolarHBondContact O-N 3.38Å; T382-E393 WeakPolarHBondContact CB-OE1 3.19Å; T382-E393 HydrophobicContact CG2-CB 4.49Å; T382-E393 HydrophobicContact CG2-CG 4.14Å; T382-E393 VanDerWaalsContact CG2-OE1 3.32Å; T382-E393 WeakPolarHBondContact CG2-OE1 3.2Å; T382-E393 WeakPolarHBondContact CG2-OE2 3.09Å; T382-E393 VanDerWaalsContact OG1-CD 3.23Å; T382-E393 PolarHBondContact OG1-OE1 2.94Å; R391-E393 IonicContact CZ-OE1 3.35Å; R391-E393 VanDerWaalsContact CZ-OE1 3.3Å; R391-E393 IonicContact NE-OE1 3.95Å; R391-E393 PolarHBondContact NE-OE1 3.19Å; R391-E393 IonicContact NH2-OE1 2.91Å; R391-E393 PolarHBondContact NH2-OE1 3.24Å
394	A	78.8	Confident	81.2	Confident	44 Å²	44	58.5 Å²	58.5	36%	0.364	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	130.1	176.5	0	0	0	0	0	111.2	V398 L399	A394-V398 HydrophobicContact CB-CB 4.05Å; A394-V398 HydrophobicContact CB-CG1 3.83Å; A394-L399 HydrophobicContact CB-CD2 3.97Å; A394-L399 HydrophobicContact CB-CG 4.2Å
395	G	83.9	Confident	81.9	Confident	5 Å²	5	56.7 Å²	56.7	5%	0.052	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-80.4	172.9	171	0	0	0	0	0	112.5	G376 L377 T378 M397 V398 L399	G376-G395 CarbonylContact O-C 3.48Å; G376-G395 WeakPolarHBondContact O-CA 3.38Å; L377-G395 CarbonylContact O-C 3.57Å; T378-G395 WeakPolarHBondContact O-CA 3.29Å; T378-G395 PolarHBondContact O-N 3.47Å; G395-M397 VanDerWaalsContact C-N 3.28Å; G395-M397 PolarHBondContact O-N 3.48Å; G395-M397 VanDerWaalsContact O-N 3.15Å; G395-V398 PolarHBondContact O-N 3.03Å; G395-L399 WeakPolarHBondContact O-CG 3.36Å; G395-L399 PolarHBondContact O-N 3.42Å
396	A	83.3	Confident	82.7	Confident	16 Å²	16	47.9 Å²	47.9	13%	0.132	25%	0.245	C	C	.	.	H	α-helix	trans	-50.9	-40.3	-174.6	0	0	0	0	0	113.9	I365 T367 G376 L377 L399 A400	I365-A396 HydrophobicContact CG2-CB 3.94Å; T367-A396 HydrophobicContact CG2-CB 3.62Å; G376-A396 PolarHBondContact O-N 2.91Å; L377-A396 PolarHBondContact O-N 3.43Å; A396-L399 PolarHBondContact O-N 3.38Å; A396-A400 WeakPolarHBondContact O-CB 3.49Å; A396-A400 PolarHBondContact O-N 3.33Å
397	M	85.4	Confident	83.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-71.6	-31	-178.8	-58.3	-174.4	80	0	0	112.9	L377 G395 V405 I421 V424 V447	L377-M397 HydrophobicContact CB-CG 4.5Å; L377-M397 HydrophobicContact CB-SD 4.42Å; L377-M397 HydrophobicContact CD2-CG 4.36Å; L377-M397 WeakPolarHBondContact O-CB 3.12Å; L377-M397 WeakPolarHBondContact O-CG 3.42Å; L377-M397 PolarHBondContact O-N 3.26Å; G395-M397 VanDerWaalsContact C-N 3.28Å; G395-M397 PolarHBondContact O-N 3.48Å; G395-M397 VanDerWaalsContact O-N 3.15Å; M397-V405 HydrophobicContact CG-CG2 4.39Å; M397-I421 HydrophobicContact SD-CG1 4.19Å; M397-V424 HydrophobicContact CE-CB 3.96Å; M397-V424 HydrophobicContact CE-CG1 3.59Å; M397-V424 HydrophobicContact SD-CB 4.45Å; M397-V424 HydrophobicContact SD-CG1 4.37Å; M397-V424 HydrophobicContact SD-CG2 4.41Å; M397-V447 HydrophobicContact CE-CG2 4.16Å
398	V	85.9	Confident	84.6	Confident	23 Å²	23	41.5 Å²	41.5	14%	0.139	21%	0.213	C	C	.	.	H	α-helix	trans	-77.1	-38.2	177.2	177.7	0	0	0	0	110.5	T378 A394 G395 A400 D401 V430 L441 A443	T378-V398 VanDerWaalsContact O-CG2 3.28Å; T378-V398 WeakPolarHBondContact O-CG2 3.29Å; A394-V398 HydrophobicContact CB-CB 4.05Å; A394-V398 HydrophobicContact CB-CG1 3.83Å; G395-V398 PolarHBondContact O-N 3.03Å; V398-A400 PolarHBondContact O-N 3.19Å; V398-D401 PolarHBondContact O-N 3.48Å; V398-V430 HydrophobicContact CG2-CG2 4.13Å; V398-L441 HydrophobicContact CG1-CB 4.32Å; V398-L441 HydrophobicContact CG1-CD1 4.22Å; V398-L441 HydrophobicContact CG2-CB 4.12Å; V398-L441 HydrophobicContact CG2-CD1 3.94Å; V398-A443 HydrophobicContact CG2-CB 4.23Å
399	L	82.6	Confident	85.2	Confident	52 Å²	52	42.6 Å²	42.6	27%	0.272	20%	0.203	S	C	.	.	H	α-helix	trans	-62	-35	172.7	-64.4	174.4	0	0	0	111.5	P230 R363 I365 A394 G395 A396 D401	P230-L399 VanDerWaalsContact O-CD2 3.22Å; P230-L399 WeakPolarHBondContact O-CD2 3.42Å; R363-L399 PolarHBondContact NH2-O 3.04Å; I365-L399 HydrophobicContact CD1-CB 3.47Å; I365-L399 VanDerWaalsContact CD1-CB 3.47Å; A394-L399 HydrophobicContact CB-CD2 3.97Å; A394-L399 HydrophobicContact CB-CG 4.2Å; G395-L399 WeakPolarHBondContact O-CG 3.36Å; G395-L399 PolarHBondContact O-N 3.42Å; A396-L399 PolarHBondContact O-N 3.38Å; L399-D401 VanDerWaalsContact C-N 3.3Å; L399-D401 PolarHBondContact O-N 3.32Å
400	A	84.7	Confident	85.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	21.1	177.5	0	0	0	0	0	115.3	I365 A396 V398 R402 G403 V405 C445	I365-A400 HydrophobicContact CB-CB 4.45Å; I365-A400 HydrophobicContact CD1-CB 4.01Å; I365-A400 HydrophobicContact CG1-CB 4.21Å; A396-A400 WeakPolarHBondContact O-CB 3.49Å; A396-A400 PolarHBondContact O-N 3.33Å; V398-A400 PolarHBondContact O-N 3.19Å; A400-R402 PolarHBondContact O-N 3.06Å; A400-G403 WeakPolarHBondContact O-CA 3.46Å; A400-G403 PolarHBondContact O-N 3.41Å; A400-V405 HydrophobicContact CB-CG2 3.47Å; A400-V405 VanDerWaalsContact CB-CG2 3.47Å; A400-C445 HydrophobicContact CB-CB 4.35Å; A400-C445 WeakPolarHBondContact O-CB 3.49Å
401	D	85.4	Confident	85.8	Confident	34 Å²	34	32.2 Å²	32.2	18%	0.182	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	129.7	175.1	-171.3	60.1	0	0	0	111.1	R363 V398 L399 G403 R444	R363-D401 PolarHBondContact NE-O 2.71Å; V398-D401 PolarHBondContact O-N 3.48Å; L399-D401 VanDerWaalsContact C-N 3.3Å; L399-D401 PolarHBondContact O-N 3.32Å; D401-G403 PolarHBondContact O-N 3.29Å; D401-R444 WeakPolarHBondContact OD1-CB 3.4Å; D401-R444 WeakPolarHBondContact OD1-CG 3.25Å; D401-R444 IonicContact OD1-CZ 3.61Å; D401-R444 PolarHBondContact OD1-N 2.8Å; D401-R444 IonicContact OD1-NE 3.87Å; D401-R444 PolarHBondContact OD1-NE 3Å; D401-R444 IonicContact OD1-NH2 2.72Å; D401-R444 IonicContact OD2-CZ 3.91Å; D401-R444 IonicContact OD2-NE 2.67Å; D401-R444 PolarHBondContact OD2-NE 2.86Å; D401-R444 IonicContact OD2-NH2 3.57Å; D401-R444 PolarHBondContact OD2-NH2 3.09Å
402	R	84.4	Confident	86.2	Confident	161 Å²	161	35.1 Å²	35.1	61%	0.608	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	11.6	-170.1	-64.1	-179.4	160.3	-176.6	-5.6	116.2	A400 R444	A400-R402 PolarHBondContact O-N 3.06Å; R402-R444 VanDerWaalsContact CA-O 3.28Å; R402-R444 WeakPolarHBondContact CA-O 3.3Å; R402-R444 PolarHBondContact N-O 3.25Å
403	G	87.4	Confident	86.5	Confident	4 Å²	4	32.8 Å²	32.8	4%	0.041	16%	0.164	C	C	.	.	S	Bend	trans	-104.6	-158.5	175	0	0	0	0	0	113.2	R363 A400 D401 S446	R363-G403 WeakPolarHBondContact O-CA 3.32Å; A400-G403 WeakPolarHBondContact O-CA 3.46Å; A400-G403 PolarHBondContact O-N 3.41Å; D401-G403 PolarHBondContact O-N 3.29Å; G403-S446 PolarHBondContact O-N 3.38Å
404	V	89.9	Confident	86.9	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.012	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.7	177.8	-177.9	0	0	0	0	109.4	M319 L320 V357 A361 R363 A364 I365 S446 L448	M319-V404 HydrophobicContact CE-CG1 3.93Å; M319-V404 HydrophobicContact SD-CG1 4.46Å; L320-V404 HydrophobicContact CD2-CG2 4.35Å; V357-V404 HydrophobicContact CG1-CG1 3.99Å; A361-V404 HydrophobicContact CB-CG2 4.27Å; R363-V404 PolarHBondContact O-N 3.1Å; A364-V404 WeakPolarHBondContact CA-O 3.28Å; I365-V404 PolarHBondContact N-O 3.16Å; I365-V404 VanDerWaalsContact N-O 3.1Å; V404-S446 WeakPolarHBondContact CA-O 3.29Å; V404-L448 HydrophobicContact CG1-CB 4.26Å
405	V	91.6	Very high	87.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117.5	170.6	179.5	0	0	0	0	108.2	T367 M397 A400 I407 C445 S446 L448	T367-V405 HydrophobicContact CG2-CG1 4.34Å; M397-V405 HydrophobicContact CG-CG2 4.39Å; A400-V405 HydrophobicContact CB-CG2 3.47Å; A400-V405 VanDerWaalsContact CB-CG2 3.47Å; V405-I407 HydrophobicContact CG1-CG1 3.98Å; V405-C445 HydrophobicContact CG2-CB 3.88Å; V405-S446 PolarHBondContact N-O 3.11Å; V405-L448 PolarHBondContact O-N 2.98Å
406	C	92.4	Very high	87.1	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.034	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	117.3	173.4	-67.8	0	0	0	0	109	L354 I365 T367 L448	L354-C406 HydrophobicContact CD2-CB 4.39Å; I365-C406 PolarHBondContact O-N 3.09Å; T367-C406 PolarHBondContact N-O 3.12Å; T367-C406 PolarHBondContact OG1-O 3.36Å; C406-L448 CarbonylContact C-O 3.59Å; C406-L448 WeakPolarHBondContact CA-O 3.41Å
407	I	91.8	Very high	87.1	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.6	176.1	-45.3	175.2	0	0	0	108.9	T367 V405 F410 M413 I421 V447 L448 A449 A450	T367-I407 WeakPolarHBondContact O-CA 3.44Å; T367-I407 WeakPolarHBondContact OG1-CG1 3.36Å; V405-I407 HydrophobicContact CG1-CG1 3.98Å; I407-F410 HydrophobicContact CB-CD2 4.32Å; I407-F410 HydrophobicContact CD1-CD2 3.97Å; I407-F410 HydrophobicContact CD1-CE2 4.12Å; I407-F410 HydrophobicContact CG2-CB 4.37Å; I407-F410 HydrophobicContact CG2-CD2 3.97Å; I407-M413 HydrophobicContact CD1-CE 4.44Å; I407-M413 HydrophobicContact CG2-CE 4.02Å; I407-I421 HydrophobicContact CD1-CD1 4.06Å; I407-V447 HydrophobicContact CD1-CG1 3.64Å; I407-V447 HydrophobicContact CG1-CG1 4.21Å; I407-L448 PolarHBondContact N-O 3.33Å; I407-A449 HydrophobicContact CB-CB 4.45Å; I407-A449 CarbonylContact O-C 3.48Å; I407-A449 WeakPolarHBondContact O-CA 3.49Å; I407-A450 PolarHBondContact O-N 2.64Å
408	D	91.4	Very high	87	Confident	35 Å²	35	44 Å²	44	19%	0.187	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	156.9	167.4	-151	-13.8	0	0	0	110.7	S351 L354 T367 T368 G369 F410	S351-D408 VanDerWaalsContact CB-OD2 3.24Å; S351-D408 WeakPolarHBondContact CB-OD2 3.49Å; S351-D408 PolarHBondContact OG-OD2 2.9Å; L354-D408 HydrophobicContact CD1-CB 3.58Å; T367-D408 PolarHBondContact O-N 3.36Å; T368-D408 CarbonylContact C-O 3.57Å; T368-D408 WeakPolarHBondContact CA-O 3.03Å; G369-D408 PolarHBondContact N-O 3.17Å; D408-F410 VanDerWaalsContact C-N 3.31Å; D408-F410 PolarHBondContact O-N 2.78Å
409	E	89.4	Confident	86.9	Confident	80 Å²	80	47.4 Å²	47.4	37%	0.374	24%	0.235	S	C	.	.	S	Bend	trans	51.5	43.1	-176	-54.7	-171	144.5	0	0	114	D411 K412 A450	E409-D411 PolarHBondContact O-N 2.83Å; E409-D411 VanDerWaalsContact O-N 3.11Å; E409-K412 HydrophobicContact CB-CB 4.38Å; E409-K412 HydrophobicContact CB-CG 4.17Å; E409-K412 PolarHBondContact O-N 3.05Å; E409-A450 PolarHBondContact N-O 3.2Å
410	F	89.3	Confident	86.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-56.3	-31	-176.4	-175.8	-83.2	0	0	0	113	I407 D408 K412 M413 I421 A449 A450 A451 L470 L474 F478	I407-F410 HydrophobicContact CB-CD2 4.32Å; I407-F410 HydrophobicContact CD1-CD2 3.97Å; I407-F410 HydrophobicContact CD1-CE2 4.12Å; I407-F410 HydrophobicContact CG2-CB 4.37Å; I407-F410 HydrophobicContact CG2-CD2 3.97Å; D408-F410 VanDerWaalsContact C-N 3.31Å; D408-F410 PolarHBondContact O-N 2.78Å; F410-K412 PolarHBondContact O-N 3.49Å; F410-M413 HydrophobicContact CD2-CE 4.06Å; F410-M413 HydrophobicContact CE2-CE 4.01Å; F410-M413 HydrophobicContact CE2-SD 4.33Å; F410-M413 WeakPolarHBondContact O-CB 3.31Å; F410-M413 PolarHBondContact O-N 3.01Å; F410-I421 HydrophobicContact CE2-CD1 4.11Å; F410-A449 HydrophobicContact CB-CB 4.23Å; F410-A449 HydrophobicContact CD2-CB 3.89Å; F410-A449 HydrophobicContact CG-CB 4.13Å; F410-A450 VanDerWaalsContact CB-O 3.29Å; F410-A450 WeakPolarHBondContact CB-O 3.5Å; F410-A450 PolarHBondContact N-O 2.68Å; F410-A451 HydrophobicContact CB-CB 4.4Å; F410-L470 HydrophobicContact CD1-CD1 4.08Å; F410-L470 HydrophobicContact CD1-CD2 4.45Å; F410-L470 HydrophobicContact CE1-CD1 3.98Å; F410-L470 HydrophobicContact CE1-CD2 4.05Å; F410-L474 HydrophobicContact CE1-CD2 3.43Å; F410-L474 VanDerWaalsContact CE1-CD2 3.43Å; F410-L474 HydrophobicContact CZ-CD1 4.22Å; F410-L474 HydrophobicContact CZ-CD2 3.61Å; F410-L474 HydrophobicContact CZ-CG 4.49Å; F410-F478 HydrophobicContact CE2-CZ 4.38Å; F410-F478 HydrophobicContact CZ-CE2 4.5Å; F410-F478 HydrophobicContact CZ-CZ 4.45Å
411	D	87.2	Confident	87	Confident	25 Å²	25	45.7 Å²	45.7	13%	0.134	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-63.4	-25.2	176.5	62	-75	0	0	0	113.6	E409 M413 R418 N452	E409-D411 PolarHBondContact O-N 2.83Å; E409-D411 VanDerWaalsContact O-N 3.11Å; D411-M413 VanDerWaalsContact C-N 3.32Å; D411-M413 PolarHBondContact O-N 3.15Å; D411-R418 PolarHBondContact O-NH2 3.03Å; D411-R418 VanDerWaalsContact O-NH2 3.13Å; D411-N452 PolarHBondContact OD1-N 2.87Å
412	K	87	Confident	87	Confident	119 Å²	119	45.5 Å²	45.5	52%	0.517	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-85.4	1.5	-179.5	-57	-54.5	-177.1	-126.4	0	114.6	R370 E409 F410	R370-K412 HydrophobicContact CB-CB 4.43Å; E409-K412 HydrophobicContact CB-CB 4.38Å; E409-K412 HydrophobicContact CB-CG 4.17Å; E409-K412 PolarHBondContact O-N 3.05Å; F410-K412 PolarHBondContact O-N 3.49Å
413	M	86.3	Confident	87.1	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.03	21%	0.208	C	C	.	.			trans	-72.2	142	178.9	-172	177.6	-63.4	0	0	112.8	G369 L377 I407 F410 D411 D417 R418 I421	G369-M413 WeakPolarHBondContact O-CA 3.42Å; L377-M413 HydrophobicContact CD1-CE 4.25Å; L377-M413 HydrophobicContact CD1-SD 4.41Å; I407-M413 HydrophobicContact CD1-CE 4.44Å; I407-M413 HydrophobicContact CG2-CE 4.02Å; F410-M413 HydrophobicContact CD2-CE 4.06Å; F410-M413 HydrophobicContact CE2-CE 4.01Å; F410-M413 HydrophobicContact CE2-SD 4.33Å; F410-M413 WeakPolarHBondContact O-CB 3.31Å; F410-M413 PolarHBondContact O-N 3.01Å; D411-M413 VanDerWaalsContact C-N 3.32Å; D411-M413 PolarHBondContact O-N 3.15Å; M413-D417 HydrophobicContact CG-CB 3.68Å; M413-D417 HydrophobicContact SD-CB 3.97Å; M413-R418 HydrophobicContact CG-CG 4.26Å; M413-R418 PolarHBondContact O-NE 2.81Å; M413-R418 VanDerWaalsContact O-NE 3.16Å; M413-R418 PolarHBondContact O-NH2 3.02Å; M413-R418 HydrophobicContact SD-CG 4.18Å; M413-I421 HydrophobicContact CE-CD1 3.58Å; M413-I421 HydrophobicContact SD-CD1 3.43Å; M413-I421 WeakPolarHBondContact SD-CD1 3.46Å; M413-I421 HydrophobicContact SD-CG1 4.45Å
414	S	86.5	Confident	87.1	Confident	53 Å²	53	40.1 Å²	40.1	37%	0.371	21%	0.208	S	C	.	.			trans	-72.9	153.6	177.8	89	0	0	0	0	112.5	M416 D417 R418	S414-M416 VanDerWaalsContact C-N 3.27Å; S414-M416 PolarHBondContact O-N 2.97Å; S414-D417 WeakPolarHBondContact CB-OD2 3.48Å; S414-D417 PolarHBondContact O-N 2.81Å; S414-D417 VanDerWaalsContact O-N 3.08Å; S414-D417 PolarHBondContact OG-N 2.74Å; S414-D417 PolarHBondContact OG-OD2 2.7Å; S414-R418 WeakPolarHBondContact O-CG 3.29Å; S414-R418 PolarHBondContact O-N 3.38Å
415	D	84.6	Confident	86.9	Confident	104 Å²	104	40.5 Å²	40.5	56%	0.556	21%	0.209	S	C	*	.	H	α-helix	trans	-65.4	-28.3	-178.3	-63.9	-51.9	0	0	0	113.7	D417 R418 T419	D415-D417 VanDerWaalsContact C-N 3.33Å; D415-D417 PolarHBondContact O-N 2.87Å; D415-R418 PolarHBondContact O-N 3.23Å; D415-R418 WeakPolarHBondContact OD1-CD 3.22Å; D415-R418 IonicContact OD1-CZ 2.96Å; D415-R418 IonicContact OD1-NE 3.72Å; D415-R418 IonicContact OD1-NH1 3.71Å; D415-R418 PolarHBondContact OD1-NH1 2.85Å; D415-T419 PolarHBondContact O-N 2.86Å
416	M	81.8	Confident	86.4	Confident	153 Å²	153	44.1 Å²	44.1	75%	0.754	23%	0.226	S	C	*	.	H	α-helix	trans	-60.9	-44.8	171.4	-68.5	-171.9	69.5	0	0	111.1	S414 T419 A420	S414-M416 VanDerWaalsContact C-N 3.27Å; S414-M416 PolarHBondContact O-N 2.97Å; M416-T419 PolarHBondContact O-N 3.46Å; M416-T419 PolarHBondContact O-OG1 2.93Å; M416-A420 PolarHBondContact O-N 2.8Å
417	D	84.6	Confident	86	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.112	25%	0.249	C	C	.	.	H	α-helix	trans	-72.1	-33.6	-176.8	-49.7	-35.8	0	0	0	111.1	G374 L377 M413 S414 D415 T419 A420 I421	G374-D417 WeakPolarHBondContact CA-OD1 3.49Å; G374-D417 VanDerWaalsContact N-CG 3.31Å; G374-D417 PolarHBondContact N-OD1 3.15Å; L377-D417 HydrophobicContact CD1-CB 4.21Å; M413-D417 HydrophobicContact CG-CB 3.68Å; M413-D417 HydrophobicContact SD-CB 3.97Å; S414-D417 WeakPolarHBondContact CB-OD2 3.48Å; S414-D417 PolarHBondContact O-N 2.81Å; S414-D417 VanDerWaalsContact O-N 3.08Å; S414-D417 PolarHBondContact OG-N 2.74Å; S414-D417 PolarHBondContact OG-OD2 2.7Å; D415-D417 VanDerWaalsContact C-N 3.33Å; D415-D417 PolarHBondContact O-N 2.87Å; D417-T419 VanDerWaalsContact C-N 3.34Å; D417-T419 PolarHBondContact O-N 2.79Å; D417-A420 WeakPolarHBondContact O-CB 3.32Å; D417-A420 PolarHBondContact O-N 3.35Å; D417-I421 PolarHBondContact O-N 2.79Å; D417-I421 VanDerWaalsContact O-N 3.07Å
418	R	82.8	Confident	85.7	Confident	46 Å²	46	49.5 Å²	49.5	17%	0.174	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-42.2	171.2	-66.2	172.7	-173	175.4	-9	111.7	D411 M413 S414 D415 A420 I421 H422	D411-R418 PolarHBondContact O-NH2 3.03Å; D411-R418 VanDerWaalsContact O-NH2 3.13Å; M413-R418 HydrophobicContact CG-CG 4.26Å; M413-R418 PolarHBondContact O-NE 2.81Å; M413-R418 VanDerWaalsContact O-NE 3.16Å; M413-R418 PolarHBondContact O-NH2 3.02Å; M413-R418 HydrophobicContact SD-CG 4.18Å; S414-R418 WeakPolarHBondContact O-CG 3.29Å; S414-R418 PolarHBondContact O-N 3.38Å; D415-R418 PolarHBondContact O-N 3.23Å; D415-R418 WeakPolarHBondContact OD1-CD 3.22Å; D415-R418 IonicContact OD1-CZ 2.96Å; D415-R418 IonicContact OD1-NE 3.72Å; D415-R418 IonicContact OD1-NH1 3.71Å; D415-R418 PolarHBondContact OD1-NH1 2.85Å; R418-A420 VanDerWaalsContact C-N 3.31Å; R418-A420 PolarHBondContact O-N 2.95Å; R418-I421 PolarHBondContact O-N 3.04Å; R418-H422 PolarHBondContact O-CD2 2.6Å; R418-H422 VanDerWaalsContact O-CG 3.28Å; R418-H422 PolarHBondContact O-N 2.77Å
419	T	84	Confident	85.5	Confident	94 Å²	94	53 Å²	53	58%	0.577	26%	0.264	S	S	*	.	H	α-helix	trans	-63.4	-34.6	176.1	65	0	0	0	0	113.6	D415 M416 D417 H422 E423	D415-T419 PolarHBondContact O-N 2.86Å; M416-T419 PolarHBondContact O-N 3.46Å; M416-T419 PolarHBondContact O-OG1 2.93Å; D417-T419 VanDerWaalsContact C-N 3.34Å; D417-T419 PolarHBondContact O-N 2.79Å; T419-H422 WeakPolarHBondContact O-CB 3.36Å; T419-H422 PolarHBondContact O-N 2.98Å; T419-E423 PolarHBondContact O-N 3.09Å
420	A	83.1	Confident	85.3	Confident	16 Å²	16	49.3 Å²	49.3	13%	0.132	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-41.9	174.6	0	0	0	0	0	111.7	T378 M416 D417 R418 H422 E423 V424	T378-A420 HydrophobicContact CG2-CB 3.68Å; M416-A420 PolarHBondContact O-N 2.8Å; D417-A420 WeakPolarHBondContact O-CB 3.32Å; D417-A420 PolarHBondContact O-N 3.35Å; R418-A420 VanDerWaalsContact C-N 3.31Å; R418-A420 PolarHBondContact O-N 2.95Å; A420-H422 VanDerWaalsContact C-N 3.29Å; A420-H422 PolarHBondContact O-N 3.11Å; A420-E423 PolarHBondContact O-N 2.85Å; A420-V424 PolarHBondContact O-N 3.07Å
421	I	85.8	Confident	85.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-35.4	174.7	-68.9	-175.8	0	0	0	111.6	L377 M397 I407 F410 M413 D417 R418 E423 V424 M425	L377-I421 HydrophobicContact CD1-CD1 4.23Å; L377-I421 HydrophobicContact CD1-CG1 4.46Å; M397-I421 HydrophobicContact SD-CG1 4.19Å; I407-I421 HydrophobicContact CD1-CD1 4.06Å; F410-I421 HydrophobicContact CE2-CD1 4.11Å; M413-I421 HydrophobicContact CE-CD1 3.58Å; M413-I421 HydrophobicContact SD-CD1 3.43Å; M413-I421 WeakPolarHBondContact SD-CD1 3.46Å; M413-I421 HydrophobicContact SD-CG1 4.45Å; D417-I421 PolarHBondContact O-N 2.79Å; D417-I421 VanDerWaalsContact O-N 3.07Å; R418-I421 PolarHBondContact O-N 3.04Å; I421-E423 VanDerWaalsContact C-N 3.3Å; I421-E423 PolarHBondContact O-N 2.67Å; I421-V424 PolarHBondContact O-N 3.26Å; I421-M425 HydrophobicContact CG2-CG 3.78Å; I421-M425 HydrophobicContact CG2-SD 3.4Å; I421-M425 WeakPolarHBondContact CG2-SD 3.42Å; I421-M425 WeakPolarHBondContact O-CB 3.45Å; I421-M425 WeakPolarHBondContact O-CG 3.18Å; I421-M425 PolarHBondContact O-N 3.1Å
422	H	85.6	Confident	85	Confident	31 Å²	31	51.8 Å²	51.8	14%	0.144	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-40.1	174.8	-69	-179.3	0	0	0	112.7	R418 T419 A420 E426 L474 R477	R418-H422 PolarHBondContact O-CD2 2.6Å; R418-H422 VanDerWaalsContact O-CG 3.28Å; R418-H422 PolarHBondContact O-N 2.77Å; T419-H422 WeakPolarHBondContact O-CB 3.36Å; T419-H422 PolarHBondContact O-N 2.98Å; A420-H422 VanDerWaalsContact C-N 3.29Å; A420-H422 PolarHBondContact O-N 3.11Å; H422-E426 VanDerWaalsContact O-CB 3.24Å; H422-E426 WeakPolarHBondContact O-CB 3.4Å; H422-E426 PolarHBondContact O-N 2.81Å; H422-L474 WeakPolarHBondContact NE2-CD1 3.23Å; H422-R477 PolarHBondContact CD2-NH1 2.91Å; H422-R477 PolarHBondContact ND1-NH1 2.9Å; H422-R477 PolarHBondContact NE2-NH1 2.82Å
423	E	85.8	Confident	84.9	Confident	48 Å²	48	49.5 Å²	49.5	22%	0.224	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-49.4	176.5	-170.3	-175.1	173.6	0	0	111	T419 A420 I421 E426 Q427 T431	T419-E423 PolarHBondContact O-N 3.09Å; A420-E423 PolarHBondContact O-N 2.85Å; I421-E423 VanDerWaalsContact C-N 3.3Å; I421-E423 PolarHBondContact O-N 2.67Å; E423-E426 PolarHBondContact O-N 3.33Å; E423-Q427 WeakPolarHBondContact O-CB 3.22Å; E423-Q427 PolarHBondContact O-N 3.31Å; E423-T431 WeakPolarHBondContact OE1-CA 3.47Å; E423-T431 VanDerWaalsContact OE1-CB 3.28Å; E423-T431 WeakPolarHBondContact OE1-CB 3.24Å; E423-T431 WeakPolarHBondContact OE1-CG2 3.43Å; E423-T431 PolarHBondContact OE1-N 2.82Å; E423-T431 PolarHBondContact OE1-OG1 2.95Å
424	V	87.5	Confident	84.8	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.024	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-45.5	-175.4	-177.8	0	0	0	0	112.4	M397 A420 I421 E426 G428 V430 A443	M397-V424 HydrophobicContact CE-CB 3.96Å; M397-V424 HydrophobicContact CE-CG1 3.59Å; M397-V424 HydrophobicContact SD-CB 4.45Å; M397-V424 HydrophobicContact SD-CG1 4.37Å; M397-V424 HydrophobicContact SD-CG2 4.41Å; A420-V424 PolarHBondContact O-N 3.07Å; I421-V424 PolarHBondContact O-N 3.26Å; V424-E426 VanDerWaalsContact C-N 3.29Å; V424-E426 PolarHBondContact O-N 3.45Å; V424-G428 WeakPolarHBondContact O-CA 3.36Å; V424-G428 PolarHBondContact O-N 3.36Å; V424-V430 HydrophobicContact CG2-CG2 3.48Å; V424-V430 VanDerWaalsContact CG2-CG2 3.48Å; V424-A443 HydrophobicContact CG1-CB 3.74Å; V424-A443 WeakPolarHBondContact CG1-O 3.47Å
425	M	87.1	Confident	84.6	Confident	9 Å²	9	54.7 Å²	54.7	4%	0.044	29%	0.291	C	S	.	.	H	α-helix	trans	-66.6	-31	179.6	-69.9	-178.4	79.7	0	0	112.6	R335 N339 I421 V447 R477 F478	R335-M425 PolarHBondContact NH1-O 2.84Å; N339-M425 HydrophobicContact CB-CE 3.68Å; I421-M425 HydrophobicContact CG2-CG 3.78Å; I421-M425 HydrophobicContact CG2-SD 3.4Å; I421-M425 WeakPolarHBondContact CG2-SD 3.42Å; I421-M425 WeakPolarHBondContact O-CB 3.45Å; I421-M425 WeakPolarHBondContact O-CG 3.18Å; I421-M425 PolarHBondContact O-N 3.1Å; M425-V447 HydrophobicContact CG-CG2 4.32Å; M425-R477 HydrophobicContact CE-CB 4.1Å; M425-R477 HydrophobicContact SD-CB 4.45Å; M425-F478 HydrophobicContact CE-CD1 3.87Å; M425-F478 HydrophobicContact CE-CD2 4.29Å; M425-F478 HydrophobicContact CE-CE1 3.76Å; M425-F478 HydrophobicContact CE-CE2 4.2Å; M425-F478 HydrophobicContact CE-CG 4.14Å; M425-F478 HydrophobicContact CE-CZ 3.93Å; M425-F478 HydrophobicContact SD-CZ 4.28Å
426	E	80.1	Confident	84.4	Confident	76 Å²	76	53.1 Å²	53.1	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-80.5	-49.6	180	-161.7	77.4	-142.6	0	0	111.7	H422 E423 V424 R477 R615	H422-E426 VanDerWaalsContact O-CB 3.24Å; H422-E426 WeakPolarHBondContact O-CB 3.4Å; H422-E426 PolarHBondContact O-N 2.81Å; E423-E426 PolarHBondContact O-N 3.33Å; V424-E426 VanDerWaalsContact C-N 3.29Å; V424-E426 PolarHBondContact O-N 3.45Å; E426-R477 IonicContact OE2-CZ 2.62Å; E426-R477 IonicContact OE2-NE 3.94Å; E426-R477 PolarHBondContact OE2-NE 3.04Å; E426-R477 IonicContact OE2-NH2 2.63Å; E426-R615 IonicContact OE1-CZ 3.46Å; E426-R615 IonicContact OE1-NE 2.91Å; E426-R615 IonicContact OE1-NH2 2.73Å; E426-R615 PolarHBondContact OE1-NH2 2.71Å; E426-R615 IonicContact OE2-CZ 3.78Å; E426-R615 IonicContact OE2-NH2 3.88Å; E426-R615 PolarHBondContact OE2-NH2 3.01Å
427	Q	83.9	Confident	84.5	Confident	112 Å²	112	48 Å²	48	52%	0.523	27%	0.274	S	S	.	.	H	α-helix	trans	-99.4	-14.8	-169.7	-55.4	-172.4	11.7	0	0	113.8	E423 R429	E423-Q427 WeakPolarHBondContact O-CB 3.22Å; E423-Q427 PolarHBondContact O-N 3.31Å; Q427-R429 PolarHBondContact O-N 3.47Å
428	G	85.4	Confident	84.5	Confident	8 Å²	8	54.8 Å²	54.8	8%	0.082	31%	0.305	C	S	.	.	S	Bend	trans	64	20.9	-171.3	0	0	0	0	0	113.6	V424 A443	V424-G428 WeakPolarHBondContact O-CA 3.36Å; V424-G428 PolarHBondContact O-N 3.36Å; G428-A443 CarbonylContact O-C 3.57Å; G428-A443 PolarHBondContact O-N 3.48Å; G428-A443 VanDerWaalsContact O-N 3.1Å
429	R	87	Confident	84.6	Confident	109 Å²	109	53.6 Å²	53.6	41%	0.411	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	151.3	-173.5	-68.6	-176	169.9	142.3	-0.2	109.9	Q427 L441 N442	Q427-R429 PolarHBondContact O-N 3.47Å; R429-L441 CarbonylContact C-O 3.47Å; R429-L441 VanDerWaalsContact CA-O 3.28Å; R429-L441 WeakPolarHBondContact CA-O 3.32Å; R429-N442 PolarHBondContact NE-OD1 3.21Å
430	V	86.6	Confident	84.8	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.1	169.9	-173.8	0	0	0	0	107.8	T378 V398 V424 I432 R440 L441 A443	T378-V430 HydrophobicContact CG2-CG1 4.14Å; T378-V430 HydrophobicContact CG2-CG2 4.39Å; V398-V430 HydrophobicContact CG2-CG2 4.13Å; V424-V430 HydrophobicContact CG2-CG2 3.48Å; V424-V430 VanDerWaalsContact CG2-CG2 3.48Å; V430-I432 HydrophobicContact CG1-CD1 3.95Å; V430-I432 HydrophobicContact CG1-CG1 3.65Å; V430-R440 CarbonylContact O-C 3.59Å; V430-R440 WeakPolarHBondContact O-CA 3.38Å; V430-L441 HydrophobicContact CB-CB 4.38Å; V430-L441 PolarHBondContact N-O 3.26Å; V430-L441 PolarHBondContact O-N 2.67Å; V430-A443 HydrophobicContact CG2-CB 3.99Å
431	T	85.6	Confident	84.9	Confident	68 Å²	68	60.2 Å²	60.2	42%	0.417	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.9	168.4	69.7	0	0	0	0	110.2	E423 R440	E423-T431 WeakPolarHBondContact OE1-CA 3.47Å; E423-T431 VanDerWaalsContact OE1-CB 3.28Å; E423-T431 WeakPolarHBondContact OE1-CB 3.24Å; E423-T431 WeakPolarHBondContact OE1-CG2 3.43Å; E423-T431 PolarHBondContact OE1-N 2.82Å; E423-T431 PolarHBondContact OE1-OG1 2.95Å; T431-R440 HydrophobicContact CG2-CG 4.01Å
432	I	84.6	Confident	84.9	Confident	9 Å²	9	63.7 Å²	63.7	5%	0.046	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.5	-177.9	-58	-175.7	0	0	0	108.8	A379 L392 V430 K434 I437 H438 A439 L441	A379-I432 HydrophobicContact CB-CD1 3.52Å; L392-I432 HydrophobicContact CD1-CD1 4.37Å; V430-I432 HydrophobicContact CG1-CD1 3.95Å; V430-I432 HydrophobicContact CG1-CG1 3.65Å; I432-K434 HydrophobicContact CG2-CB 3.96Å; I432-K434 HydrophobicContact CG2-CD 4.17Å; I432-K434 HydrophobicContact CG2-CG 4Å; I432-I437 VanDerWaalsContact O-O 3.06Å; I432-H438 CarbonylContact O-C 3.54Å; I432-H438 WeakPolarHBondContact O-CA 3.32Å; I432-A439 PolarHBondContact N-O 3.39Å; I432-A439 PolarHBondContact O-N 2.87Å; I432-L441 HydrophobicContact CD1-CD1 4.34Å
433	A	84.2	Confident	85	Confident	70 Å²	70	62.3 Å²	62.3	58%	0.579	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	78	171.9	0	0	0	0	0	108.5	I437 H438	A433-I437 WeakPolarHBondContact CA-O 3.49Å; A433-H438 WeakPolarHBondContact CB-ND1 3.46Å
434	K	84.4	Confident	85.1	Confident	114 Å²	114	62.2 Å²	62.2	50%	0.496	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.8	-176.2	-71.2	-177.2	-178.4	171.6	0	111	V381 I432 G436 I437	V381-K434 HydrophobicContact CG2-CB 4.19Å; I432-K434 HydrophobicContact CG2-CB 3.96Å; I432-K434 HydrophobicContact CG2-CD 4.17Å; I432-K434 HydrophobicContact CG2-CG 4Å; K434-G436 PolarHBondContact O-N 3.13Å; K434-G436 VanDerWaalsContact O-N 3.11Å; K434-I437 PolarHBondContact N-O 3.38Å; K434-I437 PolarHBondContact O-N 3.36Å
435	A	81.8	Confident	85.1	Confident	55 Å²	55	62.5 Å²	62.5	46%	0.455	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	35	174.9	0	0	0	0	0	115.2	V381 R390 I437	V381-A435 HydrophobicContact CG1-CB 4.17Å; R390-A435 PolarHBondContact NH1-O 3.06Å; A435-I437 VanDerWaalsContact C-N 3.3Å; A435-I437 PolarHBondContact O-N 2.99Å
436	G	81.1	Confident	85.2	Confident	70 Å²	70	62.4 Å²	62.4	72%	0.722	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-1.9	-178.7	0	0	0	0	0	115.2	K434	K434-G436 PolarHBondContact O-N 3.13Å; K434-G436 VanDerWaalsContact O-N 3.11Å
437	I	83.1	Confident	85.8	Confident	45 Å²	45	58.8 Å²	58.8	23%	0.231	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	120.4	173.8	-58.1	177.5	0	0	0	108.3	V381 R390 I432 A433 K434 A435 A439	V381-I437 HydrophobicContact CG1-CD1 3.86Å; V381-I437 HydrophobicContact CG2-CD1 4.18Å; R390-I437 HydrophobicContact CB-CD1 4.15Å; I432-I437 VanDerWaalsContact O-O 3.06Å; A433-I437 WeakPolarHBondContact CA-O 3.49Å; K434-I437 PolarHBondContact N-O 3.38Å; K434-I437 PolarHBondContact O-N 3.36Å; A435-I437 VanDerWaalsContact C-N 3.3Å; A435-I437 PolarHBondContact O-N 2.99Å; I437-A439 HydrophobicContact CG2-CB 4.01Å
438	H	86.1	Confident	86.3	Confident	165 Å²	165	53.5 Å²	53.5	76%	0.764	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	91	170.3	-67.5	-78.4	0	0	0	108.9	I432 A433	I432-H438 CarbonylContact O-C 3.54Å; I432-H438 WeakPolarHBondContact O-CA 3.32Å; A433-H438 WeakPolarHBondContact CB-ND1 3.46Å
439	A	84.3	Confident	86.6	Confident	21 Å²	21	53.1 Å²	53.1	17%	0.174	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	146.3	-177.9	0	0	0	0	0	111.3	L392 I432 I437	L392-A439 HydrophobicContact CD2-CB 3.86Å; I432-A439 PolarHBondContact N-O 3.39Å; I432-A439 PolarHBondContact O-N 2.87Å; I437-A439 HydrophobicContact CG2-CB 4.01Å
440	R	87.1	Confident	86.8	Confident	211 Å²	211	48 Å²	48	80%	0.796	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	113.3	167.9	-60.2	-172.9	177.3	160.4	-1.7	107.9	V430 T431	V430-R440 CarbonylContact O-C 3.59Å; V430-R440 WeakPolarHBondContact O-CA 3.38Å; T431-R440 HydrophobicContact CG2-CG 4.01Å
441	L	86.2	Confident	87	Confident	38 Å²	38	48 Å²	48	20%	0.199	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.3	177.8	-59.6	176.8	0	0	0	109.5	A379 L392 V398 R429 V430 I432	A379-L441 HydrophobicContact CB-CD1 3.62Å; L392-L441 HydrophobicContact CD2-CD1 3.88Å; L392-L441 HydrophobicContact CD2-CD2 4.02Å; L392-L441 HydrophobicContact CD2-CG 4.21Å; V398-L441 HydrophobicContact CG1-CB 4.32Å; V398-L441 HydrophobicContact CG1-CD1 4.22Å; V398-L441 HydrophobicContact CG2-CB 4.12Å; V398-L441 HydrophobicContact CG2-CD1 3.94Å; R429-L441 CarbonylContact C-O 3.47Å; R429-L441 VanDerWaalsContact CA-O 3.28Å; R429-L441 WeakPolarHBondContact CA-O 3.32Å; V430-L441 HydrophobicContact CB-CB 4.38Å; V430-L441 PolarHBondContact N-O 3.26Å; V430-L441 PolarHBondContact O-N 2.67Å; I432-L441 HydrophobicContact CD1-CD1 4.34Å
442	N	85.9	Confident	87.2	Confident	73 Å²	73	47.1 Å²	47.1	39%	0.39	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	136	168.8	-62.6	-53.4	0	0	0	108.7	R429	R429-N442 PolarHBondContact NE-OD1 3.21Å
443	A	86.6	Confident	87.4	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	26%	0.258	C	S	.	.			trans	-143.1	64.4	178.7	0	0	0	0	0	108.3	V398 V424 G428 V430 C445	V398-A443 HydrophobicContact CG2-CB 4.23Å; V424-A443 HydrophobicContact CG1-CB 3.74Å; V424-A443 WeakPolarHBondContact CG1-O 3.47Å; G428-A443 CarbonylContact O-C 3.57Å; G428-A443 PolarHBondContact O-N 3.48Å; G428-A443 VanDerWaalsContact O-N 3.1Å; V430-A443 HydrophobicContact CG2-CB 3.99Å; A443-C445 VanDerWaalsContact C-N 3.33Å; A443-C445 PolarHBondContact O-N 3.11Å; A443-C445 VanDerWaalsContact O-N 3.11Å
444	R	87.7	Confident	87.5	Confident	47 Å²	47	47.3 Å²	47.3	18%	0.177	25%	0.253	C	S	.	.			trans	-87	76.8	-175.5	-51.9	169.3	-73.3	-177.5	-3.5	108.4	R333 D401 R402	R333-R444 VanDerWaalsContact NH2-CG 3.29Å; D401-R444 WeakPolarHBondContact OD1-CB 3.4Å; D401-R444 WeakPolarHBondContact OD1-CG 3.25Å; D401-R444 IonicContact OD1-CZ 3.61Å; D401-R444 PolarHBondContact OD1-N 2.8Å; D401-R444 IonicContact OD1-NE 3.87Å; D401-R444 PolarHBondContact OD1-NE 3Å; D401-R444 IonicContact OD1-NH2 2.72Å; D401-R444 IonicContact OD2-CZ 3.91Å; D401-R444 IonicContact OD2-NE 2.67Å; D401-R444 PolarHBondContact OD2-NE 2.86Å; D401-R444 IonicContact OD2-NH2 3.57Å; D401-R444 PolarHBondContact OD2-NH2 3.09Å; R402-R444 VanDerWaalsContact CA-O 3.28Å; R402-R444 WeakPolarHBondContact CA-O 3.3Å; R402-R444 PolarHBondContact N-O 3.25Å
445	C	88	Confident	87.5	Confident	10 Å²	10	49.4 Å²	49.4	7%	0.068	26%	0.26	C	S	.	.			trans	-119	140.4	-175.5	56.3	0	0	0	0	110.2	A400 V405 A443	A400-C445 HydrophobicContact CB-CB 4.35Å; A400-C445 WeakPolarHBondContact O-CB 3.49Å; V405-C445 HydrophobicContact CG2-CB 3.88Å; A443-C445 VanDerWaalsContact C-N 3.33Å; A443-C445 PolarHBondContact O-N 3.11Å; A443-C445 VanDerWaalsContact O-N 3.11Å
446	S	90.6	Very high	87.5	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131.4	165.8	-64.4	0	0	0	0	108.7	I338 G403 V404 V405	I338-S446 WeakPolarHBondContact O-CB 3.29Å; G403-S446 PolarHBondContact O-N 3.38Å; V404-S446 WeakPolarHBondContact CA-O 3.29Å; V405-S446 PolarHBondContact N-O 3.11Å
447	V	92.3	Very high	87.6	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.4	-179.7	-177.9	0	0	0	0	110	N339 V340 M397 I407 M425 A449 F478	N339-V447 WeakPolarHBondContact CA-O 3.36Å; N339-V447 PolarHBondContact OD1-N 3.35Å; V340-V447 PolarHBondContact N-O 2.92Å; M397-V447 HydrophobicContact CE-CG2 4.16Å; I407-V447 HydrophobicContact CD1-CG1 3.64Å; I407-V447 HydrophobicContact CG1-CG1 4.21Å; M425-V447 HydrophobicContact CG-CG2 4.32Å; V447-A449 HydrophobicContact CG1-CB 4.48Å; V447-F478 HydrophobicContact CG1-CE1 4.21Å
448	L	93.3	Very high	87.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	109.2	167.2	-177.9	66.3	0	0	0	108.5	I316 M319 V340 L342 L354 V357 V404 V405 C406 I407	I316-L448 HydrophobicContact CG1-CD1 4.42Å; M319-L448 HydrophobicContact CE-CB 3.98Å; M319-L448 HydrophobicContact CE-CD1 4.25Å; M319-L448 HydrophobicContact CE-CD2 4.1Å; M319-L448 HydrophobicContact CE-CG 4.33Å; M319-L448 HydrophobicContact SD-CB 3.86Å; M319-L448 HydrophobicContact SD-CD1 4.15Å; M319-L448 HydrophobicContact SD-CG 4.49Å; V340-L448 HydrophobicContact CB-CD1 3.86Å; V340-L448 HydrophobicContact CG1-CD1 4.09Å; V340-L448 WeakPolarHBondContact O-CA 3.48Å; L342-L448 HydrophobicContact CD1-CD1 4.46Å; L342-L448 HydrophobicContact CG-CD1 4.47Å; L354-L448 HydrophobicContact CD2-CB 4.44Å; L354-L448 HydrophobicContact CD2-CD2 3.47Å; L354-L448 VanDerWaalsContact CD2-CD2 3.47Å; L354-L448 HydrophobicContact CD2-CG 3.54Å; V357-L448 HydrophobicContact CB-CD2 3.99Å; V357-L448 HydrophobicContact CG1-CD2 4.03Å; V357-L448 HydrophobicContact CG2-CD2 3.79Å; V404-L448 HydrophobicContact CG1-CB 4.26Å; V405-L448 PolarHBondContact O-N 2.98Å; C406-L448 CarbonylContact C-O 3.59Å; C406-L448 WeakPolarHBondContact CA-O 3.41Å; I407-L448 PolarHBondContact N-O 3.33Å
449	A	92.1	Very high	87.5	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.1	-179.1	0	0	0	0	0	111.4	V340 L341 L342 I407 F410 V447 F478	V340-A449 PolarHBondContact O-N 3.42Å; L341-A449 WeakPolarHBondContact CA-O 3.4Å; L341-A449 HydrophobicContact CD1-CB 3.67Å; L342-A449 PolarHBondContact N-O 3.08Å; I407-A449 HydrophobicContact CB-CB 4.45Å; I407-A449 CarbonylContact O-C 3.48Å; I407-A449 WeakPolarHBondContact O-CA 3.49Å; F410-A449 HydrophobicContact CB-CB 4.23Å; F410-A449 HydrophobicContact CD2-CB 3.89Å; F410-A449 HydrophobicContact CG-CB 4.13Å; V447-A449 HydrophobicContact CG1-CB 4.48Å; A449-F478 HydrophobicContact CB-CE1 4.02Å; A449-F478 HydrophobicContact CB-CZ 4.05Å
450	A	92.1	Very high	87.4	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.7	164.1	0	0	0	0	0	110.4	L342 K350 L354 I407 E409 F410	L342-A450 CarbonylContact O-C 3.41Å; L342-A450 WeakPolarHBondContact O-CA 3.26Å; K350-A450 HydrophobicContact CB-CB 4.45Å; L354-A450 HydrophobicContact CD1-CB 3.73Å; L354-A450 HydrophobicContact CD2-CB 4.45Å; L354-A450 HydrophobicContact CG-CB 4.24Å; I407-A450 PolarHBondContact O-N 2.64Å; E409-A450 PolarHBondContact N-O 3.2Å; F410-A450 VanDerWaalsContact CB-O 3.29Å; F410-A450 WeakPolarHBondContact CB-O 3.5Å; F410-A450 PolarHBondContact N-O 2.68Å
451	A	90.4	Very high	87	Confident	2 Å²	2	47 Å²	47	2%	0.017	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	151.1	177.4	0	0	0	0	0	110.9	L341 L342 I343 G344 K350 F410	L341-A451 HydrophobicContact CD1-CB 4.2Å; L342-A451 PolarHBondContact O-N 2.75Å; I343-A451 HydrophobicContact CG1-CB 4.1Å; G344-A451 PolarHBondContact N-O 2.89Å; K350-A451 PolarHBondContact NZ-O 3.29Å; F410-A451 HydrophobicContact CB-CB 4.4Å
452	N	89.7	Confident	86.7	Confident	50 Å²	50	48.3 Å²	48.3	27%	0.267	23%	0.226	S	C	.	.			trans	-105.3	145.2	169.2	-61.9	-38.3	0	0	0	109.2	K350 D411	K350-N452 PolarHBondContact NZ-OD1 3.31Å; D411-N452 PolarHBondContact OD1-N 2.87Å
453	P	88.8	Confident	86.3	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.019	22%	0.223	C	C	.	.			trans	-63.6	152.5	175.1	28.1	-35.6	0	0	0	110.4	G344 Y455 G456 Y458 N467	G344-P453 WeakPolarHBondContact O-CD 3.44Å; P453-Y455 PolarHBondContact O-N 3.19Å; P453-Y455 VanDerWaalsContact O-N 3.1Å; P453-G456 PolarHBondContact O-N 3Å; P453-Y458 HydrophobicContact CB-CD2 4.48Å; P453-N467 WeakPolarHBondContact CA-O 3.46Å; P453-N467 WeakPolarHBondContact CB-O 3.22Å
454	V	85.7	Confident	85.6	Confident	80 Å²	80	47.5 Å²	47.5	49%	0.485	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-36.9	-171	-178.5	0	0	0	0	112.7	N467	V454-N467 PolarHBondContact N-O 3.48Å
455	Y	84.1	Confident	85	Confident	159 Å²	159	49 Å²	49	62%	0.624	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	12.4	180	-57.5	-68.8	0	0	0	114.2	P453 R457	P453-Y455 PolarHBondContact O-N 3.19Å; P453-Y455 VanDerWaalsContact O-N 3.1Å; Y455-R457 PolarHBondContact O-N 3.08Å
456	G	83.3	Confident	84.7	Confident	32 Å²	32	53.4 Å²	53.4	33%	0.33	25%	0.253	S	S	.	.	S	Bend	trans	73.5	-27.1	-177.5	0	0	0	0	0	114.7	P346 P453	P346-G456 WeakPolarHBondContact CD-O 3.03Å; P453-G456 PolarHBondContact O-N 3Å
457	R	82.6	Confident	84.3	Confident	185 Å²	185	53.1 Å²	53.1	70%	0.698	25%	0.251	S	S	*	.	S	Bend	trans	-118.5	144.2	167.4	-70.3	-175.6	178.6	-178.9	-2.4	111.6	D345 Y455 N459	D345-R457 WeakPolarHBondContact OD1-CA 3.29Å; Y455-R457 PolarHBondContact O-N 3.08Å; R457-N459 PolarHBondContact O-N 2.85Å
458	Y	84.3	Confident	83.7	Confident	23 Å²	23	53.4 Å²	53.4	9%	0.09	25%	0.253	C	S	.	.			trans	-78.8	115.1	178.1	-169.4	-81.9	0	0	0	110.7	I343 D345 P453 Q460 P464 N467 I483 L485	I343-Y458 HydrophobicContact CG2-CD2 4.45Å; D345-Y458 PolarHBondContact OD1-N 3.36Å; P453-Y458 HydrophobicContact CB-CD2 4.48Å; Y458-Q460 HydrophobicContact CD1-CG 4.28Å; Y458-Q460 PolarHBondContact O-N 3.01Å; Y458-P464 WeakPolarHBondContact OH-CA 3.46Å; Y458-P464 WeakPolarHBondContact OH-CB 3.48Å; Y458-P464 WeakPolarHBondContact OH-CG 3.05Å; Y458-N467 HydrophobicContact CD2-CB 3.98Å; Y458-N467 HydrophobicContact CE2-CB 3.68Å; Y458-I483 HydrophobicContact CD2-CG2 3.98Å; Y458-I483 HydrophobicContact CE2-CD1 3.9Å; Y458-I483 HydrophobicContact CE2-CG2 3.85Å; Y458-I483 HydrophobicContact CG-CG2 4.37Å; Y458-I483 WeakPolarHBondContact OH-CD1 3.32Å; Y458-L485 HydrophobicContact CD1-CD2 3.35Å; Y458-L485 HydrophobicContact CD2-CD2 4.36Å; Y458-L485 HydrophobicContact CE1-CD2 4.06Å; Y458-L485 HydrophobicContact CG-CD2 3.52Å
459	N	82.8	Confident	83.1	Confident	65 Å²	65	55.7 Å²	55.7	35%	0.348	28%	0.276	S	S	.	.			trans	-88.1	103.9	179	-174.4	-3.1	0	0	0	110.7	R457 Y461 K462 N467	R457-N459 PolarHBondContact O-N 2.85Å; N459-Y461 PolarHBondContact O-N 3.42Å; N459-Y461 VanDerWaalsContact O-N 3.07Å; N459-Y461 WeakPolarHBondContact OD1-CB 3.41Å; N459-Y461 VanDerWaalsContact OD1-CD2 3.32Å; N459-Y461 WeakPolarHBondContact OD1-CD2 3.45Å; N459-Y461 PolarHBondContact OD1-N 3.28Å; N459-Y461 VanDerWaalsContact OD1-N 3.15Å; N459-K462 HydrophobicContact CB-CB 4.43Å; N459-K462 PolarHBondContact O-N 2.86Å; N459-N467 PolarHBondContact N-OD1 3.42Å; N459-N467 PolarHBondContact O-ND2 2.99Å
460	Q	81.3	Confident	82.5	Confident	78 Å²	78	56.6 Å²	56.6	36%	0.364	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.8	-178.6	-59.7	-178.1	34.3	0	0	114.3	Y458 L485	Y458-Q460 HydrophobicContact CD1-CG 4.28Å; Y458-Q460 PolarHBondContact O-N 3.01Å; Q460-L485 HydrophobicContact CG-CD1 4.19Å
461	Y	79.8	Confident	82	Confident	133 Å²	133	62.4 Å²	62.4	52%	0.522	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.6	176.5	-55.9	-68.3	0	0	0	113.9	N459 L657 K659	N459-Y461 PolarHBondContact O-N 3.42Å; N459-Y461 VanDerWaalsContact O-N 3.07Å; N459-Y461 WeakPolarHBondContact OD1-CB 3.41Å; N459-Y461 VanDerWaalsContact OD1-CD2 3.32Å; N459-Y461 WeakPolarHBondContact OD1-CD2 3.45Å; N459-Y461 PolarHBondContact OD1-N 3.28Å; N459-Y461 VanDerWaalsContact OD1-N 3.15Å; Y461-L657 VanDerWaalsContact CD1-O 3.26Å; Y461-L657 WeakPolarHBondContact CD1-O 3.43Å; Y461-K659 HydrophobicContact CD1-CB 3.77Å; Y461-K659 HydrophobicContact CD1-CG 4.49Å; Y461-K659 HydrophobicContact CE1-CB 3.81Å; Y461-K659 HydrophobicContact CE1-CG 4.23Å
462	K	80.4	Confident	81.5	Confident	66 Å²	66	66.2 Å²	66.2	29%	0.287	33%	0.328	S	S	.	.	S	Bend	trans	-100.4	154.6	174.4	-83.6	-169.6	165.5	-124.7	0	110.6	N459 E466 N467	N459-K462 HydrophobicContact CB-CB 4.43Å; N459-K462 PolarHBondContact O-N 2.86Å; K462-E466 HydrophobicContact CD-CB 4.5Å; K462-E466 WeakPolarHBondContact CE-OE2 3.32Å; K462-E466 IonicContact NZ-OE2 3.36Å; K462-E466 PolarHBondContact NZ-OE2 2.85Å; K462-N467 PolarHBondContact O-ND2 2.87Å
463	T	76.4	Confident	81.2	Confident	54 Å²	54	66.2 Å²	66.2	33%	0.331	33%	0.332	S	S	.	.			trans	-58.7	145.5	172.9	61.9	0	0	0	0	110.4	M465 E466 N467 A607	T463-M465 PolarHBondContact O-N 2.73Å; T463-E466 PolarHBondContact O-N 3.44Å; T463-E466 WeakPolarHBondContact OG1-CG 2.9Å; T463-E466 PolarHBondContact OG1-N 3.49Å; T463-N467 PolarHBondContact O-N 2.97Å; T463-N467 PolarHBondContact O-ND2 3.44Å; T463-A607 HydrophobicContact CG2-CB 4.49Å
464	P	72.4	Confident	81	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.019	33%	0.332	C	S	.	.	H	α-helix	trans	-55.8	-37.5	176.8	-28.3	36.7	0	0	0	113	Y458 E466 N467 I468 I483 R608 T609	Y458-P464 WeakPolarHBondContact OH-CA 3.46Å; Y458-P464 WeakPolarHBondContact OH-CB 3.48Å; Y458-P464 WeakPolarHBondContact OH-CG 3.05Å; P464-E466 PolarHBondContact O-N 2.69Å; P464-N467 PolarHBondContact O-N 2.94Å; P464-I468 HydrophobicContact CB-CD1 4.43Å; P464-I468 VanDerWaalsContact O-CD1 3.24Å; P464-I468 WeakPolarHBondContact O-CD1 3.28Å; P464-I468 WeakPolarHBondContact O-CG1 3.47Å; P464-I468 PolarHBondContact O-N 3.29Å; P464-I468 VanDerWaalsContact O-N 3.11Å; P464-I483 HydrophobicContact CB-CD1 4.39Å; P464-R608 WeakPolarHBondContact CG-O 3.33Å; P464-T609 HydrophobicContact CB-CG2 4.32Å; P464-T609 HydrophobicContact CG-CG2 4.23Å
465	M	75	Confident	80.8	Confident	79 Å²	79	62.5 Å²	62.5	39%	0.389	31%	0.309	S	S	.	.	H	α-helix	trans	-56.2	-50.8	177.4	-69	166.4	167.7	0	0	112.5	T463 N467 I468 G469	T463-M465 PolarHBondContact O-N 2.73Å; M465-N467 PolarHBondContact O-N 3.13Å; M465-I468 PolarHBondContact O-N 3.13Å; M465-G469 PolarHBondContact O-N 2.98Å
466	E	80.8	Confident	80.7	Confident	102 Å²	102	56 Å²	56	48%	0.477	29%	0.287	S	S	.	.	H	α-helix	trans	-65.2	-35.7	177.8	-76.4	178.7	-135.2	0	0	113.3	K462 T463 P464 I468	K462-E466 HydrophobicContact CD-CB 4.5Å; K462-E466 WeakPolarHBondContact CE-OE2 3.32Å; K462-E466 IonicContact NZ-OE2 3.36Å; K462-E466 PolarHBondContact NZ-OE2 2.85Å; T463-E466 PolarHBondContact O-N 3.44Å; T463-E466 WeakPolarHBondContact OG1-CG 2.9Å; T463-E466 PolarHBondContact OG1-N 3.49Å; P464-E466 PolarHBondContact O-N 2.69Å; E466-I468 VanDerWaalsContact C-N 3.29Å; E466-I468 PolarHBondContact O-N 3.12Å
467	N	82.1	Confident	80.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68.7	-29.2	179.3	-78.2	-47.7	0	0	0	112.7	P453 V454 Y458 N459 K462 T463 P464 M465	P453-N467 WeakPolarHBondContact CA-O 3.46Å; P453-N467 WeakPolarHBondContact CB-O 3.22Å; V454-N467 PolarHBondContact N-O 3.48Å; Y458-N467 HydrophobicContact CD2-CB 3.98Å; Y458-N467 HydrophobicContact CE2-CB 3.68Å; N459-N467 PolarHBondContact N-OD1 3.42Å; N459-N467 PolarHBondContact O-ND2 2.99Å; K462-N467 PolarHBondContact O-ND2 2.87Å; T463-N467 PolarHBondContact O-N 2.97Å; T463-N467 PolarHBondContact O-ND2 3.44Å; P464-N467 PolarHBondContact O-N 2.94Å; M465-N467 PolarHBondContact O-N 3.13Å
468	I	80.7	Confident	81.2	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-90.5	-38.8	-175.9	-63.3	161.8	0	0	0	111.6	I343 P464 M465 E466 L470 L475 L481	I343-I468 HydrophobicContact CD1-CD1 3.56Å; I343-I468 HydrophobicContact CD1-CG1 3.77Å; I343-I468 HydrophobicContact CD1-CG2 4.24Å; I343-I468 HydrophobicContact CG1-CG1 4.38Å; I343-I468 HydrophobicContact CG2-CG1 4.28Å; P464-I468 HydrophobicContact CB-CD1 4.43Å; P464-I468 VanDerWaalsContact O-CD1 3.24Å; P464-I468 WeakPolarHBondContact O-CD1 3.28Å; P464-I468 WeakPolarHBondContact O-CG1 3.47Å; P464-I468 PolarHBondContact O-N 3.29Å; P464-I468 VanDerWaalsContact O-N 3.11Å; M465-I468 PolarHBondContact O-N 3.13Å; E466-I468 VanDerWaalsContact C-N 3.29Å; E466-I468 PolarHBondContact O-N 3.12Å; I468-L470 VanDerWaalsContact C-N 3.31Å; I468-L470 HydrophobicContact CG2-CB 3.87Å; I468-L470 HydrophobicContact CG2-CD1 3.61Å; I468-L470 HydrophobicContact CG2-CG 3.7Å; I468-L470 PolarHBondContact O-N 3.41Å; I468-L475 HydrophobicContact CG2-CD2 4.43Å; I468-L481 HydrophobicContact CD1-CD1 4.42Å
469	G	80.1	Confident	81.4	Confident	48 Å²	48	46.9 Å²	46.9	50%	0.495	24%	0.243	S	C	.	.			trans	68.1	25.9	179.2	0	0	0	0	0	114.7	M465	M465-G469 PolarHBondContact O-N 2.98Å
470	L	80.5	Confident	81.7	Confident	18 Å²	18	43.8 Å²	43.8	9%	0.094	23%	0.227	C	C	.	.			trans	-110.4	154.5	175.2	-66.1	173.1	0	0	0	110.7	F410 I468 L474 L475	F410-L470 HydrophobicContact CD1-CD1 4.08Å; F410-L470 HydrophobicContact CD1-CD2 4.45Å; F410-L470 HydrophobicContact CE1-CD1 3.98Å; F410-L470 HydrophobicContact CE1-CD2 4.05Å; I468-L470 VanDerWaalsContact C-N 3.31Å; I468-L470 HydrophobicContact CG2-CB 3.87Å; I468-L470 HydrophobicContact CG2-CD1 3.61Å; I468-L470 HydrophobicContact CG2-CG 3.7Å; I468-L470 PolarHBondContact O-N 3.41Å; L470-L474 HydrophobicContact CB-CD2 4.38Å; L470-L474 HydrophobicContact CD1-CD2 3.99Å; L470-L474 HydrophobicContact CD2-CD2 4.08Å; L470-L474 HydrophobicContact CG-CD2 4.38Å; L470-L475 HydrophobicContact CB-CD2 4.35Å; L470-L475 HydrophobicContact CD1-CD2 4.47Å
471	Q	82	Confident	82	Confident	124 Å²	124	40.4 Å²	40.4	58%	0.579	21%	0.211	S	C	*	.			trans	-74.6	142.7	177.2	-63.7	-179.9	-5.9	0	0	111.9	S473 L474 L475	Q471-S473 PolarHBondContact O-N 3.11Å; Q471-S473 VanDerWaalsContact O-N 3.11Å; Q471-S473 PolarHBondContact OE1-OG 3.21Å; Q471-L474 WeakPolarHBondContact O-CB 3.3Å; Q471-L474 PolarHBondContact O-N 2.67Å; Q471-L475 PolarHBondContact O-N 2.79Å
472	D	79.6	Confident	82.5	Confident	81 Å²	81	34.2 Å²	34.2	43%	0.433	19%	0.187	S	C	.	.	H	α-helix	trans	-56	-30.9	176.8	-63.1	-31.3	0	0	0	113.5	L474 L475 S476	D472-L474 PolarHBondContact O-N 2.81Å; D472-L475 PolarHBondContact O-N 2.66Å; D472-S476 VanDerWaalsContact O-CB 3.27Å; D472-S476 WeakPolarHBondContact O-CB 3.25Å; D472-S476 PolarHBondContact O-N 3.08Å
473	S	83.1	Confident	82.7	Confident	50 Å²	50	32.4 Å²	32.4	35%	0.35	18%	0.18	S	C	.	.	H	α-helix	trans	-59.7	-31	176.8	72.6	0	0	0	0	112.7	Q471 R477	Q471-S473 PolarHBondContact O-N 3.11Å; Q471-S473 VanDerWaalsContact O-N 3.11Å; Q471-S473 PolarHBondContact OE1-OG 3.21Å; S473-R477 PolarHBondContact O-NH1 2.93Å
474	L	83.8	Confident	83.1	Confident	3 Å²	3	30 Å²	30	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-85.7	-44.2	175.3	-177.6	81.4	0	0	0	111.2	F410 H422 L470 Q471 D472 S476 R477 F478	F410-L474 HydrophobicContact CE1-CD2 3.43Å; F410-L474 VanDerWaalsContact CE1-CD2 3.43Å; F410-L474 HydrophobicContact CZ-CD1 4.22Å; F410-L474 HydrophobicContact CZ-CD2 3.61Å; F410-L474 HydrophobicContact CZ-CG 4.49Å; H422-L474 WeakPolarHBondContact NE2-CD1 3.23Å; L470-L474 HydrophobicContact CB-CD2 4.38Å; L470-L474 HydrophobicContact CD1-CD2 3.99Å; L470-L474 HydrophobicContact CD2-CD2 4.08Å; L470-L474 HydrophobicContact CG-CD2 4.38Å; Q471-L474 WeakPolarHBondContact O-CB 3.3Å; Q471-L474 PolarHBondContact O-N 2.67Å; D472-L474 PolarHBondContact O-N 2.81Å; L474-S476 PolarHBondContact O-N 3.13Å; L474-R477 WeakPolarHBondContact O-CB 3.43Å; L474-R477 PolarHBondContact O-N 3.13Å; L474-F478 HydrophobicContact CD1-CE2 4.16Å; L474-F478 HydrophobicContact CD2-CE2 4.18Å; L474-F478 HydrophobicContact CG-CD2 4.39Å; L474-F478 HydrophobicContact CG-CE2 3.92Å
475	L	81.9	Confident	83.7	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-56.9	-39.7	179	-64	176.3	0	0	0	111.2	L341 I468 L470 Q471 D472 R477 F478 L481	L341-L475 HydrophobicContact CD2-CD2 4.25Å; I468-L475 HydrophobicContact CG2-CD2 4.43Å; L470-L475 HydrophobicContact CB-CD2 4.35Å; L470-L475 HydrophobicContact CD1-CD2 4.47Å; Q471-L475 PolarHBondContact O-N 2.79Å; D472-L475 PolarHBondContact O-N 2.66Å; L475-R477 PolarHBondContact O-N 3.12Å; L475-R477 VanDerWaalsContact O-N 3.17Å; L475-F478 PolarHBondContact O-N 2.6Å; L475-L481 HydrophobicContact CD2-CD1 3.86Å
476	S	82.7	Confident	84.1	Confident	23 Å²	23	31 Å²	31	16%	0.161	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-7.2	174.3	-176.5	0	0	0	0	114.9	D472 L474 R615	D472-S476 VanDerWaalsContact O-CB 3.27Å; D472-S476 WeakPolarHBondContact O-CB 3.25Å; D472-S476 PolarHBondContact O-N 3.08Å; L474-S476 PolarHBondContact O-N 3.13Å; S476-R615 VanDerWaalsContact C-NH1 3.33Å; S476-R615 WeakPolarHBondContact O-CD 3.41Å; S476-R615 PolarHBondContact O-NH1 3.46Å; S476-R615 PolarHBondContact OG-NH1 3.34Å; S476-R615 VanDerWaalsContact OG-NH1 3.13Å
477	R	86.8	Confident	84.1	Confident	36 Å²	36	30.9 Å²	30.9	14%	0.136	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-21.7	175.9	-70.4	-175.9	-179.6	106.5	-11.7	113.9	R335 H422 M425 E426 S473 L474 L475	R335-R477 PolarHBondContact NH2-O 2.85Å; H422-R477 PolarHBondContact CD2-NH1 2.91Å; H422-R477 PolarHBondContact ND1-NH1 2.9Å; H422-R477 PolarHBondContact NE2-NH1 2.82Å; M425-R477 HydrophobicContact CE-CB 4.1Å; M425-R477 HydrophobicContact SD-CB 4.45Å; E426-R477 IonicContact OE2-CZ 2.62Å; E426-R477 IonicContact OE2-NE 3.94Å; E426-R477 PolarHBondContact OE2-NE 3.04Å; E426-R477 IonicContact OE2-NH2 2.63Å; S473-R477 PolarHBondContact O-NH1 2.93Å; L474-R477 WeakPolarHBondContact O-CB 3.43Å; L474-R477 PolarHBondContact O-N 3.13Å; L475-R477 PolarHBondContact O-N 3.12Å; L475-R477 VanDerWaalsContact O-N 3.17Å
478	F	88.3	Confident	83.9	Confident	9 Å²	9	38.3 Å²	38.3	4%	0.039	21%	0.208	C	C	.	.			trans	-77.3	132	168.9	-72.9	-78.9	0	0	0	108.8	N339 L341 F410 M425 V447 A449 L474 L475	N339-F478 HydrophobicContact CB-CD1 3.87Å; N339-F478 HydrophobicContact CB-CE1 4.4Å; L341-F478 HydrophobicContact CB-CB 4.33Å; L341-F478 HydrophobicContact CB-CD1 3.81Å; L341-F478 HydrophobicContact CB-CD2 4.34Å; L341-F478 HydrophobicContact CB-CE1 4.18Å; L341-F478 HydrophobicContact CB-CG 3.9Å; L341-F478 HydrophobicContact CD2-CD2 4.15Å; L341-F478 HydrophobicContact CD2-CE2 4.34Å; L341-F478 HydrophobicContact CD2-CG 4.5Å; F410-F478 HydrophobicContact CE2-CZ 4.38Å; F410-F478 HydrophobicContact CZ-CE2 4.5Å; F410-F478 HydrophobicContact CZ-CZ 4.45Å; M425-F478 HydrophobicContact CE-CD1 3.87Å; M425-F478 HydrophobicContact CE-CD2 4.29Å; M425-F478 HydrophobicContact CE-CE1 3.76Å; M425-F478 HydrophobicContact CE-CE2 4.2Å; M425-F478 HydrophobicContact CE-CG 4.14Å; M425-F478 HydrophobicContact CE-CZ 3.93Å; M425-F478 HydrophobicContact SD-CZ 4.28Å; V447-F478 HydrophobicContact CG1-CE1 4.21Å; A449-F478 HydrophobicContact CB-CE1 4.02Å; A449-F478 HydrophobicContact CB-CZ 4.05Å; L474-F478 HydrophobicContact CD1-CE2 4.16Å; L474-F478 HydrophobicContact CD2-CE2 4.18Å; L474-F478 HydrophobicContact CG-CD2 4.39Å; L474-F478 HydrophobicContact CG-CE2 3.92Å; L475-F478 PolarHBondContact O-N 2.6Å
479	D	89.3	Confident	84.1	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	22%	0.219	C	C	.	.	S	Bend	trans	-80.3	-35.1	-176.8	-77	5.1	0	0	0	110.2	R335 I338 N339 T619 R622	R335-D479 IonicContact CZ-OD1 3.94Å; R335-D479 IonicContact NH2-OD1 2.82Å; R335-D479 PolarHBondContact NH2-OD1 3.35Å; I338-D479 HydrophobicContact CG2-CB 4.16Å; N339-D479 PolarHBondContact O-N 3.11Å; D479-T619 HydrophobicContact CB-CG2 3.81Å; D479-T619 WeakPolarHBondContact CB-OG1 3.46Å; D479-T619 VanDerWaalsContact CG-OG1 3.24Å; D479-T619 WeakPolarHBondContact O-CG2 3.4Å; D479-T619 PolarHBondContact OD1-OG1 3.3Å; D479-R622 IonicContact OD1-NH1 2.83Å; D479-R622 PolarHBondContact OD1-NH1 2.82Å; D479-R622 WeakPolarHBondContact OD2-CD 3.5Å; D479-R622 IonicContact OD2-CZ 3.66Å; D479-R622 IonicContact OD2-NE 3.72Å; D479-R622 IonicContact OD2-NH1 3.27Å; D479-R622 PolarHBondContact OD2-NH1 3.43Å
480	L	88	Confident	84.4	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	135	175.4	-69.6	173.8	0	0	0	111.6	A315 N339 V340 L341 F482 L623 V648 A651	A315-L480 HydrophobicContact CB-CD1 3.65Å; N339-L480 PolarHBondContact O-N 3.36Å; N339-L480 VanDerWaalsContact O-N 3.17Å; V340-L480 WeakPolarHBondContact CA-O 3.49Å; V340-L480 HydrophobicContact CG2-CB 4.41Å; L341-L480 PolarHBondContact N-O 3.22Å; L480-F482 HydrophobicContact CB-CE2 3.9Å; L480-F482 HydrophobicContact CB-CZ 4.21Å; L480-F482 HydrophobicContact CD1-CE2 4.12Å; L480-F482 HydrophobicContact CD1-CZ 4.01Å; L480-F482 HydrophobicContact CD2-CZ 4.48Å; L480-F482 HydrophobicContact CG-CZ 4.48Å; L480-L623 HydrophobicContact CD1-CD1 4.16Å; L480-L623 HydrophobicContact CD1-CD2 3.88Å; L480-L623 HydrophobicContact CD2-CD1 4.13Å; L480-L623 HydrophobicContact CG-CD1 4.34Å; L480-V648 HydrophobicContact CD2-CG2 4.24Å; L480-A651 HydrophobicContact CD2-CB 4.09Å
481	L	89.1	Confident	84.8	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.037	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	116.2	176.2	-173	161.9	0	0	0	108.8	L341 I343 I468 L475 I483 A651	L341-L481 HydrophobicContact CD2-CD1 4.24Å; L341-L481 HydrophobicContact CD2-CG 4.36Å; I343-L481 HydrophobicContact CD1-CD1 3.89Å; I343-L481 HydrophobicContact CD1-CD2 3.7Å; I343-L481 HydrophobicContact CD1-CG 3.75Å; I468-L481 HydrophobicContact CD1-CD1 4.42Å; L475-L481 HydrophobicContact CD2-CD1 3.86Å; L481-I483 HydrophobicContact CD2-CD1 4.16Å; L481-I483 HydrophobicContact CD2-CG1 3.61Å; L481-A651 WeakPolarHBondContact O-CB 3.5Å
482	F	88.9	Confident	84.7	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.009	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.7	176.8	-64.2	-68.1	0	0	0	110.8	I312 A315 V340 L341 L342 I343 L480 F650 A651	I312-F482 HydrophobicContact CD1-CB 3.95Å; I312-F482 HydrophobicContact CD1-CG 4.22Å; I312-F482 HydrophobicContact CG1-CB 4.11Å; I312-F482 HydrophobicContact CG1-CD1 4.03Å; I312-F482 HydrophobicContact CG1-CD2 4.13Å; I312-F482 HydrophobicContact CG1-CG 3.81Å; I312-F482 HydrophobicContact CG2-CD2 4.46Å; A315-F482 HydrophobicContact CB-CE2 3.4Å; A315-F482 VanDerWaalsContact CB-CE2 3.4Å; A315-F482 HydrophobicContact CB-CZ 3.51Å; V340-F482 HydrophobicContact CG1-CD2 3.84Å; V340-F482 HydrophobicContact CG1-CE2 3.9Å; L341-F482 PolarHBondContact O-N 3.23Å; L342-F482 HydrophobicContact CD2-CB 4.05Å; L342-F482 HydrophobicContact CD2-CD2 3.93Å; L342-F482 HydrophobicContact CD2-CG 4.45Å; I343-F482 PolarHBondContact N-O 3.02Å; L480-F482 HydrophobicContact CB-CE2 3.9Å; L480-F482 HydrophobicContact CB-CZ 4.21Å; L480-F482 HydrophobicContact CD1-CE2 4.12Å; L480-F482 HydrophobicContact CD1-CZ 4.01Å; L480-F482 HydrophobicContact CD2-CZ 4.48Å; L480-F482 HydrophobicContact CG-CZ 4.48Å; F482-F650 HydrophobicContact CD1-CD1 4.17Å; F482-F650 HydrophobicContact CD1-CE1 4.21Å; F482-F650 HydrophobicContact CE1-CD1 4Å; F482-F650 HydrophobicContact CE1-CE1 4.41Å; F482-A651 HydrophobicContact CD1-CB 4.31Å; F482-A651 HydrophobicContact CE1-CB 3.99Å
483	I	85.8	Confident	85	Confident	29 Å²	29	46.8 Å²	46.8	15%	0.149	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	107.1	172	-53.4	-173.4	0	0	0	108.6	I343 Y458 P464 L481 L485 T609	I343-I483 WeakPolarHBondContact O-CA 3.32Å; Y458-I483 HydrophobicContact CD2-CG2 3.98Å; Y458-I483 HydrophobicContact CE2-CD1 3.9Å; Y458-I483 HydrophobicContact CE2-CG2 3.85Å; Y458-I483 HydrophobicContact CG-CG2 4.37Å; Y458-I483 WeakPolarHBondContact OH-CD1 3.32Å; P464-I483 HydrophobicContact CB-CD1 4.39Å; L481-I483 HydrophobicContact CD2-CD1 4.16Å; L481-I483 HydrophobicContact CD2-CG1 3.61Å; I483-L485 HydrophobicContact CG2-CD2 3.6Å; I483-L485 HydrophobicContact CG2-CG 4.03Å; I483-L485 PolarHBondContact O-N 3.32Å; I483-T609 HydrophobicContact CD1-CG2 3.47Å; I483-T609 VanDerWaalsContact CD1-CG2 3.47Å; I483-T609 HydrophobicContact CG1-CG2 4.26Å
484	M	85.4	Confident	85.2	Confident	3 Å²	3	54 Å²	54	2%	0.015	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	94.9	176.8	-54.5	179	76.1	0	0	108.1	H309 I312 L342 I343 G344 D345 V348 K350 L353	H309-M484 VanDerWaalsContact CD2-CE 3.49Å; H309-M484 WeakPolarHBondContact CD2-CE 3.42Å; H309-M484 WeakPolarHBondContact NE2-CE 3.33Å; I312-M484 HydrophobicContact CD1-CE 3.74Å; I312-M484 HydrophobicContact CD1-CG 3.55Å; I312-M484 HydrophobicContact CD1-SD 3.68Å; L342-M484 HydrophobicContact CB-SD 4.33Å; L342-M484 HydrophobicContact CD2-SD 4.46Å; I343-M484 PolarHBondContact O-N 3.15Å; G344-M484 WeakPolarHBondContact CA-O 3.45Å; D345-M484 PolarHBondContact N-O 3.38Å; V348-M484 HydrophobicContact CB-CB 4.43Å; V348-M484 HydrophobicContact CG1-CB 3.95Å; V348-M484 HydrophobicContact CG1-CE 4.24Å; K350-M484 HydrophobicContact CD-SD 4.16Å; K350-M484 HydrophobicContact CG-CE 4.44Å; K350-M484 HydrophobicContact CG-SD 3.57Å; K350-M484 VanDerWaalsContact CG-SD 3.57Å; L353-M484 HydrophobicContact CD1-CE 3.93Å; L353-M484 HydrophobicContact CD1-SD 4.44Å
485	L	84	Confident	85.2	Confident	20 Å²	20	58.2 Å²	58.2	11%	0.105	28%	0.283	C	S	.	.			trans	-86.4	139.2	174.3	-57.9	179.7	0	0	0	109.6	Y458 Q460 I483 Q487	Y458-L485 HydrophobicContact CD1-CD2 3.35Å; Y458-L485 HydrophobicContact CD2-CD2 4.36Å; Y458-L485 HydrophobicContact CE1-CD2 4.06Å; Y458-L485 HydrophobicContact CG-CD2 3.52Å; Q460-L485 HydrophobicContact CG-CD1 4.19Å; I483-L485 HydrophobicContact CG2-CD2 3.6Å; I483-L485 HydrophobicContact CG2-CG 4.03Å; I483-L485 PolarHBondContact O-N 3.32Å; L485-Q487 PolarHBondContact O-N 3.03Å
486	D	84.1	Confident	85.4	Confident	83 Å²	83	61.5 Å²	61.5	44%	0.444	30%	0.3	S	S	.	.			trans	-72.2	104.5	167.1	-166.5	18.6	0	0	0	109.2	D345 V348	D345-D486 HydrophobicContact CB-CB 4.28Å; D345-D486 PolarHBondContact OD2-N 3.31Å; D345-D486 VanDerWaalsContact OD2-N 3.11Å; V348-D486 HydrophobicContact CG2-CB 4.16Å
487	Q	79.5	Confident	85.5	Confident	100 Å²	100	63.4 Å²	63.4	47%	0.467	31%	0.313	S	S	.	.			trans	-93.6	110.3	177.4	-70	-165.8	-37.5	0	0	109	L485 D489	L485-Q487 PolarHBondContact O-N 3.03Å; Q487-D489 PolarHBondContact O-N 2.85Å
488	M	77.9	Confident	85.5	Confident	155 Å²	155	65.5 Å²	65.5	76%	0.764	33%	0.327	S	S	*	.			trans	-72.9	68.9	175.4	-63.9	177.7	178.1	0	0	111
489	D	85.3	Confident	85.2	Confident	52 Å²	52	66.1 Å²	66.1	28%	0.278	33%	0.33	S	S	.	.			trans	-110.2	113.6	178.8	179.5	2.1	0	0	0	109.1	Q487 E491 Q492 D493	Q487-D489 PolarHBondContact O-N 2.85Å; D489-E491 PolarHBondContact O-N 3.21Å; D489-E491 VanDerWaalsContact O-N 3.11Å; D489-E491 PolarHBondContact OD1-N 3.03Å; D489-Q492 HydrophobicContact CB-CB 4.27Å; D489-Q492 HydrophobicContact CB-CG 4.19Å; D489-Q492 PolarHBondContact O-N 2.94Å; D489-Q492 VanDerWaalsContact O-N 3.15Å; D489-Q492 WeakPolarHBondContact OD2-CG 3.45Å; D489-Q492 PolarHBondContact OD2-NE2 3.44Å; D489-D493 PolarHBondContact O-N 3.37Å
490	P	87.3	Confident	84.9	Confident	102 Å²	102	69.1 Å²	69.1	66%	0.662	35%	0.349	S	S	*	.	H	α-helix	trans	-62.9	-20.4	-173.8	27.1	-36.3	0	0	0	113.8	R494	P490-R494 WeakPolarHBondContact O-CB 3.42Å; P490-R494 PolarHBondContact O-N 3.03Å
491	E	87.3	Confident	84.8	Confident	151 Å²	151	74.4 Å²	74.4	71%	0.706	38%	0.376	S	S	*	.	H	α-helix	trans	-74.2	-47.8	174.7	-62.3	-166.2	168.5	0	0	111.2	D489 R494 E495	D489-E491 PolarHBondContact O-N 3.21Å; D489-E491 VanDerWaalsContact O-N 3.11Å; D489-E491 PolarHBondContact OD1-N 3.03Å; E491-R494 PolarHBondContact O-N 3.38Å; E491-E495 PolarHBondContact O-N 3.14Å; E491-E495 VanDerWaalsContact O-N 3.11Å
492	Q	80.4	Confident	84.4	Confident	80 Å²	80	76.5 Å²	76.5	37%	0.374	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-44	178.4	-65.5	-179.9	56.8	0	0	111.3	D489 R494 E495 I496	D489-Q492 HydrophobicContact CB-CB 4.27Å; D489-Q492 HydrophobicContact CB-CG 4.19Å; D489-Q492 PolarHBondContact O-N 2.94Å; D489-Q492 VanDerWaalsContact O-N 3.15Å; D489-Q492 WeakPolarHBondContact OD2-CG 3.45Å; D489-Q492 PolarHBondContact OD2-NE2 3.44Å; Q492-R494 VanDerWaalsContact C-N 3.25Å; Q492-R494 PolarHBondContact O-N 3.02Å; Q492-E495 PolarHBondContact O-N 3.46Å; Q492-I496 VanDerWaalsContact O-CG1 3.27Å; Q492-I496 WeakPolarHBondContact O-CG1 3.45Å; Q492-I496 PolarHBondContact O-N 3.36Å
493	D	86	Confident	83.7	Confident	72 Å²	72	79.8 Å²	79.8	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-60.4	-35	176.4	-79.6	-20.7	0	0	0	112.3	D489 S497	D489-D493 PolarHBondContact O-N 3.37Å; D493-S497 WeakPolarHBondContact O-CB 3.44Å; D493-S497 PolarHBondContact O-N 2.97Å; D493-S497 PolarHBondContact O-OG 3.01Å
494	R	87.8	Confident	83.3	Confident	202 Å²	202	85.8 Å²	85.8	76%	0.762	43%	0.427	S	S	*	.	H	α-helix	trans	-69.9	-41.1	176.2	-173.2	176.1	-178.2	123.9	0.3	112.1	P490 E491 Q492 S497 D498	P490-R494 WeakPolarHBondContact O-CB 3.42Å; P490-R494 PolarHBondContact O-N 3.03Å; E491-R494 PolarHBondContact O-N 3.38Å; Q492-R494 VanDerWaalsContact C-N 3.25Å; Q492-R494 PolarHBondContact O-N 3.02Å; R494-S497 PolarHBondContact O-N 2.99Å; R494-D498 PolarHBondContact O-N 3.44Å
495	E	83.3	Confident	82.9	Confident	91 Å²	91	93.5 Å²	93.5	43%	0.425	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-41.4	175.1	-67.8	-160.1	131.6	0	0	111.9	H307 E491 Q492 S497 H499 K555	H307-E495 IonicContact CE1-OE2 3.64Å; H307-E495 PolarHBondContact CE1-OE2 3.18Å; H307-E495 VanDerWaalsContact CE1-OE2 3.25Å; E491-E495 PolarHBondContact O-N 3.14Å; E491-E495 VanDerWaalsContact O-N 3.11Å; Q492-E495 PolarHBondContact O-N 3.46Å; E495-S497 VanDerWaalsContact C-N 3.35Å; E495-H499 VanDerWaalsContact O-CB 3.26Å; E495-H499 WeakPolarHBondContact O-CB 3.47Å; E495-H499 PolarHBondContact O-N 3.11Å; E495-K555 IonicContact OE1-NZ 3.67Å
496	I	85.3	Confident	82.2	Confident	72 Å²	72	96 Å²	96	37%	0.369	47%	0.465	S	S	.	.	H	α-helix	trans	-61.1	-44.9	173.1	-66.9	162.6	0	0	0	110.3	H307 Q492 H499 V500	H307-I496 HydrophobicContact CB-CG1 4.18Å; Q492-I496 VanDerWaalsContact O-CG1 3.27Å; Q492-I496 WeakPolarHBondContact O-CG1 3.45Å; Q492-I496 PolarHBondContact O-N 3.36Å; I496-H499 WeakPolarHBondContact O-CB 3.28Å; I496-H499 PolarHBondContact O-N 3.38Å; I496-V500 HydrophobicContact CG2-CG2 4.27Å; I496-V500 WeakPolarHBondContact O-CB 3.47Å; I496-V500 WeakPolarHBondContact O-CG2 3.23Å; I496-V500 PolarHBondContact O-N 2.81Å
497	S	86.6	Confident	81.2	Confident	63 Å²	63	99.8 Å²	99.8	44%	0.441	47%	0.472	S	S	.	.	H	α-helix	trans	-63.2	-47.6	179.6	-64.8	0	0	0	0	112.4	D493 R494 E495 H499 V500 L501	D493-S497 WeakPolarHBondContact O-CB 3.44Å; D493-S497 PolarHBondContact O-N 2.97Å; D493-S497 PolarHBondContact O-OG 3.01Å; R494-S497 PolarHBondContact O-N 2.99Å; E495-S497 VanDerWaalsContact C-N 3.35Å; S497-H499 VanDerWaalsContact C-N 3.29Å; S497-H499 PolarHBondContact O-N 3.11Å; S497-V500 PolarHBondContact O-N 2.87Å; S497-L501 VanDerWaalsContact O-CB 3.29Å; S497-L501 WeakPolarHBondContact O-CB 3.12Å; S497-L501 VanDerWaalsContact O-CG 3.22Å; S497-L501 WeakPolarHBondContact O-CG 3.19Å; S497-L501 PolarHBondContact O-N 3.15Å
498	D	85.7	Confident	80.3	Confident	79 Å²	79	99.5 Å²	99.5	42%	0.422	47%	0.474	S	S	.	.	H	α-helix	trans	-60.8	-41.5	175	-178.1	68.8	0	0	0	111	R494 R502	R494-D498 PolarHBondContact O-N 3.44Å; D498-R502 WeakPolarHBondContact O-CB 3.42Å; D498-R502 PolarHBondContact O-N 3.49Å; D498-R502 IonicContact OD2-CZ 2.82Å; D498-R502 IonicContact OD2-NE 3.79Å; D498-R502 IonicContact OD2-NH2 2.78Å; D498-R502 PolarHBondContact OD2-NH2 3.25Å
499	H	82.1	Confident	79.3	Confident	23 Å²	23	97.4 Å²	97.4	11%	0.106	48%	0.475	C	S	.	.	H	α-helix	trans	-62	-46.4	177.5	-168.1	-83.6	0	0	0	112.6	P304 H307 E495 I496 S497 R502 M503	P304-H499 PolarHBondContact O-CE1 2.89Å; P304-H499 PolarHBondContact O-NE2 3.03Å; P304-H499 VanDerWaalsContact O-NE2 3.09Å; H307-H499 HydrophobicContact CB-CB 4.24Å; E495-H499 VanDerWaalsContact O-CB 3.26Å; E495-H499 WeakPolarHBondContact O-CB 3.47Å; E495-H499 PolarHBondContact O-N 3.11Å; I496-H499 WeakPolarHBondContact O-CB 3.28Å; I496-H499 PolarHBondContact O-N 3.38Å; S497-H499 VanDerWaalsContact C-N 3.29Å; S497-H499 PolarHBondContact O-N 3.11Å; H499-R502 WeakPolarHBondContact O-CB 3.32Å; H499-R502 PolarHBondContact O-N 3.46Å; H499-M503 VanDerWaalsContact O-CG 3.31Å; H499-M503 WeakPolarHBondContact O-CG 3.36Å; H499-M503 PolarHBondContact O-N 3.21Å
500	V	83.3	Confident	78	Confident	66 Å²	66	106.6 Å²	106.6	40%	0.4	51%	0.506	S	S	.	.	H	α-helix	trans	-68.1	-44.9	178.9	170.2	0	0	0	0	111.2	I496 S497 R502 M503 H504	I496-V500 HydrophobicContact CG2-CG2 4.27Å; I496-V500 WeakPolarHBondContact O-CB 3.47Å; I496-V500 WeakPolarHBondContact O-CG2 3.23Å; I496-V500 PolarHBondContact O-N 2.81Å; S497-V500 PolarHBondContact O-N 2.87Å; V500-R502 VanDerWaalsContact C-N 3.27Å; V500-R502 PolarHBondContact O-N 3.43Å; V500-M503 PolarHBondContact O-N 3.06Å; V500-H504 PolarHBondContact O-CD2 2.68Å; V500-H504 PolarHBondContact O-N 3.32Å
501	L	85.3	Confident	76.8	Confident	111 Å²	111	107.7 Å²	107.7	58%	0.581	50%	0.502	S	S	*	.	H	α-helix	trans	-59.6	-40.4	174.8	-74	170.2	0	0	0	111.4	S497 H504 R505	S497-L501 VanDerWaalsContact O-CB 3.29Å; S497-L501 WeakPolarHBondContact O-CB 3.12Å; S497-L501 VanDerWaalsContact O-CG 3.22Å; S497-L501 WeakPolarHBondContact O-CG 3.19Å; S497-L501 PolarHBondContact O-N 3.15Å; L501-H504 PolarHBondContact O-N 2.94Å; L501-R505 WeakPolarHBondContact O-CB 3.28Å; L501-R505 VanDerWaalsContact O-CG 3.23Å; L501-R505 WeakPolarHBondContact O-CG 3.32Å; L501-R505 PolarHBondContact O-N 2.98Å
502	R	80.4	Confident	75.3	Confident	51 Å²	51	108.7 Å²	108.7	19%	0.192	51%	0.506	C	S	.	.	H	α-helix	trans	-62.4	-46.2	176.2	-175.4	-170.4	-50.1	168.3	4	111.8	D498 H499 V500 H504 R505 Y506 L550 L551 H552	D498-R502 WeakPolarHBondContact O-CB 3.42Å; D498-R502 PolarHBondContact O-N 3.49Å; D498-R502 IonicContact OD2-CZ 2.82Å; D498-R502 IonicContact OD2-NE 3.79Å; D498-R502 IonicContact OD2-NH2 2.78Å; D498-R502 PolarHBondContact OD2-NH2 3.25Å; H499-R502 WeakPolarHBondContact O-CB 3.32Å; H499-R502 PolarHBondContact O-N 3.46Å; V500-R502 VanDerWaalsContact C-N 3.27Å; V500-R502 PolarHBondContact O-N 3.43Å; R502-H504 VanDerWaalsContact C-N 3.34Å; R502-H504 PolarHBondContact O-N 2.81Å; R502-R505 PolarHBondContact O-N 3.33Å; R502-Y506 PolarHBondContact O-N 2.83Å; R502-Y506 VanDerWaalsContact O-N 3.11Å; R502-L550 WeakPolarHBondContact CD-O 3.44Å; R502-L550 WeakPolarHBondContact CG-O 3.41Å; R502-L551 WeakPolarHBondContact CD-O 3.35Å; R502-L551 PolarHBondContact NH1-O 2.88Å; R502-H552 VanDerWaalsContact NH1-C 3.32Å; R502-H552 PolarHBondContact NH1-O 3.1Å
503	M	75.4	Confident	73.6	Confident	71 Å²	71	113.9 Å²	113.9	35%	0.35	53%	0.531	S	S	.	.	H	α-helix	trans	-61.7	-39	174.2	-67.9	-66.3	-66.4	0	0	112.3	H499 V500 Y506 L551	H499-M503 VanDerWaalsContact O-CG 3.31Å; H499-M503 WeakPolarHBondContact O-CG 3.36Å; H499-M503 PolarHBondContact O-N 3.21Å; V500-M503 PolarHBondContact O-N 3.06Å; M503-Y506 WeakPolarHBondContact O-CB 3.41Å; M503-Y506 PolarHBondContact O-N 3.24Å; M503-L551 HydrophobicContact SD-CD1 3.78Å; M503-L551 HydrophobicContact SD-CG 4.16Å
504	H	77.3	Confident	72.2	Confident	155 Å²	155	114 Å²	114	72%	0.718	55%	0.548	S	S	*	.	H	α-helix	trans	-72.7	-24.3	175.4	-84.4	-73.1	0	0	0	114.3	V500 L501 R502 Y506	V500-H504 PolarHBondContact O-CD2 2.68Å; V500-H504 PolarHBondContact O-N 3.32Å; L501-H504 PolarHBondContact O-N 2.94Å; R502-H504 VanDerWaalsContact C-N 3.34Å; R502-H504 PolarHBondContact O-N 2.81Å; H504-Y506 VanDerWaalsContact C-N 3.34Å
505	R	76.4	Confident	70.6	Confident	165 Å²	165	107.8 Å²	107.8	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-80.4	-16.4	172.6	-74.5	172.7	66.4	-166.9	1.8	112.9	L501 R502 R507 L550	L501-R505 WeakPolarHBondContact O-CB 3.28Å; L501-R505 VanDerWaalsContact O-CG 3.23Å; L501-R505 WeakPolarHBondContact O-CG 3.32Å; L501-R505 PolarHBondContact O-N 2.98Å; R502-R505 PolarHBondContact O-N 3.33Å; R505-R507 PolarHBondContact O-N 3.38Å; R505-L550 HydrophobicContact CB-CD2 4.29Å; R505-L550 WeakPolarHBondContact O-CD2 3.08Å
506	Y	68.6	Low	69	Low	73 Å²	73	107.9 Å²	107.9	29%	0.286	56%	0.557	S	S	.	*			trans	-68.4	124.3	177.9	-175.1	-97.9	0	0	0	110.8	R502 M503 H504 D508 N548 L551	R502-Y506 PolarHBondContact O-N 2.83Å; R502-Y506 VanDerWaalsContact O-N 3.11Å; M503-Y506 WeakPolarHBondContact O-CB 3.41Å; M503-Y506 PolarHBondContact O-N 3.24Å; H504-Y506 VanDerWaalsContact C-N 3.34Å; Y506-D508 WeakPolarHBondContact CE1-OD1 3.49Å; Y506-D508 PolarHBondContact OH-OD1 2.89Å; Y506-N548 HydrophobicContact CE2-CB 4.31Å; Y506-N548 WeakPolarHBondContact CE2-ND2 3.23Å; Y506-N548 PolarHBondContact OH-ND2 3.06Å; Y506-L551 HydrophobicContact CD1-CD1 4.1Å; Y506-L551 HydrophobicContact CD2-CB 4.46Å; Y506-L551 HydrophobicContact CD2-CD1 3.51Å; Y506-L551 HydrophobicContact CE2-CD1 4.16Å; Y506-L551 HydrophobicContact CG-CD1 3.47Å; Y506-L551 VanDerWaalsContact CG-CD1 3.47Å
507	R	64.1	Low	67.1	Low	161 Å²	161	112.5 Å²	112.5	61%	0.608	58%	0.579	S	S	*	*			trans	-129.9	148.2	166.6	-68.3	-177.5	176.4	169.7	-3.1	107.1	R505 S509	R505-R507 PolarHBondContact O-N 3.38Å; R507-S509 PolarHBondContact O-N 3.33Å
508	D	60.8	Low	65	Low	95 Å²	95	115 Å²	115	51%	0.508	59%	0.592	S	S	.	*			trans	-65.6	134.9	176.1	-77.9	-32.9	0	0	0	110.3	Y506 R510 E511	Y506-D508 WeakPolarHBondContact CE1-OD1 3.49Å; Y506-D508 PolarHBondContact OH-OD1 2.89Å; D508-R510 PolarHBondContact O-N 3.06Å; D508-E511 PolarHBondContact O-N 3.09Å
509	S	56.9	Low	62.8	Low	110 Å²	110	120 Å²	120	77%	0.769	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	4.3	-174.5	-44.4	0	0	0	0	114.7	R507	R507-S509 PolarHBondContact O-N 3.33Å
510	R	57.8	Low	60.9	Low	246 Å²	246	122.5 Å²	122.5	93%	0.928	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-17.4	174.6	-67.4	-179.9	173.7	174.8	-3.2	112.8	D508	D508-R510 PolarHBondContact O-N 3.06Å
511	E	62.1	Low	58.6	Low	124 Å²	124	121.6 Å²	121.6	58%	0.579	65%	0.654	S	S	*	*	S	Bend	trans	-89.4	130.1	177	-64.7	-168.6	146.7	0	0	111.4	D508	D508-E511 PolarHBondContact O-N 3.09Å
512	Q	56.1	Low	56.2	Low	172 Å²	172	121.9 Å²	121.9	80%	0.804	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-76.4	145	173.9	-79.1	-178.3	-16.1	0	0	111.8	G514 A515	Q512-G514 PolarHBondContact O-N 2.91Å; Q512-A515 PolarHBondContact O-N 2.87Å
513	E	44.8	Very low	54	Low	189 Å²	189	124.9 Å²	124.9	88%	0.883	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	123.3	177.3	-63.9	-170.4	140.6	0	0	111.4
514	G	55.3	Low	52.3	Low	74 Å²	74	127.1 Å²	127.1	76%	0.763	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.6	-1.3	177.3	0	0	0	0	0	115.4	Q512 A516	Q512-G514 PolarHBondContact O-N 2.91Å; G514-A516 PolarHBondContact O-N 3.35Å
515	A	55.4	Low	50.6	Low	72 Å²	72	125.4 Å²	125.4	60%	0.595	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-60.8	131.1	167	0	0	0	0	0	110.4	Q512	Q512-A515 PolarHBondContact O-N 2.87Å
516	A	49.9	Very low	48.9	Very low	94 Å²	94	120.8 Å²	120.8	78%	0.777	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-68.7	131.7	170.9	0	0	0	0	0	109.1	G514 T518	G514-A516 PolarHBondContact O-N 3.35Å; A516-T518 PolarHBondContact O-N 2.74Å
517	M	45.3	Very low	47.7	Very low	168 Å²	168	120.6 Å²	120.6	83%	0.828	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-54	126.1	169.7	-74.2	-179.1	179.2	0	0	109.1	L519	M517-L519 PolarHBondContact O-N 3.27Å
518	T	42.1	Very low	46.9	Very low	116 Å²	116	113.3 Å²	113.3	71%	0.712	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-62.2	119.9	168.3	44.5	0	0	0	0	108.3	A516 G520	A516-T518 PolarHBondContact O-N 2.74Å; T518-G520 PolarHBondContact O-N 2.73Å
519	L	39.4	Very low	46.3	Very low	185 Å²	185	113 Å²	113	97%	0.969	68%	0.675	S	S	*	*	S	Bend	trans	-68.7	92.6	-172.2	-162.9	93.2	0	0	0	110.5	M517	M517-L519 PolarHBondContact O-N 3.27Å
520	G	42.4	Very low	45.7	Very low	74 Å²	74	110 Å²	110	76%	0.763	65%	0.65	S	S	*	*	S	Bend	trans	86.8	76.4	-174.2	0	0	0	0	0	112.1	T518	T518-G520 PolarHBondContact O-N 2.73Å
521	G	34	Very low	45.4	Very low	48 Å²	48	101.2 Å²	101.2	50%	0.495	63%	0.625	S	S	.	*			trans	-117.1	5.1	-173.1	0	0	0	0	0	116.3	V523	G521-V523 PolarHBondContact O-N 2.79Å
522	S	34.8	Very low	44.6	Very low	117 Å²	117	98.5 Å²	98.5	82%	0.818	61%	0.614	S	S	*	*			trans	-75.4	57.2	165.1	65.9	0	0	0	0	110.3	D524	S522-D524 PolarHBondContact O-N 3.4Å
523	V	35.8	Very low	44.1	Very low	113 Å²	113	92 Å²	92	69%	0.685	59%	0.591	S	S	*	*			trans	-73.2	84.6	154.7	-175.4	0	0	0	0	104.6	G521 V525	G521-V523 PolarHBondContact O-N 2.79Å; V523-V525 VanDerWaalsContact C-N 3.31Å; V523-V525 PolarHBondContact O-N 3.21Å
524	D	39.1	Very low	44	Very low	118 Å²	118	87 Å²	87	63%	0.631	57%	0.568	S	S	*	*			trans	-48.9	111.7	149	-85.5	-17.7	0	0	0	104.5	S522 L526	S522-D524 PolarHBondContact O-N 3.4Å; D524-L526 PolarHBondContact O-N 2.76Å
525	V	40.8	Very low	43.3	Very low	120 Å²	120	88.1 Å²	88.1	73%	0.727	56%	0.56	S	S	*	*			trans	-56.4	119.9	171.6	178.1	0	0	0	0	104.4	V523 A527	V523-V525 VanDerWaalsContact C-N 3.31Å; V523-V525 PolarHBondContact O-N 3.21Å; V525-A527 HydrophobicContact CG1-CB 4.28Å; V525-A527 PolarHBondContact O-N 2.81Å
526	L	40.6	Very low	42.2	Very low	67 Å²	67	92.6 Å²	92.6	35%	0.351	57%	0.569	S	S	.	*			trans	-73.5	54.6	-179.8	-72.8	175.5	0	0	0	110.1	E127 D524 T528	E127-L526 WeakPolarHBondContact OE1-CD2 3.31Å; D524-L526 PolarHBondContact O-N 2.76Å; L526-T528 PolarHBondContact O-N 2.92Å
527	A	43.8	Very low	41.8	Very low	70 Å²	70	95.1 Å²	95.1	58%	0.579	57%	0.565	S	S	*	*			trans	-74.4	113.2	170.1	0	0	0	0	0	107.6	V525 D529	V525-A527 HydrophobicContact CG1-CB 4.28Å; V525-A527 PolarHBondContact O-N 2.81Å; A527-D529 PolarHBondContact O-N 2.89Å
528	T	48.3	Very low	41.6	Very low	7 Å²	7	93.3 Å²	93.3	4%	0.043	55%	0.554	C	S	.	*			trans	-46.7	127.3	146.7	42.9	0	0	0	0	110.1	S104 F105 H109 L526 D530	S104-T528 WeakPolarHBondContact CA-OG1 3.43Å; S104-T528 WeakPolarHBondContact CB-OG1 3.46Å; S104-T528 PolarHBondContact OG-OG1 2.86Å; F105-T528 HydrophobicContact CD2-CG2 4.32Å; H109-T528 HydrophobicContact CB-CG2 4.4Å; L526-T528 PolarHBondContact O-N 2.92Å; T528-D530 PolarHBondContact O-N 3.1Å
529	D	47.9	Very low	41.5	Very low	88 Å²	88	95.3 Å²	95.3	47%	0.471	56%	0.555	S	S	.	*			trans	-52.9	110	170.3	-68.7	-33.3	0	0	0	110.1	A527 M534	A527-D529 PolarHBondContact O-N 2.89Å; D529-M534 HydrophobicContact CB-CE 4.2Å
530	D	44.9	Very low	41.9	Very low	48 Å²	48	94 Å²	94	26%	0.257	54%	0.544	S	S	.	.			trans	-78.7	122.3	168.6	-83.3	-47	0	0	0	108.4	N51 S104 T528 D532 A533 M534	N51-D530 PolarHBondContact ND2-OD1 3.49Å; S104-D530 WeakPolarHBondContact CB-OD1 3.38Å; T528-D530 PolarHBondContact O-N 3.1Å; D530-D532 PolarHBondContact O-N 2.82Å; D530-A533 HydrophobicContact CB-CB 3.76Å; D530-A533 WeakPolarHBondContact O-CB 3.49Å; D530-A533 PolarHBondContact O-N 3.19Å; D530-M534 PolarHBondContact O-N 2.8Å; D530-M534 VanDerWaalsContact O-N 3.13Å
531	P	50.7	Low	42.4	Very low	61 Å²	61	92.6 Å²	92.6	40%	0.396	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-29	-178.6	25.1	-33.6	0	0	0	112.3	M534 T535	P531-M534 PolarHBondContact O-N 2.92Å; P531-T535 PolarHBondContact O-OG1 2.8Å
532	D	44.9	Very low	43.6	Very low	67 Å²	67	94.9 Å²	94.9	36%	0.358	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-37.7	173	-65.8	-1.3	0	0	0	111	R55 D530 M534 T535	R55-D532 IonicContact CZ-OD2 3.8Å; R55-D532 VanDerWaalsContact CZ-OD2 3.25Å; R55-D532 IonicContact NH1-OD2 3.55Å; R55-D532 PolarHBondContact NH1-OD2 3.09Å; R55-D532 IonicContact NH2-OD2 2.64Å; R55-D532 PolarHBondContact NH2-OD2 3.48Å; D530-D532 PolarHBondContact O-N 2.82Å; D532-M534 VanDerWaalsContact C-N 3.33Å; D532-M534 PolarHBondContact O-N 3.03Å; D532-T535 VanDerWaalsContact O-CB 3.25Å; D532-T535 WeakPolarHBondContact O-CB 3.3Å; D532-T535 PolarHBondContact O-N 3.44Å
533	A	46.6	Very low	44.9	Very low	37 Å²	37	91.3 Å²	91.3	31%	0.306	49%	0.488	S	S	.	.	H	α-helix	trans	-66.2	-34.1	176.5	0	0	0	0	0	111.9	D530 T535 E536 E537	D530-A533 HydrophobicContact CB-CB 3.76Å; D530-A533 WeakPolarHBondContact O-CB 3.49Å; D530-A533 PolarHBondContact O-N 3.19Å; A533-T535 PolarHBondContact O-N 2.9Å; A533-T535 VanDerWaalsContact O-N 3.14Å; A533-E536 PolarHBondContact O-N 2.88Å; A533-E537 WeakPolarHBondContact O-CB 3.37Å; A533-E537 WeakPolarHBondContact O-CG 3.43Å; A533-E537 PolarHBondContact O-N 2.9Å
534	M	42.3	Very low	46.4	Very low	82 Å²	82	89.9 Å²	89.9	40%	0.404	47%	0.471	S	S	.	.	H	α-helix	trans	-62	-18.9	170.8	-75	-160.1	169.9	0	0	113.9	D529 D530 P531 D532 H538	D529-M534 HydrophobicContact CB-CE 4.2Å; D530-M534 PolarHBondContact O-N 2.8Å; D530-M534 VanDerWaalsContact O-N 3.13Å; P531-M534 PolarHBondContact O-N 2.92Å; D532-M534 VanDerWaalsContact C-N 3.33Å; D532-M534 PolarHBondContact O-N 3.03Å; M534-H538 PolarHBondContact O-N 2.65Å; M534-H538 PolarHBondContact O-ND1 3.28Å
535	T	40.7	Very low	47.7	Very low	98 Å²	98	87.9 Å²	87.9	60%	0.601	46%	0.458	S	S	*	.	H	α-helix	trans	-80.9	-27.5	175.6	-47.5	0	0	0	0	111.7	P531 D532 A533	P531-T535 PolarHBondContact O-OG1 2.8Å; D532-T535 VanDerWaalsContact O-CB 3.25Å; D532-T535 WeakPolarHBondContact O-CB 3.3Å; D532-T535 PolarHBondContact O-N 3.44Å; A533-T535 PolarHBondContact O-N 2.9Å; A533-T535 VanDerWaalsContact O-N 3.14Å
536	E	32.6	Very low	48.6	Very low	167 Å²	167	88.7 Å²	88.7	78%	0.78	45%	0.451	S	S	*	.	H	α-helix	trans	-92.7	-31.7	174.5	-63.2	-170.4	160.6	0	0	112.5	A533 H538 E539	A533-E536 PolarHBondContact O-N 2.88Å; E536-H538 PolarHBondContact O-N 3.35Å; E536-H538 VanDerWaalsContact O-N 3.14Å; E536-E539 PolarHBondContact O-N 3.15Å
537	E	41.6	Very low	49.4	Very low	147 Å²	147	89.3 Å²	89.3	69%	0.687	45%	0.452	S	S	*	.			trans	-72.1	6.5	167.5	-67.8	-169.7	167.6	0	0	113.2	A533 E539	A533-E537 WeakPolarHBondContact O-CB 3.37Å; A533-E537 WeakPolarHBondContact O-CG 3.43Å; A533-E537 PolarHBondContact O-N 2.9Å; E537-E539 PolarHBondContact O-N 2.66Å
538	H	40.7	Very low	50.3	Low	130 Å²	130	88.2 Å²	88.2	60%	0.602	44%	0.437	S	S	*	.			trans	-69.2	29.5	152.1	-72.6	-25.9	0	0	0	113	M534 E536 E540	M534-H538 PolarHBondContact O-N 2.65Å; M534-H538 PolarHBondContact O-ND1 3.28Å; E536-H538 PolarHBondContact O-N 3.35Å; E536-H538 VanDerWaalsContact O-N 3.14Å; H538-E540 PolarHBondContact O-N 3.44Å; H538-E540 VanDerWaalsContact O-N 3.09Å
539	E	40.4	Very low	50.8	Low	158 Å²	158	93.8 Å²	93.8	74%	0.738	47%	0.466	S	S	*	.	S	Bend	trans	-50.6	117.9	150.3	-81.2	-155.3	159.4	0	0	107.8	E536 E537 L541	E536-E539 PolarHBondContact O-N 3.15Å; E537-E539 PolarHBondContact O-N 2.66Å; E539-L541 PolarHBondContact O-N 3.34Å; E539-L541 VanDerWaalsContact O-N 3.1Å
540	E	46.8	Very low	51.4	Low	158 Å²	158	93.1 Å²	93.1	74%	0.738	46%	0.462	S	S	*	.			trans	-44.1	118.2	-168.7	-57.6	178.9	148.3	0	0	112.5	H538 Q542	H538-E540 PolarHBondContact O-N 3.44Å; H538-E540 VanDerWaalsContact O-N 3.09Å; E540-Q542 VanDerWaalsContact O-CG 3.29Å; E540-Q542 WeakPolarHBondContact O-CG 3.49Å; E540-Q542 PolarHBondContact O-N 2.66Å
541	L	53.3	Low	52.2	Low	43 Å²	43	92 Å²	92	23%	0.225	46%	0.456	C	S	.	.			trans	-48.8	110.9	173.9	-83.6	-172.8	0	0	0	110.5	K282 E539 I543 K569	K282-L541 PolarHBondContact NZ-O 2.84Å; E539-L541 PolarHBondContact O-N 3.34Å; E539-L541 VanDerWaalsContact O-N 3.1Å; L541-I543 PolarHBondContact O-N 3.24Å; L541-I543 VanDerWaalsContact O-N 3.13Å; L541-K569 HydrophobicContact CD1-CD 3.62Å; L541-K569 VanDerWaalsContact CD1-NZ 3.3Å
542	Q	58.8	Low	52.6	Low	97 Å²	97	90.6 Å²	90.6	45%	0.453	44%	0.444	S	S	.	.			trans	-76.6	103.9	-177.4	-58.5	-167	-6.4	0	0	107.3	E540 Y544 S563	E540-Q542 VanDerWaalsContact O-CG 3.29Å; E540-Q542 WeakPolarHBondContact O-CG 3.49Å; E540-Q542 PolarHBondContact O-N 2.66Å; Q542-Y544 PolarHBondContact O-N 2.75Å; Q542-Y544 VanDerWaalsContact O-N 3.13Å; Q542-S563 WeakPolarHBondContact O-CB 3.47Å
543	I	62.5	Low	53.2	Low	42 Å²	42	87.9 Å²	87.9	22%	0.215	43%	0.432	C	S	.	.	S	Bend	trans	-52.3	-36.8	-178.6	-61.4	171.8	0	0	0	110.5	K282 L541 L562 S563 F566	K282-I543 HydrophobicContact CB-CD1 4Å; K282-I543 HydrophobicContact CB-CG1 4.41Å; K282-I543 HydrophobicContact CD-CD1 4.31Å; K282-I543 HydrophobicContact CD-CG1 4.31Å; K282-I543 HydrophobicContact CG-CD1 4.03Å; L541-I543 PolarHBondContact O-N 3.24Å; L541-I543 VanDerWaalsContact O-N 3.13Å; I543-L562 HydrophobicContact CG2-CD2 4.07Å; I543-L562 WeakPolarHBondContact O-CA 3.42Å; I543-L562 WeakPolarHBondContact O-CD2 3.39Å; I543-S563 PolarHBondContact O-N 2.95Å; I543-F566 HydrophobicContact CG1-CD2 4.43Å; I543-F566 HydrophobicContact CG1-CE2 4.17Å; I543-F566 HydrophobicContact CG2-CD1 4.34Å; I543-F566 HydrophobicContact CG2-CE1 4.03Å; I543-F566 HydrophobicContact CG2-CE2 4.32Å; I543-F566 HydrophobicContact CG2-CZ 4.02Å
544	Y	67.6	Low	53.5	Low	82 Å²	82	92.5 Å²	92.5	32%	0.322	46%	0.462	S	S	.	.	B	Isolated β-bridge	trans	-111	142.5	177.8	-56	-69.4	0	0	0	110.6	Q542 K560 I561 L562	Q542-Y544 PolarHBondContact O-N 2.75Å; Q542-Y544 VanDerWaalsContact O-N 3.13Å; Y544-K560 HydrophobicContact CD1-CB 3.25Å; Y544-K560 HydrophobicContact CD1-CD 4.08Å; Y544-K560 HydrophobicContact CD1-CG 4.32Å; Y544-K560 HydrophobicContact CD2-CB 4.42Å; Y544-K560 HydrophobicContact CD2-CD 3.79Å; Y544-K560 HydrophobicContact CE1-CB 3.54Å; Y544-K560 HydrophobicContact CE1-CD 4.06Å; Y544-K560 HydrophobicContact CE1-CG 4.47Å; Y544-K560 HydrophobicContact CE2-CD 3.8Å; Y544-K560 HydrophobicContact CG-CB 3.73Å; Y544-K560 HydrophobicContact CG-CD 3.92Å; Y544-K560 HydrophobicContact CG-CG 4.44Å; Y544-I561 CarbonylContact C-O 3.47Å; Y544-I561 VanDerWaalsContact CA-O 3.26Å; Y544-I561 WeakPolarHBondContact CA-O 3.18Å; Y544-L562 HydrophobicContact CD1-CD2 3.97Å; Y544-L562 HydrophobicContact CE1-CD2 3.82Å
545	E	65.2	Low	54	Low	77 Å²	77	96.2 Å²	96.2	36%	0.36	48%	0.476	S	S	.	.			trans	-60.8	144.2	169.8	-169.1	169.3	-149.5	0	0	110	H547 H552 I561	E545-H547 PolarHBondContact O-N 3.36Å; E545-H552 IonicContact OE2-CE1 3.21Å; E545-I561 PolarHBondContact N-O 3Å
546	K	61.1	Low	54.3	Low	136 Å²	136	99.6 Å²	99.6	59%	0.591	48%	0.482	S	S	*	.			trans	-59.3	115.2	178.3	-71.8	-179.1	-177.6	171.7	0	108.4	N548	K546-N548 PolarHBondContact O-N 3.36Å
547	H	56.6	Low	55.1	Low	81 Å²	81	100.8 Å²	100.8	38%	0.375	49%	0.485	S	S	.	.			trans	-67.5	92.6	-169.3	-175.7	81.9	0	0	0	111.6	E545 N549 H552	E545-H547 PolarHBondContact O-N 3.36Å; H547-N549 PolarHBondContact O-N 3.49Å; H547-H552 AromaticContact CE1-CD2 3.89Å; H547-H552 AromaticContact CE1-CG 3.97Å; H547-H552 AromaticContact CG-CD2 3.82Å; H547-H552 AromaticContact ND1-CD2 3.31Å; H547-H552 PolarHBondContact ND1-CD2 2.9Å; H547-H552 VanDerWaalsContact ND1-CD2 3.31Å; H547-H552 AromaticContact ND1-CG 3.71Å
548	N	62.9	Low	55.6	Low	47 Å²	47	102.2 Å²	102.2	25%	0.251	49%	0.489	S	S	.	.			trans	-81.4	113.6	174.2	-75.2	-31.4	0	0	0	109.5	Y506 K546 L550 L551 H552	Y506-N548 HydrophobicContact CE2-CB 4.31Å; Y506-N548 WeakPolarHBondContact CE2-ND2 3.23Å; Y506-N548 PolarHBondContact OH-ND2 3.06Å; K546-N548 PolarHBondContact O-N 3.36Å; N548-L550 PolarHBondContact O-N 3.39Å; N548-L550 VanDerWaalsContact O-N 3.09Å; N548-L551 HydrophobicContact CB-CB 4.06Å; N548-L551 PolarHBondContact O-N 3.14Å; N548-H552 PolarHBondContact N-CD2 3.31Å; N548-H552 VanDerWaalsContact N-CD2 3.33Å; N548-H552 PolarHBondContact O-CD2 3.48Å; N548-H552 VanDerWaalsContact O-CD2 3.25Å; N548-H552 PolarHBondContact O-N 3.14Å
549	N	59	Low	56.2	Low	124 Å²	124	99.8 Å²	99.8	66%	0.663	48%	0.48	S	S	*	.	H	α-helix	trans	-53.1	-31.6	175.2	-69.3	-7.6	0	0	0	112.1	H547 L551 G553	H547-N549 PolarHBondContact O-N 3.49Å; N549-L551 VanDerWaalsContact C-N 3.32Å; N549-G553 VanDerWaalsContact O-CA 3.32Å; N549-G553 WeakPolarHBondContact O-CA 3.05Å; N549-G553 PolarHBondContact O-N 3.35Å; N549-G553 VanDerWaalsContact O-N 3.11Å
550	L	60	Low	57.4	Low	74 Å²	74	97.2 Å²	97.2	39%	0.387	47%	0.467	S	S	.	.	H	α-helix	trans	-80.9	-3	177.9	-149.9	79.2	0	0	0	114.1	R502 R505 N548	R502-L550 WeakPolarHBondContact CD-O 3.44Å; R502-L550 WeakPolarHBondContact CG-O 3.41Å; R505-L550 HydrophobicContact CB-CD2 4.29Å; R505-L550 WeakPolarHBondContact O-CD2 3.08Å; N548-L550 PolarHBondContact O-N 3.39Å; N548-L550 VanDerWaalsContact O-N 3.09Å
551	L	60.9	Low	58.5	Low	25 Å²	25	91.3 Å²	91.3	13%	0.131	44%	0.44	C	S	.	.	H	α-helix	trans	-112.1	-49.8	174	-148.3	84.9	0	0	0	110.6	R502 M503 Y506 N548 N549	R502-L551 WeakPolarHBondContact CD-O 3.35Å; R502-L551 PolarHBondContact NH1-O 2.88Å; M503-L551 HydrophobicContact SD-CD1 3.78Å; M503-L551 HydrophobicContact SD-CG 4.16Å; Y506-L551 HydrophobicContact CD1-CD1 4.1Å; Y506-L551 HydrophobicContact CD2-CB 4.46Å; Y506-L551 HydrophobicContact CD2-CD1 3.51Å; Y506-L551 HydrophobicContact CE2-CD1 4.16Å; Y506-L551 HydrophobicContact CG-CD1 3.47Å; Y506-L551 VanDerWaalsContact CG-CD1 3.47Å; N548-L551 HydrophobicContact CB-CB 4.06Å; N548-L551 PolarHBondContact O-N 3.14Å; N549-L551 VanDerWaalsContact C-N 3.32Å
552	H	60.8	Low	59.4	Low	31 Å²	31	89.3 Å²	89.3	14%	0.144	43%	0.43	C	S	.	.	H	α-helix	trans	-84.4	-16.1	-176.8	-46.9	-63.7	0	0	0	113.5	R502 E545 H547 N548 I561	R502-H552 VanDerWaalsContact NH1-C 3.32Å; R502-H552 PolarHBondContact NH1-O 3.1Å; E545-H552 IonicContact OE2-CE1 3.21Å; H547-H552 AromaticContact CE1-CD2 3.89Å; H547-H552 AromaticContact CE1-CG 3.97Å; H547-H552 AromaticContact CG-CD2 3.82Å; H547-H552 AromaticContact ND1-CD2 3.31Å; H547-H552 PolarHBondContact ND1-CD2 2.9Å; H547-H552 VanDerWaalsContact ND1-CD2 3.31Å; H547-H552 AromaticContact ND1-CG 3.71Å; N548-H552 PolarHBondContact N-CD2 3.31Å; N548-H552 VanDerWaalsContact N-CD2 3.33Å; N548-H552 PolarHBondContact O-CD2 3.48Å; N548-H552 VanDerWaalsContact O-CD2 3.25Å; N548-H552 PolarHBondContact O-N 3.14Å; H552-I561 VanDerWaalsContact ND1-CD1 3.3Å; H552-I561 WeakPolarHBondContact ND1-CD1 3.49Å
553	G	56.8	Low	60.3	Low	10 Å²	10	86.1 Å²	86.1	10%	0.103	42%	0.418	C	S	.	.			trans	77.2	-175.2	179.2	0	0	0	0	0	113.8	N549 K555	N549-G553 VanDerWaalsContact O-CA 3.32Å; N549-G553 WeakPolarHBondContact O-CA 3.05Å; N549-G553 PolarHBondContact O-N 3.35Å; N549-G553 VanDerWaalsContact O-N 3.11Å; G553-K555 VanDerWaalsContact C-N 3.34Å; G553-K555 PolarHBondContact O-N 3.19Å
554	S	52.3	Low	60.9	Low	133 Å²	133	90.1 Å²	90.1	93%	0.93	43%	0.434	S	S	*	.	S	Bend	trans	-84.4	0.5	-171.9	-142.9	0	0	0	0	114.9	K556	S554-K556 PolarHBondContact O-N 2.63Å
555	K	52.4	Low	61.3	Low	160 Å²	160	91 Å²	91	70%	0.696	44%	0.441	S	S	*	.	S	Bend	trans	-77.5	118.7	179.9	-75.5	-178.1	179.4	171.7	0	109.7	E495 G553	E495-K555 IonicContact OE1-NZ 3.67Å; G553-K555 VanDerWaalsContact C-N 3.34Å; G553-K555 PolarHBondContact O-N 3.19Å
556	K	48.7	Very low	62.1	Low	169 Å²	169	87.6 Å²	87.6	74%	0.735	43%	0.425	S	S	*	.			trans	17	125.6	171.8	-65.8	178.7	-178.8	173.5	0	118.2	S554 K558 D559	S554-K556 PolarHBondContact O-N 2.63Å; K556-K558 PolarHBondContact O-N 3.44Å; K556-D559 PolarHBondContact O-N 3.13Å
557	K	49.6	Very low	63	Low	193 Å²	193	81.1 Å²	81.1	84%	0.839	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	1.6	167.2	-69.1	-179.3	174.4	177.7	0	117.7
558	K	50.3	Low	64.2	Low	176 Å²	176	82.1 Å²	82.1	77%	0.765	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-29.2	177.8	-67.5	-168.3	174.6	-170.9	0	112.8	K556 K560	K556-K558 PolarHBondContact O-N 3.44Å; K558-K560 PolarHBondContact O-N 3.48Å
559	D	54.4	Low	65	Low	80 Å²	80	81.5 Å²	81.5	43%	0.428	39%	0.392	S	S	.	.			trans	-87	77.1	-173.4	-70.6	10.6	0	0	0	110.9	R300 K556	R300-D559 IonicContact NH1-OD2 3.9Å; K556-D559 PolarHBondContact O-N 3.13Å
560	K	64.7	Low	66.3	Low	103 Å²	103	75.6 Å²	75.6	45%	0.448	36%	0.361	S	S	.	.			trans	-86.2	109.9	-179.7	-57	-178.1	-180	-179.1	0	111.4	Q297 Y544 K558	Q297-K560 PolarHBondContact NE2-O 3.45Å; Y544-K560 HydrophobicContact CD1-CB 3.25Å; Y544-K560 HydrophobicContact CD1-CD 4.08Å; Y544-K560 HydrophobicContact CD1-CG 4.32Å; Y544-K560 HydrophobicContact CD2-CB 4.42Å; Y544-K560 HydrophobicContact CD2-CD 3.79Å; Y544-K560 HydrophobicContact CE1-CB 3.54Å; Y544-K560 HydrophobicContact CE1-CD 4.06Å; Y544-K560 HydrophobicContact CE1-CG 4.47Å; Y544-K560 HydrophobicContact CE2-CD 3.8Å; Y544-K560 HydrophobicContact CG-CB 3.73Å; Y544-K560 HydrophobicContact CG-CD 3.92Å; Y544-K560 HydrophobicContact CG-CG 4.44Å; K558-K560 PolarHBondContact O-N 3.48Å
561	I	69.6	Low	67.5	Low	34 Å²	34	72.4 Å²	72.4	17%	0.174	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-70.2	139.3	177.1	-56.1	-164.6	0	0	0	110.3	P304 Y544 E545 H552	P304-I561 HydrophobicContact CB-CD1 4.17Å; Y544-I561 CarbonylContact C-O 3.47Å; Y544-I561 VanDerWaalsContact CA-O 3.26Å; Y544-I561 WeakPolarHBondContact CA-O 3.18Å; E545-I561 PolarHBondContact N-O 3Å; H552-I561 VanDerWaalsContact ND1-CD1 3.3Å; H552-I561 WeakPolarHBondContact ND1-CD1 3.49Å
562	L	73.3	Confident	68.5	Low	2 Å²	2	72.9 Å²	72.9	1%	0.01	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-80.1	143	178.6	-63.5	168.4	0	0	0	111.6	F286 L298 S301 I543 Y544 F566 M567	F286-L562 HydrophobicContact CE1-CD1 4.04Å; F286-L562 HydrophobicContact CE1-CD2 4.45Å; F286-L562 HydrophobicContact CE2-CD2 3.82Å; F286-L562 HydrophobicContact CZ-CD1 3.72Å; F286-L562 HydrophobicContact CZ-CD2 3.81Å; F286-L562 HydrophobicContact CZ-CG 4.3Å; L298-L562 HydrophobicContact CD2-CD1 3.55Å; L298-L562 HydrophobicContact CG-CD1 4.2Å; S301-L562 PolarHBondContact OG-N 3.25Å; S301-L562 VanDerWaalsContact OG-N 3.15Å; I543-L562 HydrophobicContact CG2-CD2 4.07Å; I543-L562 WeakPolarHBondContact O-CA 3.42Å; I543-L562 WeakPolarHBondContact O-CD2 3.39Å; Y544-L562 HydrophobicContact CD1-CD2 3.97Å; Y544-L562 HydrophobicContact CE1-CD2 3.82Å; L562-F566 HydrophobicContact CD2-CD1 4.06Å; L562-F566 HydrophobicContact CD2-CE1 4.1Å; L562-M567 HydrophobicContact CB-CG 3.79Å; L562-M567 HydrophobicContact CB-SD 4.22Å; L562-M567 HydrophobicContact CD1-CG 4.31Å; L562-M567 HydrophobicContact CD1-SD 4.04Å
563	S	77.9	Confident	69.6	Low	30 Å²	30	72.9 Å²	72.9	21%	0.21	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-62.3	140.9	171.8	173.4	0	0	0	0	111.4	Q542 I543 E565 F566 M567	Q542-S563 WeakPolarHBondContact O-CB 3.47Å; I543-S563 PolarHBondContact O-N 2.95Å; S563-E565 PolarHBondContact O-N 2.77Å; S563-E565 PolarHBondContact OG-N 3.33Å; S563-F566 PolarHBondContact O-N 2.88Å; S563-M567 WeakPolarHBondContact O-CG 3.3Å; S563-M567 PolarHBondContact O-N 2.89Å
564	K	74.8	Confident	71	Confident	125 Å²	125	72.4 Å²	72.4	54%	0.543	34%	0.341	S	S	.	.	H	α-helix	trans	-57.5	-37.5	178.2	-65.3	177.9	-175.4	166.1	0	112.4	Y356 M567 R568	Y356-K564 WeakPolarHBondContact OH-CE 3.47Å; K564-M567 PolarHBondContact O-N 2.99Å; K564-R568 WeakPolarHBondContact O-CB 3.18Å; K564-R568 PolarHBondContact O-N 3.44Å
565	E	76.6	Confident	72.5	Confident	102 Å²	102	69.3 Å²	69.3	48%	0.477	31%	0.311	S	S	.	.	H	α-helix	trans	-70.6	-41.5	179	-61.8	-172.7	151.9	0	0	112.1	S563 M567 R568 K569	S563-E565 PolarHBondContact O-N 2.77Å; S563-E565 PolarHBondContact OG-N 3.33Å; E565-M567 VanDerWaalsContact C-N 3.33Å; E565-R568 PolarHBondContact O-N 2.95Å; E565-K569 PolarHBondContact O-N 3.49Å
566	F	81	Confident	74.1	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-42.3	173.2	-178.2	-96.4	0	0	0	110.8	K282 I283 F286 I543 L562 S563 R568 K569 Y570	K282-F566 HydrophobicContact CB-CE2 4.46Å; I283-F566 HydrophobicContact CD1-CE2 4.49Å; I283-F566 HydrophobicContact CG1-CD2 4.5Å; I283-F566 HydrophobicContact CG1-CE2 3.6Å; I283-F566 HydrophobicContact CG1-CZ 3.8Å; F286-F566 HydrophobicContact CB-CZ 4.26Å; F286-F566 HydrophobicContact CD1-CE1 4.13Å; F286-F566 HydrophobicContact CD1-CZ 4.43Å; F286-F566 HydrophobicContact CG-CE1 4.31Å; F286-F566 HydrophobicContact CG-CZ 4.34Å; I543-F566 HydrophobicContact CG1-CD2 4.43Å; I543-F566 HydrophobicContact CG1-CE2 4.17Å; I543-F566 HydrophobicContact CG2-CD1 4.34Å; I543-F566 HydrophobicContact CG2-CE1 4.03Å; I543-F566 HydrophobicContact CG2-CE2 4.32Å; I543-F566 HydrophobicContact CG2-CZ 4.02Å; L562-F566 HydrophobicContact CD2-CD1 4.06Å; L562-F566 HydrophobicContact CD2-CE1 4.1Å; S563-F566 PolarHBondContact O-N 2.88Å; F566-R568 PolarHBondContact O-N 3.03Å; F566-K569 PolarHBondContact O-N 3.39Å; F566-Y570 HydrophobicContact CE1-CD2 4.43Å; F566-Y570 VanDerWaalsContact O-CB 3.28Å; F566-Y570 WeakPolarHBondContact O-CB 3.27Å; F566-Y570 PolarHBondContact O-N 2.77Å
567	M	81.1	Confident	75.9	Confident	1 Å²	1	61 Å²	61	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-42.7	173.6	-68.5	-119.7	-62.4	0	0	112.5	L298 S301 L302 L562 S563 K564 E565 Y570 I571	L298-M567 HydrophobicContact CD2-SD 3.7Å; S301-M567 WeakPolarHBondContact O-CE 3.42Å; L302-M567 HydrophobicContact CB-CE 4.23Å; L302-M567 HydrophobicContact CD1-CE 4.05Å; L562-M567 HydrophobicContact CB-CG 3.79Å; L562-M567 HydrophobicContact CB-SD 4.22Å; L562-M567 HydrophobicContact CD1-CG 4.31Å; L562-M567 HydrophobicContact CD1-SD 4.04Å; S563-M567 WeakPolarHBondContact O-CG 3.3Å; S563-M567 PolarHBondContact O-N 2.89Å; K564-M567 PolarHBondContact O-N 2.99Å; E565-M567 VanDerWaalsContact C-N 3.33Å; M567-Y570 PolarHBondContact O-N 2.72Å; M567-I571 WeakPolarHBondContact O-CB 3.46Å; M567-I571 VanDerWaalsContact O-CG1 3.3Å; M567-I571 WeakPolarHBondContact O-CG1 3.47Å; M567-I571 PolarHBondContact O-N 3.14Å
568	R	80.3	Confident	77.7	Confident	101 Å²	101	56.4 Å²	56.4	38%	0.381	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-45.7	176.6	-172.1	175.4	58.3	167.8	-3.6	111.5	Q273 K564 E565 F566 H572	Q273-R568 VanDerWaalsContact NE2-NE 3.11Å; K564-R568 WeakPolarHBondContact O-CB 3.18Å; K564-R568 PolarHBondContact O-N 3.44Å; E565-R568 PolarHBondContact O-N 2.95Å; F566-R568 PolarHBondContact O-N 3.03Å; R568-H572 PolarHBondContact O-N 2.81Å; R568-H572 VanDerWaalsContact O-N 3.12Å
569	K	81.4	Confident	79.6	Confident	34 Å²	34	48.4 Å²	48.4	15%	0.148	24%	0.235	C	C	.	.	H	α-helix	trans	-59.3	-44.7	172.1	-80.9	-178.2	171.7	-168.5	0	111.6	F275 D279 I283 L541 E565 F566 H572 I573	F275-K569 HydrophobicContact CE1-CB 4.25Å; F275-K569 HydrophobicContact CE1-CG 4.22Å; D279-K569 IonicContact OD2-NZ 2.72Å; D279-K569 PolarHBondContact OD2-NZ 3.1Å; I283-K569 HydrophobicContact CD1-CB 4.3Å; L541-K569 HydrophobicContact CD1-CD 3.62Å; L541-K569 VanDerWaalsContact CD1-NZ 3.3Å; E565-K569 PolarHBondContact O-N 3.49Å; F566-K569 PolarHBondContact O-N 3.39Å; K569-H572 PolarHBondContact O-N 2.71Å; K569-I573 PolarHBondContact O-N 3.03Å; K569-I573 VanDerWaalsContact O-N 3.16Å
570	Y	85.1	Confident	81.4	Confident	1 Å²	1	49.5 Å²	49.5	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-49.3	-180	-168.6	-89.7	0	0	0	112.6	I283 F286 L298 F566 M567 H572 I573 A574 A630 M632	I283-Y570 HydrophobicContact CG1-CD2 4.34Å; I283-Y570 HydrophobicContact CG2-CD2 3.79Å; I283-Y570 HydrophobicContact CG2-CE2 3.95Å; F286-Y570 HydrophobicContact CD1-CD2 4.28Å; F286-Y570 AromaticContact CD1-CE2 3.82Å; F286-Y570 HydrophobicContact CD1-CE2 3.82Å; F286-Y570 HydrophobicContact CE1-CE2 4.39Å; L298-Y570 HydrophobicContact CD1-CD1 4.2Å; L298-Y570 HydrophobicContact CD1-CE1 3.71Å; L298-Y570 HydrophobicContact CD2-CD1 4.1Å; L298-Y570 HydrophobicContact CD2-CE1 4.37Å; F566-Y570 HydrophobicContact CE1-CD2 4.43Å; F566-Y570 VanDerWaalsContact O-CB 3.28Å; F566-Y570 WeakPolarHBondContact O-CB 3.27Å; F566-Y570 PolarHBondContact O-N 2.77Å; M567-Y570 PolarHBondContact O-N 2.72Å; Y570-H572 VanDerWaalsContact C-N 3.29Å; Y570-H572 PolarHBondContact O-N 3.48Å; Y570-I573 PolarHBondContact O-N 3.03Å; Y570-A574 VanDerWaalsContact O-CB 3.31Å; Y570-A574 WeakPolarHBondContact O-CB 3.48Å; Y570-A574 PolarHBondContact O-N 2.8Å; Y570-A630 PolarHBondContact OH-O 3.02Å; Y570-M632 HydrophobicContact CD1-CE 4.4Å; Y570-M632 HydrophobicContact CD2-CE 3.87Å; Y570-M632 HydrophobicContact CE1-CE 4.14Å; Y570-M632 HydrophobicContact CE2-CE 3.57Å; Y570-M632 HydrophobicContact CE2-SD 4.06Å; Y570-M632 HydrophobicContact CG-CE 4.26Å
571	I	85.2	Confident	82.6	Confident	6 Å²	6	47 Å²	47	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-39.4	177.8	-69.4	165.6	0	0	0	110.5	L320 L321 M567 A574 K575	L320-I571 HydrophobicContact CD1-CD1 4.4Å; L321-I571 HydrophobicContact CD2-CG1 4.41Å; L321-I571 HydrophobicContact CD2-CG2 4.36Å; M567-I571 WeakPolarHBondContact O-CB 3.46Å; M567-I571 VanDerWaalsContact O-CG1 3.3Å; M567-I571 WeakPolarHBondContact O-CG1 3.47Å; M567-I571 PolarHBondContact O-N 3.14Å; I571-A574 PolarHBondContact O-N 2.89Å; I571-K575 WeakPolarHBondContact O-CB 3.43Å; I571-K575 WeakPolarHBondContact O-CG 3.4Å; I571-K575 PolarHBondContact O-N 3.35Å
572	H	82.9	Confident	83.7	Confident	35 Å²	35	47.6 Å²	47.6	16%	0.162	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-48.9	176.9	-170.4	96.7	0	0	0	112.1	E270 F275 R568 K569 Y570 K575	E270-H572 PolarHBondContact O-CE1 3.34Å; E270-H572 PolarHBondContact O-ND1 3.37Å; F275-H572 AromaticContact CE2-CD2 3.83Å; F275-H572 HydrophobicContact CZ-CB 4.28Å; F275-H572 AromaticContact CZ-CD2 3.58Å; R568-H572 PolarHBondContact O-N 2.81Å; R568-H572 VanDerWaalsContact O-N 3.12Å; K569-H572 PolarHBondContact O-N 2.71Å; Y570-H572 VanDerWaalsContact C-N 3.29Å; Y570-H572 PolarHBondContact O-N 3.48Å; H572-K575 PolarHBondContact O-N 3.44Å
573	I	83.9	Confident	84.6	Confident	32 Å²	32	55.4 Å²	55.4	16%	0.164	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-44.1	176.8	-63.5	-174.3	0	0	0	111	F275 V280 I283 K569 Y570 K575 I576 M632	F275-I573 HydrophobicContact CD1-CD1 3.87Å; F275-I573 HydrophobicContact CD1-CG1 4.26Å; F275-I573 HydrophobicContact CE1-CD1 3.73Å; F275-I573 HydrophobicContact CE1-CG1 3.66Å; F275-I573 HydrophobicContact CE2-CG1 4.43Å; F275-I573 HydrophobicContact CZ-CD1 4.3Å; F275-I573 HydrophobicContact CZ-CG1 3.76Å; V280-I573 HydrophobicContact CG2-CD1 4.44Å; I283-I573 HydrophobicContact CD1-CD1 3.67Å; I283-I573 HydrophobicContact CG2-CD1 4.39Å; K569-I573 PolarHBondContact O-N 3.03Å; K569-I573 VanDerWaalsContact O-N 3.16Å; Y570-I573 PolarHBondContact O-N 3.03Å; I573-K575 VanDerWaalsContact C-N 3.29Å; I573-K575 PolarHBondContact O-N 3.24Å; I573-I576 WeakPolarHBondContact O-CB 3.3Å; I573-I576 PolarHBondContact O-N 2.74Å; I573-I576 VanDerWaalsContact O-N 3.13Å; I573-M632 HydrophobicContact CB-CE 3.98Å; I573-M632 HydrophobicContact CG2-CE 3.7Å; I573-M632 HydrophobicContact CG2-SD 4.47Å
574	A	85.5	Confident	85.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.7	-31.6	-178.9	0	0	0	0	0	113	L321 Y570 I571 I576 I577 M632	L321-A574 HydrophobicContact CD2-CB 3.5Å; L321-A574 VanDerWaalsContact CD2-CB 3.5Å; Y570-A574 VanDerWaalsContact O-CB 3.31Å; Y570-A574 WeakPolarHBondContact O-CB 3.48Å; Y570-A574 PolarHBondContact O-N 2.8Å; I571-A574 PolarHBondContact O-N 2.89Å; A574-I576 VanDerWaalsContact C-N 3.28Å; A574-I576 PolarHBondContact O-N 2.86Å; A574-I577 PolarHBondContact O-N 3.34Å; A574-M632 HydrophobicContact CB-CE 4.09Å
575	K	84.9	Confident	86.1	Confident	68 Å²	68	54.9 Å²	54.9	30%	0.296	27%	0.274	S	S	.	.	H	α-helix	trans	-60.6	-33	173.3	-85.7	-173.4	176.4	-167.1	0	113.7	L320 I571 H572 I573 I577	L320-K575 WeakPolarHBondContact O-CE 3.5Å; I571-K575 WeakPolarHBondContact O-CB 3.43Å; I571-K575 WeakPolarHBondContact O-CG 3.4Å; I571-K575 PolarHBondContact O-N 3.35Å; H572-K575 PolarHBondContact O-N 3.44Å; I573-K575 VanDerWaalsContact C-N 3.29Å; I573-K575 PolarHBondContact O-N 3.24Å; K575-I577 VanDerWaalsContact C-N 3.33Å
576	I	84.7	Confident	86.8	Confident	116 Å²	116	51.8 Å²	51.8	60%	0.595	27%	0.265	S	S	*	.	H	α-helix	trans	-73.9	-26.8	-177.5	-59.7	168.1	0	0	0	111.2	I573 A574	I573-I576 WeakPolarHBondContact O-CB 3.3Å; I573-I576 PolarHBondContact O-N 2.74Å; I573-I576 VanDerWaalsContact O-N 3.13Å; A574-I576 VanDerWaalsContact C-N 3.28Å; A574-I576 PolarHBondContact O-N 2.86Å
577	I	86.1	Confident	87.4	Confident	38 Å²	38	57.1 Å²	57.1	20%	0.195	29%	0.294	C	S	.	.			trans	-72.4	130.1	-178.7	-58.6	174.9	0	0	0	110	A574 K575 P579 K629 M632 S633	A574-I577 PolarHBondContact O-N 3.34Å; K575-I577 VanDerWaalsContact C-N 3.33Å; I577-P579 VanDerWaalsContact O-CD 3.32Å; I577-P579 WeakPolarHBondContact O-CD 3.47Å; I577-K629 WeakPolarHBondContact O-CE 3.28Å; I577-K629 WeakPolarHBondContact O-CG 3.27Å; I577-M632 HydrophobicContact CD1-CB 3.58Å; I577-M632 HydrophobicContact CD1-CG 3.71Å; I577-M632 HydrophobicContact CD1-SD 4.35Å; I577-S633 WeakPolarHBondContact CG2-O 3.42Å
578	T	88.2	Confident	87.9	Confident	96 Å²	96	59 Å²	59	59%	0.589	30%	0.303	S	S	*	.			trans	-113.9	88.2	179.2	42.3	0	0	0	0	110.3	V324	V324-T578 HydrophobicContact CG1-CG2 4.29Å
579	P	91.3	Very high	88.5	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.052	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-69.7	142.9	179.3	27.7	-33.9	0	0	0	111.9	V324 I577 T625 A628 K629 K634 V636	V324-P579 HydrophobicContact CG2-CG 4.38Å; I577-P579 VanDerWaalsContact O-CD 3.32Å; I577-P579 WeakPolarHBondContact O-CD 3.47Å; P579-T625 HydrophobicContact CG-CG2 4.41Å; P579-T625 WeakPolarHBondContact CG-O 3.35Å; P579-A628 HydrophobicContact CB-CB 3.84Å; P579-A628 HydrophobicContact CG-CB 3.98Å; P579-K629 HydrophobicContact CG-CG 4.01Å; P579-K634 WeakPolarHBondContact CA-O 3.47Å; P579-V636 HydrophobicContact CB-CG2 4.16Å
580	V	90.7	Very high	89.1	Confident	104 Å²	104	55.2 Å²	55.2	63%	0.63	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	140.7	175.2	-176.1	0	0	0	0	109.5	K634 A635 V636	V580-K634 PolarHBondContact N-O 2.68Å; V580-A635 WeakPolarHBondContact O-CA 3.41Å; V580-V636 PolarHBondContact O-N 2.71Å
581	L	89.6	Confident	89.4	Confident	50 Å²	50	61.8 Å²	61.8	26%	0.262	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	132.2	176.9	-156.2	77.8	0	0	0	109.7	A586 I589 V636	L581-A586 HydrophobicContact CD2-CB 3.82Å; L581-I589 HydrophobicContact CD1-CD1 4.17Å; L581-V636 HydrophobicContact CD1-CB 4.06Å; L581-V636 HydrophobicContact CD1-CG1 4.09Å; L581-V636 HydrophobicContact CD1-CG2 4.09Å
582	T	93.9	Very high	89.6	Confident	47 Å²	47	62.3 Å²	62.3	29%	0.288	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-84	159	172	57.8	0	0	0	0	110.8	E584 A585 A586 A635 V636	T582-E584 VanDerWaalsContact C-N 3.34Å; T582-A585 PolarHBondContact O-N 3.19Å; T582-A585 WeakPolarHBondContact OG1-CB 2.76Å; T582-A585 PolarHBondContact OG1-N 2.62Å; T582-A586 WeakPolarHBondContact O-CB 3.23Å; T582-A586 PolarHBondContact O-N 3.19Å; T582-A635 HydrophobicContact CG2-CB 4.06Å; T582-V636 VanDerWaalsContact CG2-O 3.23Å; T582-V636 WeakPolarHBondContact CG2-O 3.48Å; T582-V636 PolarHBondContact OG1-O 2.82Å
583	E	91.4	Very high	89.9	Confident	166 Å²	166	62 Å²	62	78%	0.776	33%	0.329	S	S	*	.	H	α-helix	trans	-65.5	-37.5	177.3	-63.7	-175.7	169.7	0	0	111.9	A586 N587	E583-A586 PolarHBondContact O-N 2.93Å; E583-N587 VanDerWaalsContact O-CG 3.28Å; E583-N587 PolarHBondContact O-N 3.38Å; E583-N587 PolarHBondContact O-ND2 2.87Å
584	E	92	Very high	90.1	Very high	144 Å²	144	63.6 Å²	63.6	67%	0.673	34%	0.343	S	S	*	.	H	α-helix	trans	-59.6	-49.9	174.6	-62.8	178.2	175	0	0	111.6	T582 A586 N587 H588	T582-E584 VanDerWaalsContact C-N 3.34Å; E584-A586 VanDerWaalsContact C-N 3.32Å; E584-A586 PolarHBondContact O-N 2.79Å; E584-N587 PolarHBondContact O-N 2.81Å; E584-H588 PolarHBondContact O-N 3.27Å; E584-H588 VanDerWaalsContact O-N 3.09Å
585	A	91.8	Very high	90.1	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-62.1	-38.2	175.4	0	0	0	0	0	112.3	T582 I589 V636 T641	T582-A585 PolarHBondContact O-N 3.19Å; T582-A585 WeakPolarHBondContact OG1-CB 2.76Å; T582-A585 PolarHBondContact OG1-N 2.62Å; A585-I589 WeakPolarHBondContact O-CB 3.34Å; A585-I589 WeakPolarHBondContact O-CD1 3.38Å; A585-I589 VanDerWaalsContact O-CG1 3.22Å; A585-I589 WeakPolarHBondContact O-CG1 3.28Å; A585-I589 PolarHBondContact O-N 2.63Å; A585-V636 HydrophobicContact CB-CG1 4.22Å; A585-T641 HydrophobicContact CB-CG2 3.63Å
586	A	92.6	Very high	90	Very high	37 Å²	37	66.7 Å²	66.7	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-64.8	-43.5	178.5	0	0	0	0	0	112.3	L581 T582 E583 E584 A590	L581-A586 HydrophobicContact CD2-CB 3.82Å; T582-A586 WeakPolarHBondContact O-CB 3.23Å; T582-A586 PolarHBondContact O-N 3.19Å; E583-A586 PolarHBondContact O-N 2.93Å; E584-A586 VanDerWaalsContact C-N 3.32Å; E584-A586 PolarHBondContact O-N 2.79Å; A586-A590 WeakPolarHBondContact O-CB 3.48Å; A586-A590 PolarHBondContact O-N 2.87Å
587	N	93.4	Very high	90	Very high	115 Å²	115	68 Å²	68	62%	0.615	35%	0.351	S	S	*	.	H	α-helix	trans	-63.9	-46.1	177.2	-69.5	-24.4	0	0	0	111.3	E583 E584 I589 A590 E591	E583-N587 VanDerWaalsContact O-CG 3.28Å; E583-N587 PolarHBondContact O-N 3.38Å; E583-N587 PolarHBondContact O-ND2 2.87Å; E584-N587 PolarHBondContact O-N 2.81Å; N587-I589 PolarHBondContact O-N 3.36Å; N587-A590 PolarHBondContact O-N 3.06Å; N587-E591 PolarHBondContact O-N 2.91Å
588	H	92.1	Very high	89.8	Confident	42 Å²	42	69.3 Å²	69.3	19%	0.194	36%	0.364	C	S	.	.	H	α-helix	trans	-62.3	-44	178.1	-174	-120.7	0	0	0	112.4	E584 A590 E591 E592 T641	E584-H588 PolarHBondContact O-N 3.27Å; E584-H588 VanDerWaalsContact O-N 3.09Å; H588-A590 VanDerWaalsContact C-N 3.3Å; H588-A590 PolarHBondContact O-N 2.97Å; H588-E591 PolarHBondContact O-N 2.82Å; H588-E592 WeakPolarHBondContact O-CB 3.26Å; H588-E592 PolarHBondContact O-N 3.19Å; H588-T641 PolarHBondContact ND1-OG1 2.9Å
589	I	92.9	Very high	89.1	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.021	36%	0.355	C	S	.	.	H	α-helix	trans	-60.6	-39.2	174.8	-71.1	166.5	0	0	0	111.5	L581 A585 N587 Y593 L617 L620 I621 T641	L581-I589 HydrophobicContact CD1-CD1 4.17Å; A585-I589 WeakPolarHBondContact O-CB 3.34Å; A585-I589 WeakPolarHBondContact O-CD1 3.38Å; A585-I589 VanDerWaalsContact O-CG1 3.22Å; A585-I589 WeakPolarHBondContact O-CG1 3.28Å; A585-I589 PolarHBondContact O-N 2.63Å; N587-I589 PolarHBondContact O-N 3.36Å; I589-Y593 VanDerWaalsContact O-CB 3.25Å; I589-Y593 WeakPolarHBondContact O-CB 3.38Å; I589-Y593 PolarHBondContact O-N 2.83Å; I589-L617 HydrophobicContact CG2-CD1 3.55Å; I589-L620 HydrophobicContact CG2-CB 4.01Å; I589-L620 HydrophobicContact CG2-CD1 4.29Å; I589-I621 HydrophobicContact CD1-CG1 4.46Å; I589-T641 HydrophobicContact CD1-CG2 3.73Å; I589-T641 HydrophobicContact CG1-CG2 3.81Å
590	A	92.6	Very high	87.9	Confident	51 Å²	51	71.4 Å²	71.4	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-69.2	-41.1	179.2	0	0	0	0	0	112.4	A586 N587 H588 S594	A586-A590 WeakPolarHBondContact O-CB 3.48Å; A586-A590 PolarHBondContact O-N 2.87Å; N587-A590 PolarHBondContact O-N 3.06Å; H588-A590 VanDerWaalsContact C-N 3.3Å; H588-A590 PolarHBondContact O-N 2.97Å; A590-S594 WeakPolarHBondContact O-CB 2.99Å; A590-S594 PolarHBondContact O-N 2.84Å
591	E	91.9	Very high	86.5	Confident	139 Å²	139	74.4 Å²	74.4	65%	0.65	37%	0.374	S	S	*	.	H	α-helix	trans	-63.8	-48.3	174.6	-175.9	170.5	-172.1	0	0	111.4	N587 H588 Y593 S594 R595	N587-E591 PolarHBondContact O-N 2.91Å; H588-E591 PolarHBondContact O-N 2.82Å; E591-Y593 PolarHBondContact O-N 3.44Å; E591-S594 WeakPolarHBondContact O-CB 3.4Å; E591-S594 PolarHBondContact O-N 3.32Å; E591-R595 WeakPolarHBondContact O-CB 3.13Å; E591-R595 PolarHBondContact O-N 2.98Å
592	E	88.4	Confident	85	Confident	17 Å²	17	79.1 Å²	79.1	8%	0.079	40%	0.398	C	S	.	.	H	α-helix	trans	-64.1	-40.4	178.1	-78.6	-63.9	153.7	0	0	113	H588 S594 R595 L596 V645	H588-E592 WeakPolarHBondContact O-CB 3.26Å; H588-E592 PolarHBondContact O-N 3.19Å; E592-S594 VanDerWaalsContact C-N 3.34Å; E592-S594 PolarHBondContact O-N 3.47Å; E592-R595 VanDerWaalsContact CD-CZ 3.45Å; E592-R595 PolarHBondContact O-N 3.4Å; E592-R595 IonicContact OE1-CZ 3.04Å; E592-R595 IonicContact OE1-NE 2.74Å; E592-R595 PolarHBondContact OE1-NE 3.45Å; E592-R595 VanDerWaalsContact OE1-NE 3.15Å; E592-R595 IonicContact OE1-NH1 3.84Å; E592-R595 IonicContact OE1-NH2 2.91Å; E592-R595 PolarHBondContact OE1-NH2 3.39Å; E592-R595 IonicContact OE2-CZ 2.77Å; E592-R595 IonicContact OE2-NE 2.73Å; E592-R595 PolarHBondContact OE2-NE 3.46Å; E592-R595 IonicContact OE2-NH2 3.15Å; E592-R595 PolarHBondContact OE2-NH2 2.82Å; E592-L596 WeakPolarHBondContact O-CB 3.42Å; E592-L596 VanDerWaalsContact O-CG 3.28Å; E592-L596 WeakPolarHBondContact O-CG 3.34Å; E592-L596 PolarHBondContact O-N 3.31Å; E592-V645 HydrophobicContact CB-CG1 4.5Å; E592-V645 HydrophobicContact CB-CG2 3.96Å; E592-V645 HydrophobicContact CG-CG1 4.25Å; E592-V645 HydrophobicContact CG-CG2 4.03Å
593	Y	89.4	Confident	83.2	Confident	28 Å²	28	78.2 Å²	78.2	11%	0.11	40%	0.395	C	S	.	.	H	α-helix	trans	-61.8	-42.3	172.8	172.6	-112.7	0	0	0	112	I589 E591 R597 V612 T616 L617	I589-Y593 VanDerWaalsContact O-CB 3.25Å; I589-Y593 WeakPolarHBondContact O-CB 3.38Å; I589-Y593 PolarHBondContact O-N 2.83Å; E591-Y593 PolarHBondContact O-N 3.44Å; Y593-R597 WeakPolarHBondContact O-CB 3.5Å; Y593-R597 PolarHBondContact O-N 2.87Å; Y593-R597 VanDerWaalsContact O-N 3.16Å; Y593-V612 HydrophobicContact CD2-CG1 4.46Å; Y593-V612 HydrophobicContact CE2-CG1 3.9Å; Y593-T616 WeakPolarHBondContact CE2-OG1 3.45Å; Y593-L617 HydrophobicContact CD1-CB 4.4Å; Y593-L617 HydrophobicContact CD1-CD1 4.13Å; Y593-L617 HydrophobicContact CD1-CD2 4.48Å; Y593-L617 HydrophobicContact CD2-CB 4.23Å; Y593-L617 HydrophobicContact CE2-CB 4.49Å; Y593-L617 HydrophobicContact CG-CB 4.2Å; Y593-L617 HydrophobicContact CG-CD1 3.95Å
594	S	88.9	Confident	81.4	Confident	66 Å²	66	74.7 Å²	74.7	46%	0.462	39%	0.394	S	S	.	.	H	α-helix	trans	-61.1	-46.1	174.1	-167.9	0	0	0	0	111	A590 E591 E592 L596 R597 S598	A590-S594 WeakPolarHBondContact O-CB 2.99Å; A590-S594 PolarHBondContact O-N 2.84Å; E591-S594 WeakPolarHBondContact O-CB 3.4Å; E591-S594 PolarHBondContact O-N 3.32Å; E592-S594 VanDerWaalsContact C-N 3.34Å; E592-S594 PolarHBondContact O-N 3.47Å; S594-L596 PolarHBondContact O-N 2.88Å; S594-R597 PolarHBondContact O-N 3.07Å; S594-S598 PolarHBondContact O-N 3.45Å; S594-S598 PolarHBondContact O-OG 3.2Å
595	R	86.3	Confident	79.4	Confident	125 Å²	125	74.7 Å²	74.7	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-58.4	-49.1	177.7	-172	171.7	77.2	155.3	2.5	112.2	E591 E592 R597 S598 Q599 Q649	E591-R595 WeakPolarHBondContact O-CB 3.13Å; E591-R595 PolarHBondContact O-N 2.98Å; E592-R595 VanDerWaalsContact CD-CZ 3.45Å; E592-R595 PolarHBondContact O-N 3.4Å; E592-R595 IonicContact OE1-CZ 3.04Å; E592-R595 IonicContact OE1-NE 2.74Å; E592-R595 PolarHBondContact OE1-NE 3.45Å; E592-R595 VanDerWaalsContact OE1-NE 3.15Å; E592-R595 IonicContact OE1-NH1 3.84Å; E592-R595 IonicContact OE1-NH2 2.91Å; E592-R595 PolarHBondContact OE1-NH2 3.39Å; E592-R595 IonicContact OE2-CZ 2.77Å; E592-R595 IonicContact OE2-NE 2.73Å; E592-R595 PolarHBondContact OE2-NE 3.46Å; E592-R595 IonicContact OE2-NH2 3.15Å; E592-R595 PolarHBondContact OE2-NH2 2.82Å; R595-R597 VanDerWaalsContact C-N 3.27Å; R595-R597 PolarHBondContact O-N 2.9Å; R595-S598 PolarHBondContact O-N 3.43Å; R595-Q599 VanDerWaalsContact O-CB 3.24Å; R595-Q599 WeakPolarHBondContact O-CB 3.39Å; R595-Q599 PolarHBondContact O-N 1.94Å; R595-Q649 VanDerWaalsContact NH2-NE2 3.17Å
596	L	82.7	Confident	77.8	Confident	8 Å²	8	77.5 Å²	77.5	4%	0.042	41%	0.413	C	S	.	.	H	α-helix	trans	-57.1	-40.2	177.2	-73.4	169.8	0	0	0	112.2	E592 S594 E600 V648 Q649 F653	E592-L596 WeakPolarHBondContact O-CB 3.42Å; E592-L596 VanDerWaalsContact O-CG 3.28Å; E592-L596 WeakPolarHBondContact O-CG 3.34Å; E592-L596 PolarHBondContact O-N 3.31Å; S594-L596 PolarHBondContact O-N 2.88Å; L596-E600 PolarHBondContact O-N 2.72Å; L596-E600 VanDerWaalsContact O-N 3.09Å; L596-V648 HydrophobicContact CD1-CG1 4.22Å; L596-Q649 HydrophobicContact CD2-CG 4.05Å; L596-F653 HydrophobicContact CD2-CE2 3.64Å; L596-F653 HydrophobicContact CD2-CZ 4.01Å
597	R	82.9	Confident	75.9	Confident	142 Å²	142	77.1 Å²	77.1	54%	0.536	41%	0.411	S	S	.	.	H	α-helix	trans	-76.6	-39.5	179.8	-166.3	174.6	-178.7	-175.4	-4.1	113.1	Y593 S594 R595 Q599 E600 Q601 V612	Y593-R597 WeakPolarHBondContact O-CB 3.5Å; Y593-R597 PolarHBondContact O-N 2.87Å; Y593-R597 VanDerWaalsContact O-N 3.16Å; S594-R597 PolarHBondContact O-N 3.07Å; R595-R597 VanDerWaalsContact C-N 3.27Å; R595-R597 PolarHBondContact O-N 2.9Å; R597-Q599 VanDerWaalsContact C-N 3.31Å; R597-Q599 PolarHBondContact O-N 3.14Å; R597-E600 VanDerWaalsContact O-CB 3.25Å; R597-E600 WeakPolarHBondContact O-CB 3.39Å; R597-E600 PolarHBondContact O-N 3.45Å; R597-Q601 PolarHBondContact O-N 3.13Å; R597-V612 HydrophobicContact CB-CG1 4.39Å
598	S	82.8	Confident	74.4	Confident	66 Å²	66	73.1 Å²	73.1	46%	0.462	39%	0.387	S	S	.	.	H	α-helix	trans	-63.9	-38.1	171.3	-64.8	0	0	0	0	111.7	S594 R595 E600 Q601 L602	S594-S598 PolarHBondContact O-N 3.45Å; S594-S598 PolarHBondContact O-OG 3.2Å; R595-S598 PolarHBondContact O-N 3.43Å; S598-E600 VanDerWaalsContact C-N 3.28Å; S598-E600 PolarHBondContact O-N 3.43Å; S598-Q601 PolarHBondContact O-N 2.84Å; S598-L602 WeakPolarHBondContact O-CG 3.3Å; S598-L602 PolarHBondContact O-N 3.04Å
599	Q	73	Confident	73	Confident	86 Å²	86	71.2 Å²	71.2	40%	0.402	38%	0.378	S	S	.	.	H	α-helix	trans	-69.7	-24.7	176	-163.8	174.3	23.9	0	0	112.4	R595 R597 A603 R608	R595-Q599 VanDerWaalsContact O-CB 3.24Å; R595-Q599 WeakPolarHBondContact O-CB 3.39Å; R595-Q599 PolarHBondContact O-N 1.94Å; R597-Q599 VanDerWaalsContact C-N 3.31Å; R597-Q599 PolarHBondContact O-N 3.14Å; Q599-A603 PolarHBondContact O-N 2.72Å; Q599-R608 PolarHBondContact O-NH2 2.99Å
600	E	65.7	Low	71.7	Confident	62 Å²	62	71.5 Å²	71.5	29%	0.29	38%	0.381	S	S	.	.	H	α-helix	trans	-59.5	-47.1	167.4	-162.6	176.6	-142.5	0	0	111.8	L596 R597 S598 L602 R608 V612	L596-E600 PolarHBondContact O-N 2.72Å; L596-E600 VanDerWaalsContact O-N 3.09Å; R597-E600 VanDerWaalsContact O-CB 3.25Å; R597-E600 WeakPolarHBondContact O-CB 3.39Å; R597-E600 PolarHBondContact O-N 3.45Å; S598-E600 VanDerWaalsContact C-N 3.28Å; S598-E600 PolarHBondContact O-N 3.43Å; E600-L602 VanDerWaalsContact C-N 3.31Å; E600-L602 PolarHBondContact O-N 3.5Å; E600-R608 VanDerWaalsContact CA-NH1 3.28Å; E600-V612 PolarHBondContact OE1-N 3.03Å; E600-V612 WeakPolarHBondContact OE2-CB 3.16Å
601	Q	63	Low	70.6	Confident	168 Å²	168	71.2 Å²	71.2	79%	0.785	37%	0.374	S	S	*	.	H	α-helix	trans	-68.5	-26	-178.3	-154.2	71.1	35.6	0	0	113.9	R597 S598	R597-Q601 PolarHBondContact O-N 3.13Å; S598-Q601 PolarHBondContact O-N 2.84Å
602	L	57.7	Low	69.9	Low	149 Å²	149	65.3 Å²	65.3	78%	0.78	35%	0.348	S	S	*	.	H	α-helix	trans	-95.5	-20.5	-171.1	-71	168.9	0	0	0	115.1	S598 E600	S598-L602 WeakPolarHBondContact O-CG 3.3Å; S598-L602 PolarHBondContact O-N 3.04Å; E600-L602 VanDerWaalsContact C-N 3.31Å; E600-L602 PolarHBondContact O-N 3.5Å
603	A	56.3	Low	69.7	Low	28 Å²	28	66.8 Å²	66.8	23%	0.231	36%	0.358	C	S	.	.			trans	-120.9	69.8	-172.4	0	0	0	0	0	111.8	Q599 D605 I606	Q599-A603 PolarHBondContact O-N 2.72Å; A603-D605 VanDerWaalsContact C-N 3.33Å; A603-D605 PolarHBondContact O-N 2.69Å; A603-I606 HydrophobicContact CB-CD1 4.23Å; A603-I606 PolarHBondContact O-N 2.87Å
604	A	52.6	Low	69.6	Low	91 Å²	91	68.7 Å²	68.7	75%	0.752	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-30.5	-176.8	0	0	0	0	0	114.1	I606	A604-I606 VanDerWaalsContact C-N 3.29Å; A604-I606 PolarHBondContact O-N 2.92Å
605	D	49.7	Very low	69.5	Low	144 Å²	144	68.4 Å²	68.4	77%	0.77	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-12.2	-176.5	-55.1	-39.4	0	0	0	113.6	A603 A607	A603-D605 VanDerWaalsContact C-N 3.33Å; A603-D605 PolarHBondContact O-N 2.69Å; D605-A607 PolarHBondContact O-N 3.49Å
606	I	57.8	Low	69.5	Low	59 Å²	59	62.8 Å²	62.8	30%	0.303	35%	0.348	S	S	.	.	S	Bend	trans	-93	86.2	177	-52.8	178.9	0	0	0	108.7	A603 A604 R608	A603-I606 HydrophobicContact CB-CD1 4.23Å; A603-I606 PolarHBondContact O-N 2.87Å; A604-I606 VanDerWaalsContact C-N 3.29Å; A604-I606 PolarHBondContact O-N 2.92Å; I606-R608 WeakPolarHBondContact O-CG 3.42Å; I606-R608 PolarHBondContact O-N 3.35Å
607	A	53.8	Low	69.9	Low	30 Å²	30	65 Å²	65	25%	0.248	36%	0.36	C	S	.	.			trans	-60.8	116.3	176.2	0	0	0	0	0	111.5	T463 D605 V656	T463-A607 HydrophobicContact CG2-CB 4.49Å; D605-A607 PolarHBondContact O-N 3.49Å; A607-V656 HydrophobicContact CB-CG2 3.95Å
608	R	61.6	Low	70.2	Confident	31 Å²	31	62 Å²	62	12%	0.117	35%	0.351	C	S	.	.			trans	-95.1	167.8	-169.3	-53.4	-167.5	-172.8	179.8	3.3	113.7	P464 Q599 E600 I606	P464-R608 WeakPolarHBondContact CG-O 3.33Å; Q599-R608 PolarHBondContact O-NH2 2.99Å; E600-R608 VanDerWaalsContact CA-NH1 3.28Å; I606-R608 WeakPolarHBondContact O-CG 3.42Å; I606-R608 PolarHBondContact O-N 3.35Å
609	T	63.8	Low	70.5	Confident	2 Å²	2	59 Å²	59	1%	0.012	33%	0.331	C	S	.	.	S	Bend	trans	-84.8	-25.8	-175.8	58.7	0	0	0	0	114.1	P464 I483 A651 K654	P464-T609 HydrophobicContact CB-CG2 4.32Å; P464-T609 HydrophobicContact CG-CG2 4.23Å; I483-T609 HydrophobicContact CD1-CG2 3.47Å; I483-T609 VanDerWaalsContact CD1-CG2 3.47Å; I483-T609 HydrophobicContact CG1-CG2 4.26Å; T609-A651 PolarHBondContact OG1-O 3.32Å; T609-A651 VanDerWaalsContact OG1-O 3.06Å; T609-K654 HydrophobicContact CG2-CB 4.39Å
610	S	65.6	Low	71.4	Confident	10 Å²	10	54.9 Å²	54.9	7%	0.07	31%	0.311	C	S	.	.	S	Bend	trans	-160.5	155	176	57.9	0	0	0	0	112.1	Y652	S610-Y652 WeakPolarHBondContact OG-CE1 3.24Å
611	P	69.4	Low	72.7	Confident	45 Å²	45	54.6 Å²	54.6	29%	0.292	31%	0.311	S	S	.	.			trans	-78.1	141.6	-178.8	30.3	-35.2	0	0	0	113.2	T613	P611-T613 PolarHBondContact O-N 3.07Å
612	V	77.3	Confident	74.1	Confident	15 Å²	15	47 Å²	47	9%	0.091	28%	0.276	C	S	.	.			trans	-80.5	87.8	-178	-174	0	0	0	0	111.4	Y593 R597 E600 T616 Y652	Y593-V612 HydrophobicContact CD2-CG1 4.46Å; Y593-V612 HydrophobicContact CE2-CG1 3.9Å; R597-V612 HydrophobicContact CB-CG1 4.39Å; E600-V612 PolarHBondContact OE1-N 3.03Å; E600-V612 WeakPolarHBondContact OE2-CB 3.16Å; V612-T616 HydrophobicContact CG1-CG2 4.45Å; V612-Y652 HydrophobicContact CG2-CD1 4.33Å; V612-Y652 HydrophobicContact CG2-CE1 4.39Å
613	T	84.1	Confident	75.7	Confident	47 Å²	47	40 Å²	40	29%	0.288	24%	0.239	S	C	.	.			trans	-91.5	170.7	175.9	71.3	0	0	0	0	112.7	P611 R615 T616	P611-T613 PolarHBondContact O-N 3.07Å; T613-R615 PolarHBondContact O-N 3.3Å; T613-R615 VanDerWaalsContact O-N 3.1Å; T613-R615 WeakPolarHBondContact OG1-CB 3.24Å; T613-R615 PolarHBondContact OG1-N 3.48Å; T613-T616 WeakPolarHBondContact O-CB 3.18Å; T613-T616 WeakPolarHBondContact O-CG2 3.22Å; T613-T616 PolarHBondContact O-N 3.3Å; T613-T616 PolarHBondContact O-OG1 3.41Å
614	A	85.8	Confident	77.5	Confident	69 Å²	69	38.7 Å²	38.7	57%	0.57	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-19	172.9	0	0	0	0	0	113.8	T616 L617	A614-T616 PolarHBondContact O-N 3.1Å; A614-L617 WeakPolarHBondContact O-CB 3.4Å; A614-L617 PolarHBondContact O-N 3.44Å
615	R	86.8	Confident	79.4	Confident	60 Å²	60	34.8 Å²	34.8	23%	0.226	20%	0.195	C	C	.	.	H	α-helix	trans	-65.3	-27.1	173.7	-64.9	176.5	173.1	168.4	-4.7	112.9	E426 S476 T613 L617 E618 T619	E426-R615 IonicContact OE1-CZ 3.46Å; E426-R615 IonicContact OE1-NE 2.91Å; E426-R615 IonicContact OE1-NH2 2.73Å; E426-R615 PolarHBondContact OE1-NH2 2.71Å; E426-R615 IonicContact OE2-CZ 3.78Å; E426-R615 IonicContact OE2-NH2 3.88Å; E426-R615 PolarHBondContact OE2-NH2 3.01Å; S476-R615 VanDerWaalsContact C-NH1 3.33Å; S476-R615 WeakPolarHBondContact O-CD 3.41Å; S476-R615 PolarHBondContact O-NH1 3.46Å; S476-R615 PolarHBondContact OG-NH1 3.34Å; S476-R615 VanDerWaalsContact OG-NH1 3.13Å; T613-R615 PolarHBondContact O-N 3.3Å; T613-R615 VanDerWaalsContact O-N 3.1Å; T613-R615 WeakPolarHBondContact OG1-CB 3.24Å; T613-R615 PolarHBondContact OG1-N 3.48Å; R615-L617 VanDerWaalsContact C-N 3.25Å; R615-L617 PolarHBondContact O-N 3.08Å; R615-E618 WeakPolarHBondContact O-CA 3.38Å; R615-E618 WeakPolarHBondContact O-CB 3.17Å; R615-E618 PolarHBondContact O-N 2.94Å; R615-E618 VanDerWaalsContact O-N 3.07Å; R615-T619 PolarHBondContact O-N 2.99Å; R615-T619 PolarHBondContact O-OG1 2.85Å
616	T	86.8	Confident	81.4	Confident	6 Å²	6	28 Å²	28	4%	0.037	16%	0.158	C	C	.	.	H	α-helix	trans	-66.1	-30.5	178.1	65.7	0	0	0	0	112	Y593 V612 T613 A614 T619 L620 Y652	Y593-T616 WeakPolarHBondContact CE2-OG1 3.45Å; V612-T616 HydrophobicContact CG1-CG2 4.45Å; T613-T616 WeakPolarHBondContact O-CB 3.18Å; T613-T616 WeakPolarHBondContact O-CG2 3.22Å; T613-T616 PolarHBondContact O-N 3.3Å; T613-T616 PolarHBondContact O-OG1 3.41Å; A614-T616 PolarHBondContact O-N 3.1Å; T616-T619 WeakPolarHBondContact O-CB 3.5Å; T616-T619 PolarHBondContact O-N 3.42Å; T616-L620 WeakPolarHBondContact O-CG 3.05Å; T616-L620 PolarHBondContact O-N 3.43Å; T616-Y652 HydrophobicContact CG2-CE1 4.23Å; T616-Y652 WeakPolarHBondContact CG2-OH 3.44Å
617	L	90.5	Very high	82.9	Confident	56 Å²	56	25.9 Å²	25.9	29%	0.293	15%	0.147	S	C	.	.	H	α-helix	trans	-64	-42.9	169.6	-175.7	68.6	0	0	0	111.3	I589 Y593 A614 R615 T619 L620 I621	I589-L617 HydrophobicContact CG2-CD1 3.55Å; Y593-L617 HydrophobicContact CD1-CB 4.4Å; Y593-L617 HydrophobicContact CD1-CD1 4.13Å; Y593-L617 HydrophobicContact CD1-CD2 4.48Å; Y593-L617 HydrophobicContact CD2-CB 4.23Å; Y593-L617 HydrophobicContact CE2-CB 4.49Å; Y593-L617 HydrophobicContact CG-CB 4.2Å; Y593-L617 HydrophobicContact CG-CD1 3.95Å; A614-L617 WeakPolarHBondContact O-CB 3.4Å; A614-L617 PolarHBondContact O-N 3.44Å; R615-L617 VanDerWaalsContact C-N 3.25Å; R615-L617 PolarHBondContact O-N 3.08Å; L617-T619 VanDerWaalsContact C-N 3.34Å; L617-L620 PolarHBondContact O-N 3.09Å; L617-I621 WeakPolarHBondContact O-CG1 3.5Å; L617-I621 PolarHBondContact O-N 3.3Å; L617-I621 VanDerWaalsContact O-N 3.13Å
618	E	89.4	Confident	84.6	Confident	77 Å²	77	24.5 Å²	24.5	36%	0.36	14%	0.135	S	C	.	.	H	α-helix	trans	-63.4	-40.2	173.1	-55.5	-172.2	160	0	0	111.9	R615 I621 R622	R615-E618 WeakPolarHBondContact O-CA 3.38Å; R615-E618 WeakPolarHBondContact O-CB 3.17Å; R615-E618 PolarHBondContact O-N 2.94Å; R615-E618 VanDerWaalsContact O-N 3.07Å; E618-I621 PolarHBondContact O-N 2.9Å; E618-R622 WeakPolarHBondContact O-CG 3.37Å; E618-R622 PolarHBondContact O-N 2.69Å; E618-R622 IonicContact OE2-CZ 2.79Å; E618-R622 IonicContact OE2-NH1 2.8Å; E618-R622 IonicContact OE2-NH2 3.4Å; E618-R622 PolarHBondContact OE2-NH2 3.31Å
619	T	90.4	Very high	85.9	Confident	4 Å²	4	23.5 Å²	23.5	3%	0.025	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-46.8	174.2	-64.1	0	0	0	0	111.7	D479 R615 T616 L617 I621 R622 L623 V648	D479-T619 HydrophobicContact CB-CG2 3.81Å; D479-T619 WeakPolarHBondContact CB-OG1 3.46Å; D479-T619 VanDerWaalsContact CG-OG1 3.24Å; D479-T619 WeakPolarHBondContact O-CG2 3.4Å; D479-T619 PolarHBondContact OD1-OG1 3.3Å; R615-T619 PolarHBondContact O-N 2.99Å; R615-T619 PolarHBondContact O-OG1 2.85Å; T616-T619 WeakPolarHBondContact O-CB 3.5Å; T616-T619 PolarHBondContact O-N 3.42Å; L617-T619 VanDerWaalsContact C-N 3.34Å; T619-I621 VanDerWaalsContact C-N 3.29Å; T619-I621 PolarHBondContact O-N 3.21Å; T619-R622 PolarHBondContact O-N 3.02Å; T619-R622 VanDerWaalsContact O-N 3.17Å; T619-L623 HydrophobicContact CG2-CD1 3.68Å; T619-L623 HydrophobicContact CG2-CG 4.2Å; T619-L623 WeakPolarHBondContact O-CB 3.2Å; T619-L623 WeakPolarHBondContact O-CG 3.5Å; T619-L623 PolarHBondContact O-N 3.18Å; T619-V648 HydrophobicContact CG2-CG2 4.39Å
620	L	91.6	Very high	87.1	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.7	-41.8	176.5	-74.3	168.6	0	0	0	111.4	I589 T616 L617 S624 V645 V648	I589-L620 HydrophobicContact CG2-CB 4.01Å; I589-L620 HydrophobicContact CG2-CD1 4.29Å; T616-L620 WeakPolarHBondContact O-CG 3.05Å; T616-L620 PolarHBondContact O-N 3.43Å; L617-L620 PolarHBondContact O-N 3.09Å; L620-S624 VanDerWaalsContact O-CB 3.31Å; L620-S624 WeakPolarHBondContact O-CB 3.38Å; L620-S624 PolarHBondContact O-N 2.92Å; L620-S624 PolarHBondContact O-OG 3.4Å; L620-V645 HydrophobicContact CD2-CG2 3.76Å; L620-V648 HydrophobicContact CD2-CB 4.18Å; L620-V648 HydrophobicContact CD2-CG2 3.74Å; L620-V648 HydrophobicContact CG-CG2 4.42Å
621	I	92.8	Very high	88	Confident	56 Å²	56	25.3 Å²	25.3	29%	0.287	14%	0.137	S	C	.	.	H	α-helix	trans	-64.9	-43.5	175.1	-64.7	164.7	0	0	0	111.3	I589 L617 E618 T619 T625	I589-I621 HydrophobicContact CD1-CG1 4.46Å; L617-I621 WeakPolarHBondContact O-CG1 3.5Å; L617-I621 PolarHBondContact O-N 3.3Å; L617-I621 VanDerWaalsContact O-N 3.13Å; E618-I621 PolarHBondContact O-N 2.9Å; T619-I621 VanDerWaalsContact C-N 3.29Å; T619-I621 PolarHBondContact O-N 3.21Å; I621-T625 WeakPolarHBondContact O-CB 3.3Å; I621-T625 WeakPolarHBondContact O-CG2 3.4Å; I621-T625 PolarHBondContact O-N 2.71Å; I621-T625 PolarHBondContact O-OG1 2.98Å
622	R	92.5	Very high	88.8	Confident	9 Å²	9	24.8 Å²	24.8	3%	0.034	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-45.2	176.9	-71.1	-179.4	-164.5	113.3	22.8	111.9	R335 D337 I338 D479 E618 T619 T625 A626	R335-R622 PolarHBondContact O-NE 2.83Å; R335-R622 PolarHBondContact O-NH2 2.81Å; R335-R622 VanDerWaalsContact O-NH2 3.12Å; D337-R622 VanDerWaalsContact O-CD 3.29Å; D337-R622 WeakPolarHBondContact O-CD 3.25Å; I338-R622 HydrophobicContact CD1-CB 4.11Å; I338-R622 HydrophobicContact CG1-CB 3.73Å; D479-R622 IonicContact OD1-NH1 2.83Å; D479-R622 PolarHBondContact OD1-NH1 2.82Å; D479-R622 WeakPolarHBondContact OD2-CD 3.5Å; D479-R622 IonicContact OD2-CZ 3.66Å; D479-R622 IonicContact OD2-NE 3.72Å; D479-R622 IonicContact OD2-NH1 3.27Å; D479-R622 PolarHBondContact OD2-NH1 3.43Å; E618-R622 WeakPolarHBondContact O-CG 3.37Å; E618-R622 PolarHBondContact O-N 2.69Å; E618-R622 IonicContact OE2-CZ 2.79Å; E618-R622 IonicContact OE2-NH1 2.8Å; E618-R622 IonicContact OE2-NH2 3.4Å; E618-R622 PolarHBondContact OE2-NH2 3.31Å; T619-R622 PolarHBondContact O-N 3.02Å; T619-R622 VanDerWaalsContact O-N 3.17Å; R622-T625 WeakPolarHBondContact CA-OG1 3.2Å; R622-T625 PolarHBondContact O-N 3.01Å; R622-T625 PolarHBondContact O-OG1 2.82Å; R622-A626 VanDerWaalsContact O-CB 3.31Å; R622-A626 WeakPolarHBondContact O-CB 3.13Å; R622-A626 PolarHBondContact O-N 3.23Å
623	L	92.1	Very high	89.2	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-65.8	-44.5	178.7	-70.8	170.7	0	0	0	111.8	C318 I338 L480 T619 T625 A626 H627 A644 V648	C318-L623 HydrophobicContact CB-CD2 3.9Å; I338-L623 HydrophobicContact CD1-CD2 4.06Å; L480-L623 HydrophobicContact CD1-CD1 4.16Å; L480-L623 HydrophobicContact CD1-CD2 3.88Å; L480-L623 HydrophobicContact CD2-CD1 4.13Å; L480-L623 HydrophobicContact CG-CD1 4.34Å; T619-L623 HydrophobicContact CG2-CD1 3.68Å; T619-L623 HydrophobicContact CG2-CG 4.2Å; T619-L623 WeakPolarHBondContact O-CB 3.2Å; T619-L623 WeakPolarHBondContact O-CG 3.5Å; T619-L623 PolarHBondContact O-N 3.18Å; L623-T625 PolarHBondContact O-N 2.95Å; L623-A626 PolarHBondContact O-N 2.86Å; L623-H627 PolarHBondContact O-N 2.91Å; L623-A644 HydrophobicContact CB-CB 3.77Å; L623-V648 HydrophobicContact CD1-CG2 3.75Å
624	S	92.8	Very high	89.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.3	-42.5	177.4	-52	0	0	0	0	111.5	L620 H627 A628 A644	L620-S624 VanDerWaalsContact O-CB 3.31Å; L620-S624 WeakPolarHBondContact O-CB 3.38Å; L620-S624 PolarHBondContact O-N 2.92Å; L620-S624 PolarHBondContact O-OG 3.4Å; S624-H627 PolarHBondContact O-N 3.48Å; S624-A628 PolarHBondContact O-N 2.87Å; S624-A644 WeakPolarHBondContact OG-CB 3.33Å
625	T	92.5	Very high	89.7	Confident	10 Å²	10	30.1 Å²	30.1	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-67.2	-36.8	174.9	52.8	0	0	0	0	112.6	P579 I621 R622 L623 A628 K629 V636	P579-T625 HydrophobicContact CG-CG2 4.41Å; P579-T625 WeakPolarHBondContact CG-O 3.35Å; I621-T625 WeakPolarHBondContact O-CB 3.3Å; I621-T625 WeakPolarHBondContact O-CG2 3.4Å; I621-T625 PolarHBondContact O-N 2.71Å; I621-T625 PolarHBondContact O-OG1 2.98Å; R622-T625 WeakPolarHBondContact CA-OG1 3.2Å; R622-T625 PolarHBondContact O-N 3.01Å; R622-T625 PolarHBondContact O-OG1 2.82Å; L623-T625 PolarHBondContact O-N 2.95Å; T625-A628 PolarHBondContact O-N 2.7Å; T625-K629 WeakPolarHBondContact O-CG 3.43Å; T625-K629 PolarHBondContact O-N 2.98Å; T625-V636 HydrophobicContact CG2-CG2 3.98Å
626	A	91.4	Very high	89.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.6	-37.4	173.9	0	0	0	0	0	112.5	C318 L321 I338 R622 L623 K629 A630	C318-A626 HydrophobicContact CB-CB 3.88Å; L321-A626 WeakPolarHBondContact CD1-O 3.46Å; I338-A626 HydrophobicContact CD1-CB 4.06Å; R622-A626 VanDerWaalsContact O-CB 3.31Å; R622-A626 WeakPolarHBondContact O-CB 3.13Å; R622-A626 PolarHBondContact O-N 3.23Å; L623-A626 PolarHBondContact O-N 2.86Å; A626-K629 WeakPolarHBondContact O-CB 3.22Å; A626-K629 PolarHBondContact O-N 2.81Å; A626-A630 PolarHBondContact O-N 2.86Å
627	H	89.8	Confident	90.1	Very high	16 Å²	16	30.1 Å²	30.1	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-66.5	-44	174.2	-168.5	-96	0	0	0	111.9	F295 L623 S624 K629 A630 R631 D640	F295-H627 AromaticContact CD1-CD2 3.48Å; F295-H627 VanDerWaalsContact CD1-CD2 3.48Å; F295-H627 WeakPolarHBondContact CD1-CD2 3.34Å; F295-H627 AromaticContact CD1-NE2 3.41Å; F295-H627 WeakPolarHBondContact CD1-NE2 3.46Å; F295-H627 AromaticContact CD2-CD2 3.64Å; F295-H627 AromaticContact CE1-CD2 3.69Å; F295-H627 AromaticContact CE2-CD2 3.86Å; F295-H627 AromaticContact CG-CD2 3.45Å; F295-H627 VanDerWaalsContact CG-CD2 3.45Å; F295-H627 WeakPolarHBondContact CG-CD2 3.48Å; F295-H627 AromaticContact CG-NE2 3.42Å; F295-H627 WeakPolarHBondContact CG-NE2 3.43Å; F295-H627 AromaticContact CZ-CD2 3.89Å; L623-H627 PolarHBondContact O-N 2.91Å; S624-H627 PolarHBondContact O-N 3.48Å; H627-K629 VanDerWaalsContact C-N 3.32Å; H627-K629 PolarHBondContact O-N 3.49Å; H627-A630 WeakPolarHBondContact O-CA 3.43Å; H627-A630 VanDerWaalsContact O-CB 3.26Å; H627-A630 WeakPolarHBondContact O-CB 3.09Å; H627-A630 PolarHBondContact O-N 2.86Å; H627-R631 PolarHBondContact O-N 2.78Å; H627-R631 VanDerWaalsContact O-N 3.14Å; H627-D640 HydrophobicContact CB-CB 4.33Å; H627-D640 IonicContact CE1-OD1 3.74Å; H627-D640 PolarHBondContact CE1-OD1 2.96Å; H627-D640 IonicContact CG-OD1 2.86Å; H627-D640 IonicContact ND1-OD1 3.19Å; H627-D640 PolarHBondContact ND1-OD1 2.9Å
628	A	90	Very high	90.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.4	-39.2	174.3	0	0	0	0	0	112.4	P579 S624 T625 A630 R631 M632 S633 V636	P579-A628 HydrophobicContact CB-CB 3.84Å; P579-A628 HydrophobicContact CG-CB 3.98Å; S624-A628 PolarHBondContact O-N 2.87Å; T625-A628 PolarHBondContact O-N 2.7Å; A628-A630 VanDerWaalsContact C-N 3.35Å; A628-A630 PolarHBondContact O-N 3.02Å; A628-R631 PolarHBondContact O-N 2.98Å; A628-M632 PolarHBondContact O-N 3.21Å; A628-S633 PolarHBondContact O-N 3.13Å; A628-V636 HydrophobicContact CB-CG2 3.94Å
629	K	89.3	Confident	90	Very high	10 Å²	10	32.4 Å²	32.4	4%	0.043	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-41.7	169.5	-74.4	-176.5	-172.9	-176.7	0	112.3	L321 G322 G323 I577 P579 T625 A626 H627 R631 M632	L321-K629 PolarHBondContact O-NZ 2.83Å; G322-K629 WeakPolarHBondContact O-CD 3.49Å; G322-K629 WeakPolarHBondContact O-CE 3.49Å; G322-K629 PolarHBondContact O-NZ 2.84Å; G323-K629 PolarHBondContact O-NZ 2.96Å; I577-K629 WeakPolarHBondContact O-CE 3.28Å; I577-K629 WeakPolarHBondContact O-CG 3.27Å; P579-K629 HydrophobicContact CG-CG 4.01Å; T625-K629 WeakPolarHBondContact O-CG 3.43Å; T625-K629 PolarHBondContact O-N 2.98Å; A626-K629 WeakPolarHBondContact O-CB 3.22Å; A626-K629 PolarHBondContact O-N 2.81Å; H627-K629 VanDerWaalsContact C-N 3.32Å; H627-K629 PolarHBondContact O-N 3.49Å; K629-R631 PolarHBondContact O-N 3.47Å; K629-M632 PolarHBondContact O-N 3.4Å
630	A	87.6	Confident	89.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-26.9	177.8	0	0	0	0	0	113.2	F295 L321 Y570 A626 H627 A628	F295-A630 HydrophobicContact CD2-CB 3.86Å; F295-A630 HydrophobicContact CE2-CB 4.49Å; L321-A630 HydrophobicContact CD1-CB 3.52Å; Y570-A630 PolarHBondContact OH-O 3.02Å; A626-A630 PolarHBondContact O-N 2.86Å; H627-A630 WeakPolarHBondContact O-CA 3.43Å; H627-A630 VanDerWaalsContact O-CB 3.26Å; H627-A630 WeakPolarHBondContact O-CB 3.09Å; H627-A630 PolarHBondContact O-N 2.86Å; A628-A630 VanDerWaalsContact C-N 3.35Å; A628-A630 PolarHBondContact O-N 3.02Å
631	R	85.8	Confident	89.8	Confident	50 Å²	50	32.2 Å²	32.2	19%	0.189	16%	0.159	C	C	.	.	H	α-helix	trans	-86.3	-11.8	173	-65.3	169	76	-156.5	5.2	113.2	S287 H627 A628 K629 S633 E637 E639 D640	S287-R631 PolarHBondContact OG-O 3.18Å; H627-R631 PolarHBondContact O-N 2.78Å; H627-R631 VanDerWaalsContact O-N 3.14Å; A628-R631 PolarHBondContact O-N 2.98Å; K629-R631 PolarHBondContact O-N 3.47Å; R631-S633 VanDerWaalsContact C-N 3.26Å; R631-E637 IonicContact CZ-OE2 2.66Å; R631-E637 IonicContact NH1-OE2 2.74Å; R631-E637 PolarHBondContact NH1-OE2 3.16Å; R631-E637 IonicContact NH2-OE2 2.71Å; R631-E637 PolarHBondContact NH2-OE2 3.18Å; R631-E639 IonicContact CZ-OE2 3.42Å; R631-E639 IonicContact NH1-OE2 3.8Å; R631-E639 IonicContact NH2-OE2 2.65Å; R631-E639 PolarHBondContact NH2-OE2 3.36Å; R631-D640 WeakPolarHBondContact CD-OD1 3.41Å; R631-D640 IonicContact CZ-OD1 3.37Å; R631-D640 IonicContact NE-OD1 3.17Å; R631-D640 VanDerWaalsContact NH1-CG 3.33Å; R631-D640 IonicContact NH1-OD1 3.14Å; R631-D640 PolarHBondContact NH1-OD1 2.75Å; R631-D640 IonicContact NH1-OD2 3.78Å; R631-D640 PolarHBondContact NH1-OD2 3.18Å
632	M	85.6	Confident	89.5	Confident	35 Å²	35	34.8 Å²	34.8	17%	0.172	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	28.5	-166.3	-56.9	-170.5	159.6	0	0	114	I283 Y570 I573 A574 I577 A628 K629	I283-M632 HydrophobicContact CG2-CE 3.56Å; I283-M632 HydrophobicContact CG2-SD 3.75Å; Y570-M632 HydrophobicContact CD1-CE 4.4Å; Y570-M632 HydrophobicContact CD2-CE 3.87Å; Y570-M632 HydrophobicContact CE1-CE 4.14Å; Y570-M632 HydrophobicContact CE2-CE 3.57Å; Y570-M632 HydrophobicContact CE2-SD 4.06Å; Y570-M632 HydrophobicContact CG-CE 4.26Å; I573-M632 HydrophobicContact CB-CE 3.98Å; I573-M632 HydrophobicContact CG2-CE 3.7Å; I573-M632 HydrophobicContact CG2-SD 4.47Å; A574-M632 HydrophobicContact CB-CE 4.09Å; I577-M632 HydrophobicContact CD1-CB 3.58Å; I577-M632 HydrophobicContact CD1-CG 3.71Å; I577-M632 HydrophobicContact CD1-SD 4.35Å; A628-M632 PolarHBondContact O-N 3.21Å; K629-M632 PolarHBondContact O-N 3.4Å
633	S	86.6	Confident	89.3	Confident	28 Å²	28	35.8 Å²	35.8	20%	0.196	18%	0.177	C	C	.	.			trans	-77	149.8	173.2	-173	0	0	0	0	111.5	I577 A628 R631 A635	I577-S633 WeakPolarHBondContact CG2-O 3.42Å; A628-S633 PolarHBondContact O-N 3.13Å; R631-S633 VanDerWaalsContact C-N 3.26Å; S633-A635 WeakPolarHBondContact CB-O 3.45Å; S633-A635 PolarHBondContact OG-N 2.72Å; S633-A635 VanDerWaalsContact OG-N 3.16Å; S633-A635 PolarHBondContact OG-O 2.72Å
634	K	88.8	Confident	89.1	Confident	179 Å²	179	35.9 Å²	35.9	78%	0.778	18%	0.178	S	C	*	.	S	Bend	trans	-90.2	-12.2	170.2	-66	-173.9	178.7	-175.9	0	113.1	P579 V580	P579-K634 WeakPolarHBondContact CA-O 3.47Å; V580-K634 PolarHBondContact N-O 2.68Å
635	A	91.3	Very high	88.9	Confident	36 Å²	36	36.3 Å²	36.3	30%	0.298	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.6	179	0	0	0	0	0	109.5	V580 T582 S633	V580-A635 WeakPolarHBondContact O-CA 3.41Å; T582-A635 HydrophobicContact CG2-CB 4.06Å; S633-A635 WeakPolarHBondContact CB-O 3.45Å; S633-A635 PolarHBondContact OG-N 2.72Å; S633-A635 VanDerWaalsContact OG-N 3.16Å; S633-A635 PolarHBondContact OG-O 2.72Å
636	V	91.3	Very high	88.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	119.5	169.9	-176	0	0	0	0	108.2	P579 V580 L581 T582 A585 T625 A628 D640 T641	P579-V636 HydrophobicContact CB-CG2 4.16Å; V580-V636 PolarHBondContact O-N 2.71Å; L581-V636 HydrophobicContact CD1-CB 4.06Å; L581-V636 HydrophobicContact CD1-CG1 4.09Å; L581-V636 HydrophobicContact CD1-CG2 4.09Å; T582-V636 VanDerWaalsContact CG2-O 3.23Å; T582-V636 WeakPolarHBondContact CG2-O 3.48Å; T582-V636 PolarHBondContact OG1-O 2.82Å; A585-V636 HydrophobicContact CB-CG1 4.22Å; T625-V636 HydrophobicContact CG2-CG2 3.98Å; A628-V636 HydrophobicContact CB-CG2 3.94Å; V636-D640 HydrophobicContact CG1-CB 3.92Å; V636-T641 HydrophobicContact CG1-CG2 4.17Å
637	E	90	Very high	88.4	Confident	66 Å²	66	40 Å²	40	31%	0.308	20%	0.197	S	C	.	.			trans	-94.6	166.1	178.1	-65.7	175.4	168.1	0	0	110.9	R631 E639 D640	R631-E637 IonicContact CZ-OE2 2.66Å; R631-E637 IonicContact NH1-OE2 2.74Å; R631-E637 PolarHBondContact NH1-OE2 3.16Å; R631-E637 IonicContact NH2-OE2 2.71Å; R631-E637 PolarHBondContact NH2-OE2 3.18Å; E637-E639 VanDerWaalsContact C-N 3.28Å; E637-E639 PolarHBondContact O-N 3.44Å; E637-D640 PolarHBondContact N-OD2 2.95Å; E637-D640 WeakPolarHBondContact O-CB 3.03Å; E637-D640 PolarHBondContact O-N 2.98Å
638	L	89.8	Confident	88.3	Confident	79 Å²	79	39.5 Å²	39.5	41%	0.414	20%	0.195	S	C	.	.	H	α-helix	trans	-57.4	-41.6	177.8	-168.2	156.3	0	0	0	111.7	D640 T641 E642	L638-D640 PolarHBondContact O-N 2.85Å; L638-D640 VanDerWaalsContact O-N 3.15Å; L638-T641 PolarHBondContact O-N 2.75Å; L638-T641 PolarHBondContact O-OG1 3.08Å; L638-E642 PolarHBondContact O-N 3.46Å; L638-E642 VanDerWaalsContact O-N 3.09Å
639	E	87.3	Confident	88	Confident	101 Å²	101	42.2 Å²	42.2	47%	0.472	21%	0.208	S	C	.	.	H	α-helix	trans	-49.6	-38.2	173.7	-62.7	178.3	-179.5	0	0	112.7	R631 E637 T641 V643	R631-E639 IonicContact CZ-OE2 3.42Å; R631-E639 IonicContact NH1-OE2 3.8Å; R631-E639 IonicContact NH2-OE2 2.65Å; R631-E639 PolarHBondContact NH2-OE2 3.36Å; E637-E639 VanDerWaalsContact C-N 3.28Å; E637-E639 PolarHBondContact O-N 3.44Å; E639-T641 VanDerWaalsContact C-N 3.34Å; E639-V643 WeakPolarHBondContact O-CG2 3.34Å; E639-V643 PolarHBondContact O-N 3Å
640	D	88.9	Confident	87.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-71.7	-31.9	-179.2	-57.5	-43.6	0	0	0	111.8	H627 R631 V636 E637 L638 A644	H627-D640 HydrophobicContact CB-CB 4.33Å; H627-D640 IonicContact CE1-OD1 3.74Å; H627-D640 PolarHBondContact CE1-OD1 2.96Å; H627-D640 IonicContact CG-OD1 2.86Å; H627-D640 IonicContact ND1-OD1 3.19Å; H627-D640 PolarHBondContact ND1-OD1 2.9Å; R631-D640 WeakPolarHBondContact CD-OD1 3.41Å; R631-D640 IonicContact CZ-OD1 3.37Å; R631-D640 IonicContact NE-OD1 3.17Å; R631-D640 VanDerWaalsContact NH1-CG 3.33Å; R631-D640 IonicContact NH1-OD1 3.14Å; R631-D640 PolarHBondContact NH1-OD1 2.75Å; R631-D640 IonicContact NH1-OD2 3.78Å; R631-D640 PolarHBondContact NH1-OD2 3.18Å; V636-D640 HydrophobicContact CG1-CB 3.92Å; E637-D640 PolarHBondContact N-OD2 2.95Å; E637-D640 WeakPolarHBondContact O-CB 3.03Å; E637-D640 PolarHBondContact O-N 2.98Å; L638-D640 PolarHBondContact O-N 2.85Å; L638-D640 VanDerWaalsContact O-N 3.15Å; D640-A644 WeakPolarHBondContact O-CB 3.29Å; D640-A644 PolarHBondContact O-N 3.17Å
641	T	88.8	Confident	87.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-77.4	-36.4	179.5	69.6	0	0	0	0	112.2	A585 H588 I589 V636 L638 E639 A644 V645	A585-T641 HydrophobicContact CB-CG2 3.63Å; H588-T641 PolarHBondContact ND1-OG1 2.9Å; I589-T641 HydrophobicContact CD1-CG2 3.73Å; I589-T641 HydrophobicContact CG1-CG2 3.81Å; V636-T641 HydrophobicContact CG1-CG2 4.17Å; L638-T641 PolarHBondContact O-N 2.75Å; L638-T641 PolarHBondContact O-OG1 3.08Å; E639-T641 VanDerWaalsContact C-N 3.34Å; T641-A644 PolarHBondContact O-N 3.05Å; T641-V645 VanDerWaalsContact O-CG2 3.29Å; T641-V645 WeakPolarHBondContact O-CG2 3.12Å; T641-V645 PolarHBondContact O-N 3.16Å
642	E	88.5	Confident	86.5	Confident	110 Å²	110	45.7 Å²	45.7	51%	0.514	23%	0.225	S	C	.	.	H	α-helix	trans	-62.7	-48.6	177.4	-171.9	172.4	-160.2	0	0	110.8	L638 A644 V645 E646	L638-E642 PolarHBondContact O-N 3.46Å; L638-E642 VanDerWaalsContact O-N 3.09Å; E642-A644 VanDerWaalsContact C-N 3.29Å; E642-A644 PolarHBondContact O-N 2.98Å; E642-V645 PolarHBondContact O-N 3.12Å; E642-V645 VanDerWaalsContact O-N 3.11Å; E642-E646 PolarHBondContact O-N 2.98Å
643	V	86.4	Confident	85.5	Confident	31 Å²	31	46.8 Å²	46.8	19%	0.188	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-35.1	175.4	177.6	0	0	0	0	112.1	F295 E639 L647	F295-V643 HydrophobicContact CD1-CG1 4.26Å; F295-V643 HydrophobicContact CE1-CG1 3.94Å; E639-V643 WeakPolarHBondContact O-CG2 3.34Å; E639-V643 PolarHBondContact O-N 3Å; V643-L647 HydrophobicContact CG1-CD1 4.37Å; V643-L647 WeakPolarHBondContact O-CG 3.45Å; V643-L647 PolarHBondContact O-N 2.82Å
644	A	89.3	Confident	84.3	Confident	3 Å²	3	49.3 Å²	49.3	3%	0.025	24%	0.236	C	C	.	.	H	α-helix	trans	-68.1	-39.3	174.6	0	0	0	0	0	112.2	L623 S624 D640 T641 E642 L647 V648	L623-A644 HydrophobicContact CB-CB 3.77Å; S624-A644 WeakPolarHBondContact OG-CB 3.33Å; D640-A644 WeakPolarHBondContact O-CB 3.29Å; D640-A644 PolarHBondContact O-N 3.17Å; T641-A644 PolarHBondContact O-N 3.05Å; E642-A644 VanDerWaalsContact C-N 3.29Å; E642-A644 PolarHBondContact O-N 2.98Å; A644-L647 PolarHBondContact O-N 3.47Å; A644-V648 WeakPolarHBondContact O-CG2 3.1Å; A644-V648 PolarHBondContact O-N 3.36Å; A644-V648 VanDerWaalsContact O-N 3.12Å
645	V	88.8	Confident	82.4	Confident	8 Å²	8	48.8 Å²	48.8	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-67.8	-43	175.7	170.4	0	0	0	0	111	E592 L620 T641 E642 L647 V648 Q649	E592-V645 HydrophobicContact CB-CG1 4.5Å; E592-V645 HydrophobicContact CB-CG2 3.96Å; E592-V645 HydrophobicContact CG-CG1 4.25Å; E592-V645 HydrophobicContact CG-CG2 4.03Å; L620-V645 HydrophobicContact CD2-CG2 3.76Å; T641-V645 VanDerWaalsContact O-CG2 3.29Å; T641-V645 WeakPolarHBondContact O-CG2 3.12Å; T641-V645 PolarHBondContact O-N 3.16Å; E642-V645 PolarHBondContact O-N 3.12Å; E642-V645 VanDerWaalsContact O-N 3.11Å; V645-L647 VanDerWaalsContact C-N 3.33Å; V645-L647 PolarHBondContact O-N 3.19Å; V645-V648 PolarHBondContact O-N 2.72Å; V645-Q649 HydrophobicContact CG1-CG 4.12Å; V645-Q649 WeakPolarHBondContact O-CB 3.09Å; V645-Q649 WeakPolarHBondContact O-CG 3.45Å; V645-Q649 PolarHBondContact O-N 3.29Å
646	E	87.1	Confident	80.3	Confident	86 Å²	86	49.2 Å²	49.2	40%	0.402	23%	0.233	S	C	.	.	H	α-helix	trans	-54.6	-47.1	173	-73.2	-172.3	156.2	0	0	111.9	E642 V648 Q649 F650	E642-E646 PolarHBondContact O-N 2.98Å; E646-V648 VanDerWaalsContact C-N 3.33Å; E646-V648 PolarHBondContact O-N 2.79Å; E646-Q649 PolarHBondContact O-N 2.88Å; E646-F650 WeakPolarHBondContact O-CB 3.14Å; E646-F650 PolarHBondContact O-N 3.26Å
647	L	86.4	Confident	78.3	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.016	26%	0.256	C	S	.	.	H	α-helix	trans	-61.6	-40.3	178.8	-77.9	165.6	0	0	0	112.3	Y311 K314 V643 A644 V645 A651	Y311-L647 HydrophobicContact CD1-CD2 3.94Å; Y311-L647 WeakPolarHBondContact O-CD2 3.4Å; K314-L647 HydrophobicContact CB-CD1 4.43Å; K314-L647 HydrophobicContact CB-CD2 3.91Å; K314-L647 HydrophobicContact CD-CD2 4.25Å; V643-L647 HydrophobicContact CG1-CD1 4.37Å; V643-L647 WeakPolarHBondContact O-CG 3.45Å; V643-L647 PolarHBondContact O-N 2.82Å; A644-L647 PolarHBondContact O-N 3.47Å; V645-L647 VanDerWaalsContact C-N 3.33Å; V645-L647 PolarHBondContact O-N 3.19Å; L647-A651 PolarHBondContact O-N 2.6Å
648	V	86.2	Confident	76	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.024	28%	0.279	C	S	.	.	H	α-helix	trans	-69.2	-48.8	175.5	168.5	0	0	0	0	110.6	L480 L596 T619 L620 L623 A644 V645 E646 F650 A651 Y652	L480-V648 HydrophobicContact CD2-CG2 4.24Å; L596-V648 HydrophobicContact CD1-CG1 4.22Å; T619-V648 HydrophobicContact CG2-CG2 4.39Å; L620-V648 HydrophobicContact CD2-CB 4.18Å; L620-V648 HydrophobicContact CD2-CG2 3.74Å; L620-V648 HydrophobicContact CG-CG2 4.42Å; L623-V648 HydrophobicContact CD1-CG2 3.75Å; A644-V648 WeakPolarHBondContact O-CG2 3.1Å; A644-V648 PolarHBondContact O-N 3.36Å; A644-V648 VanDerWaalsContact O-N 3.12Å; V645-V648 PolarHBondContact O-N 2.72Å; E646-V648 VanDerWaalsContact C-N 3.33Å; E646-V648 PolarHBondContact O-N 2.79Å; V648-F650 VanDerWaalsContact C-N 3.29Å; V648-F650 PolarHBondContact O-N 3.25Å; V648-A651 PolarHBondContact O-N 3.27Å; V648-Y652 HydrophobicContact CG1-CD2 3.74Å; V648-Y652 HydrophobicContact CG1-CE2 3.89Å; V648-Y652 VanDerWaalsContact O-CD2 3.26Å; V648-Y652 WeakPolarHBondContact O-CD2 3.48Å; V648-Y652 PolarHBondContact O-N 2.93Å
649	Q	83.6	Confident	73.6	Confident	58 Å²	58	62.3 Å²	62.3	27%	0.271	29%	0.292	S	S	.	.	H	α-helix	trans	-56.9	-43.3	178.6	-72.4	-174.4	8.9	0	0	111.7	R595 L596 V645 E646 A651 Y652 F653	R595-Q649 VanDerWaalsContact NH2-NE2 3.17Å; L596-Q649 HydrophobicContact CD2-CG 4.05Å; V645-Q649 HydrophobicContact CG1-CG 4.12Å; V645-Q649 WeakPolarHBondContact O-CB 3.09Å; V645-Q649 WeakPolarHBondContact O-CG 3.45Å; V645-Q649 PolarHBondContact O-N 3.29Å; E646-Q649 PolarHBondContact O-N 2.88Å; Q649-A651 VanDerWaalsContact C-N 3.32Å; Q649-A651 PolarHBondContact O-N 3.25Å; Q649-Y652 PolarHBondContact O-N 2.9Å; Q649-F653 HydrophobicContact CB-CD2 4.07Å; Q649-F653 HydrophobicContact CB-CE2 4.41Å; Q649-F653 HydrophobicContact CG-CD2 4.32Å; Q649-F653 HydrophobicContact CG-CE2 4.16Å; Q649-F653 WeakPolarHBondContact O-CB 3.36Å; Q649-F653 WeakPolarHBondContact O-CD2 3.28Å; Q649-F653 PolarHBondContact O-N 3.48Å
650	F	83.1	Confident	71.1	Confident	107 Å²	107	66.3 Å²	66.3	47%	0.469	31%	0.31	S	S	.	.	H	α-helix	trans	-62.7	-34.1	175.8	-177.9	-95.5	0	0	0	113.6	Y311 F482 E646 V648	Y311-F650 HydrophobicContact CD1-CG 4.48Å; Y311-F650 HydrophobicContact CD2-CD1 4.02Å; Y311-F650 AromaticContact CD2-CD2 3.82Å; Y311-F650 HydrophobicContact CD2-CD2 3.82Å; Y311-F650 AromaticContact CD2-CE1 3.94Å; Y311-F650 HydrophobicContact CD2-CE1 3.94Å; Y311-F650 AromaticContact CD2-CE2 3.73Å; Y311-F650 HydrophobicContact CD2-CE2 3.73Å; Y311-F650 AromaticContact CD2-CG 3.97Å; Y311-F650 HydrophobicContact CD2-CG 3.97Å; Y311-F650 AromaticContact CD2-CZ 3.79Å; Y311-F650 HydrophobicContact CD2-CZ 3.79Å; Y311-F650 AromaticContact CE2-CD2 3.92Å; Y311-F650 HydrophobicContact CE2-CD2 3.92Å; Y311-F650 AromaticContact CE2-CE2 3.98Å; Y311-F650 HydrophobicContact CE2-CE2 3.98Å; Y311-F650 HydrophobicContact CE2-CG 4.37Å; Y311-F650 HydrophobicContact CE2-CZ 4.49Å; Y311-F650 AromaticContact CG-CD1 3.91Å; Y311-F650 HydrophobicContact CG-CD1 3.91Å; Y311-F650 HydrophobicContact CG-CD2 4.35Å; Y311-F650 HydrophobicContact CG-CE1 4.12Å; Y311-F650 HydrophobicContact CG-CG 4.03Å; Y311-F650 HydrophobicContact CG-CZ 4.44Å; F482-F650 HydrophobicContact CD1-CD1 4.17Å; F482-F650 HydrophobicContact CD1-CE1 4.21Å; F482-F650 HydrophobicContact CE1-CD1 4Å; F482-F650 HydrophobicContact CE1-CE1 4.41Å; E646-F650 WeakPolarHBondContact O-CB 3.14Å; E646-F650 PolarHBondContact O-N 3.26Å; V648-F650 VanDerWaalsContact C-N 3.29Å; V648-F650 PolarHBondContact O-N 3.25Å
651	A	77.6	Confident	68.7	Low	6 Å²	6	75.8 Å²	75.8	5%	0.05	35%	0.352	C	S	.	.	H	α-helix	trans	-76.3	-36.5	178	0	0	0	0	0	113.5	L480 L481 F482 T609 L647 V648 Q649	L480-A651 HydrophobicContact CD2-CB 4.09Å; L481-A651 WeakPolarHBondContact O-CB 3.5Å; F482-A651 HydrophobicContact CD1-CB 4.31Å; F482-A651 HydrophobicContact CE1-CB 3.99Å; T609-A651 PolarHBondContact OG1-O 3.32Å; T609-A651 VanDerWaalsContact OG1-O 3.06Å; L647-A651 PolarHBondContact O-N 2.6Å; V648-A651 PolarHBondContact O-N 3.27Å; Q649-A651 VanDerWaalsContact C-N 3.32Å; Q649-A651 PolarHBondContact O-N 3.25Å
652	Y	71.6	Confident	66.1	Low	20 Å²	20	85.1 Å²	85.1	8%	0.078	39%	0.392	C	S	.	.	H	α-helix	trans	-87.2	-38.6	-175.4	-79.6	-106	0	0	0	113.2	S610 V612 T616 V648 Q649 K654	S610-Y652 WeakPolarHBondContact OG-CE1 3.24Å; V612-Y652 HydrophobicContact CG2-CD1 4.33Å; V612-Y652 HydrophobicContact CG2-CE1 4.39Å; T616-Y652 HydrophobicContact CG2-CE1 4.23Å; T616-Y652 WeakPolarHBondContact CG2-OH 3.44Å; V648-Y652 HydrophobicContact CG1-CD2 3.74Å; V648-Y652 HydrophobicContact CG1-CE2 3.89Å; V648-Y652 VanDerWaalsContact O-CD2 3.26Å; V648-Y652 WeakPolarHBondContact O-CD2 3.48Å; V648-Y652 PolarHBondContact O-N 2.93Å; Q649-Y652 PolarHBondContact O-N 2.9Å; Y652-K654 PolarHBondContact O-N 3.5Å
653	F	65.2	Low	63.6	Low	58 Å²	58	91.6 Å²	91.6	25%	0.254	41%	0.412	S	S	.	.			trans	-95.3	81.6	-173.4	-65	-69.7	0	0	0	112.9	L596 Q649	L596-F653 HydrophobicContact CD2-CE2 3.64Å; L596-F653 HydrophobicContact CD2-CZ 4.01Å; Q649-F653 HydrophobicContact CB-CD2 4.07Å; Q649-F653 HydrophobicContact CB-CE2 4.41Å; Q649-F653 HydrophobicContact CG-CD2 4.32Å; Q649-F653 HydrophobicContact CG-CE2 4.16Å; Q649-F653 WeakPolarHBondContact O-CB 3.36Å; Q649-F653 WeakPolarHBondContact O-CD2 3.28Å; Q649-F653 PolarHBondContact O-N 3.48Å
654	K	59.5	Low	60.9	Low	81 Å²	81	96.5 Å²	96.5	35%	0.352	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-99.1	122.7	159.7	-161.7	64.5	172.6	-179.3	0	109.8	T609 Y652 V656	T609-K654 HydrophobicContact CG2-CB 4.39Å; Y652-K654 PolarHBondContact O-N 3.5Å; K654-V656 PolarHBondContact O-N 3.03Å
655	K	50.8	Low	58.3	Low	168 Å²	168	107.4 Å²	107.4	73%	0.73	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-70.7	124	172.7	-63.9	-176.1	-179.4	-177.7	0	109.2
656	V	47.1	Very low	55.6	Low	44 Å²	44	116.1 Å²	116.1	27%	0.267	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-72.8	136.2	162.2	162.5	0	0	0	0	108.1	A607 K654	A607-V656 HydrophobicContact CB-CG2 3.95Å; K654-V656 PolarHBondContact O-N 3.03Å
657	L	47.8	Very low	53	Low	96 Å²	96	119.7 Å²	119.7	50%	0.503	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-86.9	120.2	172.1	-66.1	176.4	0	0	0	108.1	Y461	Y461-L657 VanDerWaalsContact CD1-O 3.26Å; Y461-L657 WeakPolarHBondContact CD1-O 3.43Å
658	E	42.1	Very low	50.4	Low	169 Å²	169	130 Å²	130	79%	0.79	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-67.4	139.1	168.8	-66.3	-156.4	136.5	0	0	110.2	E660	E658-E660 PolarHBondContact O-N 3.2Å
659	K	39.6	Very low	47.7	Very low	156 Å²	156	137.1 Å²	137.1	68%	0.678	62%	0.621	S	S	*	*			trans	-81.3	112.7	171.9	-169	176	-175.6	178.4	0	108	Y461 K661	Y461-K659 HydrophobicContact CD1-CB 3.77Å; Y461-K659 HydrophobicContact CD1-CG 4.49Å; Y461-K659 HydrophobicContact CE1-CB 3.81Å; Y461-K659 HydrophobicContact CE1-CG 4.23Å; K659-K661 PolarHBondContact O-N 2.96Å
660	E	35.4	Very low	45.1	Very low	184 Å²	184	140 Å²	140	86%	0.86	65%	0.648	S	S	*	*			trans	-50.4	117.6	173.7	-73.4	-164.2	158.3	0	0	109.9	E658 K662	E658-E660 PolarHBondContact O-N 3.2Å; E660-K662 PolarHBondContact O-N 3.01Å
661	K	36.9	Very low	42.6	Very low	199 Å²	199	142.4 Å²	142.4	87%	0.865	67%	0.665	S	S	*	*			trans	-66.1	102.8	173.3	-72.7	178.8	180	172.1	0	107.2	K659 R663	K659-K661 PolarHBondContact O-N 2.96Å; K661-R663 PolarHBondContact O-N 3.11Å
662	K	36.2	Very low	40.3	Very low	197 Å²	197	147.4 Å²	147.4	86%	0.857	70%	0.7	S	S	*	*			trans	-47.3	114.6	164.4	-85.2	-171	173.5	-176	0	107.3	E660 T664	E660-K662 PolarHBondContact O-N 3.01Å; K662-T664 PolarHBondContact O-N 3.19Å
663	R	34.2	Very low	38.3	Very low	245 Å²	245	155.2 Å²	155.2	93%	0.925	74%	0.738	S	S	*	*			trans	-62	98.1	176.9	-76.4	178	165.2	177.6	-5.1	108.4	K661 R665	K661-R663 PolarHBondContact O-N 3.11Å; R663-R665 PolarHBondContact O-N 2.9Å
664	T	30.9	Very low	36.7	Very low	134 Å²	134	160.9 Å²	160.9	82%	0.822	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-58.1	125.8	166.9	-43.3	0	0	0	0	107.2	K662 Q666	K662-T664 PolarHBondContact O-N 3.19Å; T664-Q666 PolarHBondContact O-N 3.38Å
665	R	33.9	Very low	35.3	Very low	233 Å²	233	164 Å²	164	88%	0.879	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-60.2	129.5	173.9	-79.3	178.8	169.5	165.7	-4.6	108.4	R663 D667	R663-R665 PolarHBondContact O-N 2.9Å; R665-D667 PolarHBondContact O-N 2.94Å
666	Q	32.3	Very low	34.2	Very low	190 Å²	190	163.3 Å²	163.3	89%	0.888	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.3	126.4	160.1	-81.9	172.4	-46.4	0	0	108.1	T664	T664-Q666 PolarHBondContact O-N 3.38Å
667	D	32.6	Very low	33.4	Very low	161 Å²	161	169.5 Å²	169.5	86%	0.861	82%	0.821	S	S	*	*			trans	-124.2	152.8	150	-103.7	-44.4	0	0	0	107.9	R665	R665-D667 PolarHBondContact O-N 2.94Å
668	R	31.9	Very low	32.5	Very low	221 Å²	221	173.7 Å²	173.7	83%	0.834	84%	0.838	S	S	*	*			trans	-98.9	160.1	-165.8	-69.2	177.4	169.7	171.2	-5.5	112.6
669	D	30.1	Very low	31.8	Very low	153 Å²	153	174.9 Å²	174.9	82%	0.818	84%	0.844	S	S	*	*			trans	61.4	121.5	159.6	-47.3	-30.7	0	0	0	115.6
670	S	28.5	Very low	31.2	Very low	118 Å²	118	171.5 Å²	171.5	83%	0.825	85%	0.845	S	S	*	*				-161.8	146.8	61.7	59.4	0	0	0	0	115.3
671	D	29.9	Very low	31.4	Very low	157 Å²	157	168.5 Å²	168.5	84%	0.84	84%	0.842	S	S	*	*			trans	-11.2	163.7	165.7	-122.1	-19	0	0	0	125.4
672	S	29.6	Very low	32	Very low	112 Å²	112	164.7 Å²	164.7	78%	0.783	84%	0.837	S	S	*	*			trans	94.4	141.9	154.7	66.9	0	0	0	0	121.2
673	E	30.8	Very low	31.5	Very low	184 Å²	184	161.1 Å²	161.1	86%	0.86	84%	0.837	S	S	*	*			trans	-102.6	-177.3	-160.7	-58.8	174.8	134.1	0	0	113.6
674	E	31.2	Very low	31.1	Very low	176 Å²	176	157.8 Å²	157.8	82%	0.822	83%	0.832	S	S	*	*			trans	112.9	95.3	157.8	-60.5	-173.6	176.3	0	0	118
675	D	29.7	Very low	30.9	Very low	148 Å²	148	162.4 Å²	162.4	79%	0.791	83%	0.834	S	S	*	*				49.1	132.6	127.2	-59.9	-5.9	0	0	0	124.6
676	D	28.7	Very low	30.5	Very low	153 Å²	153	155.8 Å²	155.8	82%	0.818	82%	0.824	S	S	*	*			trans	31.8	128.4	143.9	-66.6	-17.2	0	0	0	122.8
677	D	28.4	Very low	30.3	Very low	173 Å²	173	154.8 Å²	154.8	93%	0.925	82%	0.819	S	S	*	*				-161	149.9	119.9	-115.2	-26.5	0	0	0	112.7
678	E	29.3	Very low	29.9	Very low	184 Å²	184	157.5 Å²	157.5	86%	0.86	82%	0.817	S	S	*	*			trans	-91.7	179	179.9	-85.6	-162.2	131.8	0	0	114.1
679	E	27.5	Very low	29.5	Very low	194 Å²	194	152 Å²	152	91%	0.907	81%	0.808	S	S	*	*			trans	85.8	138.2	163.4	-59.8	-154.2	132	0	0	120.8
680	A	27.2	Very low	29.3	Very low	86 Å²	86	156 Å²	156	71%	0.711	81%	0.812	S	S	*	*			trans	-118.3	-171.6	169.2	0	0	0	0	0	107
681	P	39.3	Very low	29.1	Very low	121 Å²	121	159.5 Å²	159.5	79%	0.786	81%	0.812	S	S	*	*			cis	-136.7	-126	6.6	33.3	-5.1	0	0	0	112.5
682	P	49.3	Very low	28.8	Very low	118 Å²	118	164 Å²	164	77%	0.766	82%	0.818	S	S	*	*				-124.7	169.5	-127.4	37.8	-17.4	0	0	0	115.8
683	S	26.3	Very low	28.6	Very low	122 Å²	122	162.6 Å²	162.6	85%	0.853	82%	0.82	S	S	*	*			trans	-151.9	149.1	154.8	56.5	0	0	0	0	116.2
684	Q	26.6	Very low	28.3	Very low	175 Å²	175	165.1 Å²	165.1	82%	0.818	82%	0.822	S	S	*	*			trans	-49.6	163.5	176.8	-56.6	159.9	8.6	0	0	112.5
685	R	25.9	Very low	28	Very low	231 Å²	231	165.9 Å²	165.9	87%	0.872	83%	0.826	S	S	*	*				-178.1	159.4	56.1	-158.4	171.1	-175.1	175.9	2	111.8
686	S	25.7	Very low	27.8	Very low	95 Å²	95	162.7 Å²	162.7	66%	0.664	83%	0.828	S	S	*	*			trans	-84.9	150.8	176.9	52.7	0	0	0	0	114.1
687	Q	27.3	Very low	27.6	Very low	168 Å²	168	161 Å²	161	79%	0.785	83%	0.828	S	S	*	*				167.6	134	116.9	-89.1	179.5	20.4	0	0	115.2
688	R	24.8	Very low	27.6	Very low	218 Å²	218	162.4 Å²	162.4	82%	0.823	83%	0.829	S	S	*	*				29.6	143.1	128.5	-55.6	179.4	97.8	175.8	7.9	119.5
689	T	24.3	Very low	27.4	Very low	105 Å²	105	159.7 Å²	159.7	64%	0.644	83%	0.83	S	S	*	*			cis	-177.6	154.7	4.9	19.4	0	0	0	0	111.9
690	R	24.8	Very low	27.3	Very low	238 Å²	238	155.8 Å²	155.8	90%	0.898	83%	0.825	S	S	*	*			trans	68.4	144.1	157.9	-66.2	167.1	174.5	-174.9	-2.8	115.7
691	K	25.4	Very low	27.5	Very low	192 Å²	192	160.6 Å²	160.6	84%	0.835	83%	0.833	S	S	*	*			cis	-163.6	146.2	42.1	-145.1	178.5	-167.9	177.7	0	112.3
692	R	23.7	Very low	27.1	Very low	251 Å²	251	160.4 Å²	160.4	95%	0.947	83%	0.831	S	S	*	*			trans	28.9	123.1	154.1	-76.1	-178.5	163.1	179.7	-5.7	121.7
693	G	25.2	Very low	26.1	Very low	82 Å²	82	164.3 Å²	164.3	85%	0.845	83%	0.832	S	S	*	*			trans	-153.3	158.6	154.7	0	0	0	0	0	109.7
694	R	24.2	Very low	26.2	Very low	237 Å²	237	163.5 Å²	163.5	89%	0.894	83%	0.826	S	S	*	*			trans	-133.8	149	-165	-174.2	-172.3	177.8	-178.1	-1	112
695	Q	25.5	Very low	26.3	Very low	192 Å²	192	158.9 Å²	158.9	90%	0.897	81%	0.812	S	S	*	*			trans	101.7	143	167.5	-61.1	-179.9	-50.4	0	0	117.3
696	G	24.9	Very low	26.4	Very low	81 Å²	81	159 Å²	159	84%	0.835	81%	0.814	S	S	*	*			trans	128.6	52.3	159.8	0	0	0	0	0	118
697	S	24.3	Very low	26.6	Very low	118 Å²	118	160.6 Å²	160.6	83%	0.825	82%	0.815	S	S	*	*			trans	-107.3	114.7	168.8	57.5	0	0	0	0	111.3
698	Q	27.4	Very low	26.4	Very low	202 Å²	202	162 Å²	162	94%	0.944	82%	0.819	S	S	*	*			trans	-139.3	108.6	162	-79.7	-171.5	-18.4	0	0	109.5
699	S	26.1	Very low	26.4	Very low	127 Å²	127	156 Å²	156	89%	0.888	81%	0.81	S	S	*	*			trans	-136.5	118.6	154.3	47.5	0	0	0	0	105.6
700	S	25.6	Very low	26.5	Very low	113 Å²	113	159.4 Å²	159.4	79%	0.79	82%	0.818	S	S	*	*			trans	-120	110.5	-176.3	53.3	0	0	0	0	109
701	E	30.4	Very low	26.5	Very low	187 Å²	187	155.8 Å²	155.8	87%	0.874	81%	0.812	S	S	*	*			trans	-76	154.3	145.9	-64.6	-172	155.6	0	0	108.4
702	P	30.6	Very low	26.4	Very low	117 Å²	117	154.2 Å²	154.2	76%	0.76	81%	0.807	S	S	*	*				-143	179.8	101	44.4	-31	0	0	0	110.6
703	Y	29.5	Very low	26.4	Very low	200 Å²	200	149.5 Å²	149.5	78%	0.784	80%	0.801	S	S	*	*			cis	-159.9	154.8	14.2	-169.8	-120.5	0	0	0	108.9	P705	Y703-P705 HydrophobicContact CD1-CG 4.09Å; Y703-P705 HydrophobicContact CE1-CB 4.23Å; Y703-P705 HydrophobicContact CE1-CG 4.17Å
704	S	28.2	Very low	26.6	Very low	104 Å²	104	151.7 Å²	151.7	73%	0.727	80%	0.797	S	S	*	*			trans	-123.9	123.5	161.7	-164.6	0	0	0	0	109.1
705	P	28.4	Very low	26.8	Very low	79 Å²	79	146.5 Å²	146.5	51%	0.513	79%	0.794	S	S	.	*	S	Bend	trans	-73.1	149.6	178.3	-16.1	31	0	0	0	112.8	Y703	Y703-P705 HydrophobicContact CD1-CG 4.09Å; Y703-P705 HydrophobicContact CE1-CB 4.23Å; Y703-P705 HydrophobicContact CE1-CG 4.17Å
706	Y	27.9	Very low	26.8	Very low	234 Å²	234	145.3 Å²	145.3	92%	0.918	79%	0.789	S	S	*	*			trans	81.4	71.9	176.2	-51.3	-71.6	0	0	0	116.6
707	D	29.2	Very low	26.9	Very low	127 Å²	127	147.4 Å²	147.4	68%	0.679	78%	0.78	S	S	*	*			trans	-106.8	146.3	152.1	171.5	27.2	0	0	0	108.7	S709	D707-S709 PolarHBondContact OD1-N 2.85Å
708	F	23.9	Very low	27	Very low	199 Å²	199	150.6 Å²	150.6	87%	0.873	78%	0.782	S	S	*	*			trans	-165.9	88.3	146.6	-92.9	-59.5	0	0	0	110.9
709	S	25.5	Very low	26.9	Very low	90 Å²	90	146 Å²	146	63%	0.629	78%	0.778	S	S	*	*				39.7	143.6	129.1	65.9	0	0	0	0	123.7	D707	D707-S709 PolarHBondContact OD1-N 2.85Å
710	E	25.5	Very low	26.8	Very low	177 Å²	177	143.8 Å²	143.8	83%	0.827	78%	0.775	S	S	*	*			trans	-48.8	167.2	162	-57.1	155.3	151.8	0	0	113.6
711	E	24.9	Very low	26.9	Very low	163 Å²	163	145.1 Å²	145.1	76%	0.762	78%	0.779	S	S	*	*			cis	-165.8	176.6	26.4	-152.4	178.9	-140.3	0	0	111.7
712	Q	23.8	Very low	27.1	Very low	158 Å²	158	141.8 Å²	141.8	74%	0.738	77%	0.773	S	S	*	*			trans	105.6	125.6	155.7	-72.1	178.8	3.8	0	0	124.4
713	D	23.8	Very low	27	Very low	153 Å²	153	145.8 Å²	145.8	82%	0.818	78%	0.779	S	S	*	*			trans	80.3	138.3	147.6	-67.6	-8.2	0	0	0	125
714	V	29.2	Very low	27.1	Very low	127 Å²	127	142.1 Å²	142.1	77%	0.77	78%	0.78	S	S	*	*			trans	-115.6	152.8	-170.2	-163.4	0	0	0	0	109.7
715	P	27.6	Very low	26.9	Very low	128 Å²	128	141.4 Å²	141.4	83%	0.831	78%	0.78	S	S	*	*				-146.3	166.6	126.3	32.2	-14.3	0	0	0	117.4
716	E	25.7	Very low	26.9	Very low	167 Å²	167	145.8 Å²	145.8	78%	0.78	79%	0.791	S	S	*	*			trans	-118	157.5	-175.7	-85.2	-158.9	134.7	0	0	111.2
717	I	26.8	Very low	27	Very low	126 Å²	126	140.2 Å²	140.2	65%	0.646	78%	0.784	S	S	*	*			cis	-154.3	157.5	-10.3	-80.6	143.7	0	0	0	104.7
718	Q	26.4	Very low	26.9	Very low	184 Å²	184	140.8 Å²	140.8	86%	0.86	78%	0.782	S	S	*	*			trans	161.4	114.5	130.5	-84.5	-175	14.8	0	0	117.9
719	A	26.1	Very low	27	Very low	106 Å²	106	139.7 Å²	139.7	88%	0.876	78%	0.78	S	S	*	*				47.9	129.9	128.6	0	0	0	0	0	124.7
720	G	24.1	Very low	27	Very low	80 Å²	80	142.3 Å²	142.3	83%	0.825	78%	0.782	S	S	*	*			trans	176.5	125	157.4	0	0	0	0	0	114.6
721	T	26.6	Very low	26.9	Very low	142 Å²	142	143.5 Å²	143.5	87%	0.871	79%	0.788	S	S	*	*			trans	-115.1	179.6	176	59.4	0	0	0	0	110.3
722	P	35.1	Very low	27	Very low	116 Å²	116	143.6 Å²	143.6	75%	0.753	79%	0.788	S	S	*	*			cis	-141.3	178.4	3.9	41.5	-20.8	0	0	0	118.8
723	K	28.5	Very low	27.4	Very low	201 Å²	201	145.2 Å²	145.2	87%	0.874	80%	0.796	S	S	*	*			trans	-2.6	160.9	154.9	-77.6	178.4	-179.6	175.5	0	122.2
724	P	31.9	Very low	27.8	Very low	123 Å²	123	143.8 Å²	143.8	80%	0.799	80%	0.795	S	S	*	*			cis	-145.1	154.1	41.8	41.3	-19.9	0	0	0	117.8
725	A	24.7	Very low	27.7	Very low	90 Å²	90	146.2 Å²	146.2	74%	0.744	80%	0.8	S	S	*	*				95	113.4	77.5	0	0	0	0	0	119.7
726	K	26.8	Very low	27.7	Very low	170 Å²	170	149 Å²	149	74%	0.739	80%	0.802	S	S	*	*			trans	60.6	168.4	135.1	-78.5	-159.9	178.5	-164	0	122.3
727	P	30.7	Very low	27.6	Very low	117 Å²	117	145.3 Å²	145.3	76%	0.76	80%	0.799	S	S	*	*			cis	-114.8	177.8	-2.3	40.3	-25.6	0	0	0	113.3
728	Q	26.3	Very low	27.5	Very low	140 Å²	140	146.8 Å²	146.8	65%	0.654	81%	0.807	S	S	*	*			cis	88.6	136.6	23.6	-125.3	-178.7	-4.3	0	0	116.9
729	Q	26.4	Very low	27.6	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	80%	0.798	S	S	*	*			trans	88.3	141.8	-174.6	-60.3	170.3	-16.5	0	0	114.7
730	Q	25.7	Very low	27.6	Very low	145 Å²	145	146.9 Å²	146.9	68%	0.678	80%	0.8	S	S	*	*			cis	-158.3	149	-4	-123.2	161.8	-41.2	0	0	109.1
731	E	24	Very low	27.9	Very low	202 Å²	202	147.9 Å²	147.9	94%	0.944	80%	0.801	S	S	*	*			trans	-106	123.6	160.2	-82.6	-179.2	149.2	0	0	108.5
732	E	26.8	Very low	28.1	Very low	166 Å²	166	151 Å²	151	78%	0.776	81%	0.805	S	S	*	*			trans	-128.2	135.6	161.8	-71.9	-172.3	159.8	0	0	107.6
733	E	31.4	Very low	28	Very low	192 Å²	192	149.2 Å²	149.2	90%	0.897	81%	0.808	S	S	*	*			trans	-70	155	165.1	-64.1	-176.2	158.1	0	0	109.8
734	P	32.8	Very low	28.5	Very low	123 Å²	123	143.2 Å²	143.2	80%	0.799	80%	0.803	S	S	*	*				-146.1	174.9	110.2	35.1	-18.6	0	0	0	116.5
735	M	26.3	Very low	29.1	Very low	178 Å²	178	146 Å²	146	88%	0.877	81%	0.806	S	S	*	*			trans	-56.5	161.9	-176.1	-75.8	167.9	-109.4	0	0	118.3
736	E	28.1	Very low	30.8	Very low	187 Å²	187	143.3 Å²	143.3	87%	0.874	78%	0.78	S	S	*	*			trans	-7	126.9	156.9	-54.9	179.9	146.1	0	0	119.1
737	A	24.3	Very low	32.5	Very low	88 Å²	88	138.4 Å²	138.4	73%	0.727	77%	0.767	S	S	*	*				172.6	127.5	106.1	0	0	0	0	0	115
738	I	25.5	Very low	34.3	Very low	157 Å²	157	136.3 Å²	136.3	81%	0.805	76%	0.76	S	S	*	*			trans	66	114.8	143.2	-57.3	169.8	0	0	0	120.4
739	S	27.5	Very low	36.4	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	76%	0.763	S	S	*	*			trans	57.6	115	153.9	73.9	0	0	0	0	120.1
740	Q	26.9	Very low	38.6	Very low	196 Å²	196	131.6 Å²	131.6	92%	0.916	74%	0.735	S	S	*	*				-161.4	146.2	83.8	-93.5	172	15.2	0	0	109.7
741	A	29.9	Very low	40.9	Very low	101 Å²	101	125.6 Å²	125.6	84%	0.835	71%	0.708	S	S	*	*			trans	-110.7	123.8	-176	0	0	0	0	0	110.9
742	E	30.5	Very low	43.5	Very low	207 Å²	207	123.6 Å²	123.6	97%	0.967	70%	0.696	S	S	*	*			trans	-158	110	156	-116.2	173.3	-156.5	0	0	109.1
743	G	31.9	Very low	45.7	Very low	78 Å²	78	119.8 Å²	119.8	80%	0.804	68%	0.678	S	S	*	*			trans	145.2	55.8	-171.5	0	0	0	0	0	113.2	E745	G743-E745 PolarHBondContact O-N 2.84Å; G743-E745 VanDerWaalsContact O-N 3.1Å
744	G	39.6	Very low	48	Very low	75 Å²	75	110.7 Å²	110.7	77%	0.773	64%	0.636	S	S	*	*			trans	-82.8	77.2	-173.2	0	0	0	0	0	114.4
745	E	44.5	Very low	50.1	Low	183 Å²	183	107.4 Å²	107.4	86%	0.855	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-87.6	130.6	161.2	-68.7	-167.6	168.5	0	0	110.6	G743	G743-E745 PolarHBondContact O-N 2.84Å; G743-E745 VanDerWaalsContact O-N 3.1Å
746	P	60.4	Low	52.5	Low	32 Å²	32	102.2 Å²	102.2	21%	0.208	59%	0.59	C	S	.	*	P	Polyproline II helix	trans	-73.8	128.3	176	28.9	-32.6	0	0	0	111
747	S	63.5	Low	54.5	Low	67 Å²	67	94 Å²	94	47%	0.469	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-62.6	149.8	176.9	70.6	0	0	0	0	112.2	E749 R750 L751	S747-E749 PolarHBondContact O-N 3.25Å; S747-R750 PolarHBondContact O-N 2.9Å; S747-R750 VanDerWaalsContact O-N 3.11Å; S747-L751 PolarHBondContact O-N 2.93Å; S747-L751 VanDerWaalsContact O-N 3.1Å
748	A	67.4	Low	57.1	Low	74 Å²	74	90 Å²	90	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-61.5	-27.3	-174.5	0	0	0	0	0	113.9	K752	A748-K752 PolarHBondContact O-N 3.2Å
749	E	70.4	Confident	59.4	Low	151 Å²	151	88.7 Å²	88.7	71%	0.706	51%	0.508	S	S	*	.	H	α-helix	trans	-70.5	-47.6	174.9	-64	179.5	151.6	0	0	111	S747 L751 K752 E753	S747-E749 PolarHBondContact O-N 3.25Å; E749-L751 PolarHBondContact O-N 2.98Å; E749-K752 WeakPolarHBondContact O-CB 3.39Å; E749-K752 PolarHBondContact O-N 3.22Å; E749-E753 PolarHBondContact O-N 3.04Å
750	R	72.9	Confident	61.6	Low	65 Å²	65	86.6 Å²	86.6	25%	0.245	50%	0.497	C	S	.	.	H	α-helix	trans	-63.8	-26.8	178.4	-151.7	175	173.3	-158	-12.6	112.4	S747 F754 R786 F787 E791	S747-R750 PolarHBondContact O-N 2.9Å; S747-R750 VanDerWaalsContact O-N 3.11Å; R750-F754 PolarHBondContact O-N 3.38Å; R750-R786 PolarHBondContact NH2-O 3.4Å; R750-F787 HydrophobicContact CG-CE1 3.75Å; R750-F787 HydrophobicContact CG-CZ 3.95Å; R750-E791 IonicContact CZ-OE1 3.3Å; R750-E791 IonicContact CZ-OE2 2.91Å; R750-E791 IonicContact NH1-OE1 3.28Å; R750-E791 PolarHBondContact NH1-OE1 3.3Å; R750-E791 IonicContact NH1-OE2 3.6Å; R750-E791 IonicContact NH2-OE1 2.65Å; R750-E791 PolarHBondContact NH2-OE1 2.89Å; R750-E791 IonicContact NH2-OE2 3.15Å; R750-E791 PolarHBondContact NH2-OE2 3.13Å; R750-E791 VanDerWaalsContact NH2-OE2 3.14Å
751	L	74.9	Confident	63.9	Low	19 Å²	19	78 Å²	78	10%	0.099	46%	0.458	C	S	.	.	H	α-helix	trans	-75.1	-36.9	173.3	-163.9	149.3	0	0	0	112.9	S747 E749 E753 F754 K755	S747-L751 PolarHBondContact O-N 2.93Å; S747-L751 VanDerWaalsContact O-N 3.1Å; E749-L751 PolarHBondContact O-N 2.98Å; L751-E753 VanDerWaalsContact C-N 3.34Å; L751-F754 PolarHBondContact O-N 3.32Å; L751-K755 HydrophobicContact CD2-CD 4.22Å; L751-K755 HydrophobicContact CD2-CG 4.36Å; L751-K755 PolarHBondContact O-N 2.64Å
752	K	77.1	Confident	66	Low	159 Å²	159	74.1 Å²	74.1	69%	0.691	42%	0.422	S	S	*	.	H	α-helix	trans	-63.6	-42	171.1	-71.9	178.5	-179.2	177.6	0	111.4	A748 E749 F754 K755 S756	A748-K752 PolarHBondContact O-N 3.2Å; E749-K752 WeakPolarHBondContact O-CB 3.39Å; E749-K752 PolarHBondContact O-N 3.22Å; K752-F754 VanDerWaalsContact C-N 3.32Å; K752-F754 PolarHBondContact O-N 2.93Å; K752-K755 PolarHBondContact O-N 2.79Å; K752-S756 PolarHBondContact O-N 3.5Å; K752-S756 VanDerWaalsContact O-N 3.11Å
753	E	73.9	Confident	67.9	Low	86 Å²	86	70.7 Å²	70.7	40%	0.402	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-36.7	173.6	-86.1	-173.4	-148.5	0	0	113.6	E749 L751 S756 S757 R783	E749-E753 PolarHBondContact O-N 3.04Å; L751-E753 VanDerWaalsContact C-N 3.34Å; E753-S756 PolarHBondContact O-OG 2.99Å; E753-S756 VanDerWaalsContact O-OG 3.08Å; E753-S757 PolarHBondContact O-N 2.98Å; E753-S757 PolarHBondContact O-OG 2.71Å; E753-R783 IonicContact OE2-NH1 3.2Å; E753-R783 PolarHBondContact OE2-NH1 3.08Å
754	F	78.9	Confident	69.7	Low	2 Å²	2	71.5 Å²	71.5	1%	0.009	40%	0.4	C	S	.	.	H	α-helix	trans	-66.4	-44.1	172.6	-178.8	-98	0	0	0	111.3	R750 L751 K752 S756 S757 L758 L775 I779 V792 A795 L796 M799	R750-F754 PolarHBondContact O-N 3.38Å; L751-F754 PolarHBondContact O-N 3.32Å; K752-F754 VanDerWaalsContact C-N 3.32Å; K752-F754 PolarHBondContact O-N 2.93Å; F754-S756 PolarHBondContact O-N 3.38Å; F754-S757 PolarHBondContact O-N 2.95Å; F754-L758 HydrophobicContact CE1-CD1 3.76Å; F754-L758 HydrophobicContact CZ-CD1 3.99Å; F754-L758 WeakPolarHBondContact O-CB 3.29Å; F754-L758 PolarHBondContact O-N 3.23Å; F754-L775 HydrophobicContact CE2-CD2 4.27Å; F754-L775 HydrophobicContact CZ-CD2 4.16Å; F754-I779 HydrophobicContact CD2-CD1 4.01Å; F754-I779 HydrophobicContact CE2-CD1 3.56Å; F754-I779 HydrophobicContact CZ-CD1 4.43Å; F754-V792 HydrophobicContact CE2-CB 4.35Å; F754-V792 HydrophobicContact CE2-CG1 3.86Å; F754-V792 HydrophobicContact CE2-CG2 3.98Å; F754-V792 HydrophobicContact CZ-CG1 3.93Å; F754-A795 HydrophobicContact CD1-CB 3.88Å; F754-A795 HydrophobicContact CE1-CB 4Å; F754-A795 HydrophobicContact CG-CB 4.3Å; F754-L796 HydrophobicContact CE1-CD2 4.11Å; F754-L796 HydrophobicContact CE1-CG 4.29Å; F754-L796 HydrophobicContact CZ-CD2 4.13Å; F754-L796 HydrophobicContact CZ-CG 4.11Å; F754-M799 HydrophobicContact CD1-SD 4.1Å; F754-M799 HydrophobicContact CE1-SD 4.02Å
755	K	78.1	Confident	70.9	Confident	53 Å²	53	70.3 Å²	70.3	23%	0.23	38%	0.383	C	S	.	.	H	α-helix	trans	-59.8	-42.4	178.4	-72.7	-167.9	-179.7	-166.1	0	112.8	L751 K752 F759 M799 D802	L751-K755 HydrophobicContact CD2-CD 4.22Å; L751-K755 HydrophobicContact CD2-CG 4.36Å; L751-K755 PolarHBondContact O-N 2.64Å; K752-K755 PolarHBondContact O-N 2.79Å; K755-F759 PolarHBondContact O-N 3.04Å; K755-F759 VanDerWaalsContact O-N 3.14Å; K755-M799 HydrophobicContact CD-CE 4.15Å; K755-M799 HydrophobicContact CD-SD 4.34Å; K755-M799 HydrophobicContact CG-CE 3.84Å; K755-M799 HydrophobicContact CG-SD 3.78Å; K755-D802 IonicContact NZ-OD2 2.69Å; K755-D802 PolarHBondContact NZ-OD2 3.35Å
756	S	76.4	Confident	71.7	Confident	69 Å²	69	70.4 Å²	70.4	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-67.3	-39.8	176.9	60.6	0	0	0	0	112.8	K752 E753 F754 F759 A760	K752-S756 PolarHBondContact O-N 3.5Å; K752-S756 VanDerWaalsContact O-N 3.11Å; E753-S756 PolarHBondContact O-OG 2.99Å; E753-S756 VanDerWaalsContact O-OG 3.08Å; F754-S756 PolarHBondContact O-N 3.38Å; S756-F759 PolarHBondContact O-N 2.73Å; S756-A760 PolarHBondContact O-N 2.87Å; S756-A760 VanDerWaalsContact O-N 3.09Å
757	S	70.4	Confident	72.1	Confident	15 Å²	15	71 Å²	71	11%	0.105	39%	0.391	C	S	.	.	H	α-helix	trans	-65.6	-44.4	177.6	-48	0	0	0	0	111.9	E753 F754 F759 A760 V761 R783	E753-S757 PolarHBondContact O-N 2.98Å; E753-S757 PolarHBondContact O-OG 2.71Å; F754-S757 PolarHBondContact O-N 2.95Å; S757-F759 VanDerWaalsContact C-N 3.34Å; S757-F759 PolarHBondContact O-N 2.92Å; S757-A760 PolarHBondContact O-N 2.97Å; S757-V761 WeakPolarHBondContact O-CG2 3.15Å; S757-V761 PolarHBondContact O-N 3.32Å; S757-R783 PolarHBondContact OG-NH2 3.45Å
758	L	78.4	Confident	72.4	Confident	5 Å²	5	75.9 Å²	75.9	3%	0.026	41%	0.406	C	S	.	.	H	α-helix	trans	-59.7	-45.4	176.9	-177	144.3	0	0	0	110.6	F754 A760 V761 F762 L775 L796 M799 L814	F754-L758 HydrophobicContact CE1-CD1 3.76Å; F754-L758 HydrophobicContact CZ-CD1 3.99Å; F754-L758 WeakPolarHBondContact O-CB 3.29Å; F754-L758 PolarHBondContact O-N 3.23Å; L758-A760 PolarHBondContact O-N 3.22Å; L758-V761 PolarHBondContact O-N 3.44Å; L758-F762 HydrophobicContact CD1-CE2 4.48Å; L758-F762 HydrophobicContact CD2-CD2 3.64Å; L758-F762 HydrophobicContact CD2-CE2 3.69Å; L758-F762 HydrophobicContact CG-CD2 3.96Å; L758-F762 HydrophobicContact CG-CE2 3.9Å; L758-F762 WeakPolarHBondContact O-CD2 3.4Å; L758-F762 PolarHBondContact O-N 3.25Å; L758-L775 HydrophobicContact CD1-CD1 4.13Å; L758-L775 HydrophobicContact CG-CD1 4.22Å; L758-L796 HydrophobicContact CD1-CD2 3.99Å; L758-M799 HydrophobicContact CD2-CE 4.48Å; L758-L814 HydrophobicContact CD2-CD1 4.2Å
759	F	73.4	Confident	72.8	Confident	128 Å²	128	75.2 Å²	75.2	56%	0.561	40%	0.397	S	S	*	.	H	α-helix	trans	-61.3	-42.1	176.7	-165.9	-94.6	0	0	0	112.7	K755 S756 S757 V761 F762 Q763	K755-F759 PolarHBondContact O-N 3.04Å; K755-F759 VanDerWaalsContact O-N 3.14Å; S756-F759 PolarHBondContact O-N 2.73Å; S757-F759 VanDerWaalsContact C-N 3.34Å; S757-F759 PolarHBondContact O-N 2.92Å; F759-V761 PolarHBondContact O-N 2.89Å; F759-F762 PolarHBondContact O-N 3.29Å; F759-Q763 WeakPolarHBondContact O-CB 3.39Å; F759-Q763 PolarHBondContact O-N 2.74Å
760	A	73.9	Confident	73.2	Confident	54 Å²	54	68.5 Å²	68.5	45%	0.446	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-40.1	175.8	0	0	0	0	0	112.7	S756 S757 L758 Q763 S764	S756-A760 PolarHBondContact O-N 2.87Å; S756-A760 VanDerWaalsContact O-N 3.09Å; S757-A760 PolarHBondContact O-N 2.97Å; L758-A760 PolarHBondContact O-N 3.22Å; A760-Q763 PolarHBondContact O-N 2.89Å; A760-S764 PolarHBondContact O-N 2.78Å; A760-S764 PolarHBondContact O-OG 2.73Å
761	V	74.4	Confident	73.4	Confident	15 Å²	15	71.6 Å²	71.6	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-65.5	-41.9	175.3	172.6	0	0	0	0	111.6	S757 L758 F759 S764 A765 E778	S757-V761 WeakPolarHBondContact O-CG2 3.15Å; S757-V761 PolarHBondContact O-N 3.32Å; L758-V761 PolarHBondContact O-N 3.44Å; F759-V761 PolarHBondContact O-N 2.89Å; V761-S764 PolarHBondContact O-N 3.21Å; V761-S764 PolarHBondContact O-OG 3.22Å; V761-S764 VanDerWaalsContact O-OG 3.06Å; V761-A765 WeakPolarHBondContact O-CB 3.36Å; V761-A765 PolarHBondContact O-N 3.05Å; V761-E778 HydrophobicContact CG2-CB 3.77Å
762	F	73.9	Confident	73.4	Confident	19 Å²	19	71.8 Å²	71.8	8%	0.083	38%	0.382	C	S	.	.	H	α-helix	trans	-65.1	-38.5	174.2	-86.9	-79.8	0	0	0	112.1	L758 F759 H766 A767 V770 I812 L814	L758-F762 HydrophobicContact CD1-CE2 4.48Å; L758-F762 HydrophobicContact CD2-CD2 3.64Å; L758-F762 HydrophobicContact CD2-CE2 3.69Å; L758-F762 HydrophobicContact CG-CD2 3.96Å; L758-F762 HydrophobicContact CG-CE2 3.9Å; L758-F762 WeakPolarHBondContact O-CD2 3.4Å; L758-F762 PolarHBondContact O-N 3.25Å; F759-F762 PolarHBondContact O-N 3.29Å; F762-H766 PolarHBondContact O-N 3.21Å; F762-H766 VanDerWaalsContact O-N 3.13Å; F762-A767 WeakPolarHBondContact CD1-O 3.44Å; F762-V770 HydrophobicContact CD1-CG2 3.97Å; F762-V770 HydrophobicContact CE1-CB 4.31Å; F762-V770 HydrophobicContact CE1-CG2 3.67Å; F762-V770 HydrophobicContact CZ-CB 4.19Å; F762-V770 HydrophobicContact CZ-CG2 3.98Å; F762-I812 HydrophobicContact CE2-CG2 4.31Å; F762-I812 HydrophobicContact CZ-CB 4.49Å; F762-I812 HydrophobicContact CZ-CG2 4.05Å; F762-L814 HydrophobicContact CD2-CD1 4.16Å; F762-L814 HydrophobicContact CE1-CB 4.29Å; F762-L814 HydrophobicContact CE2-CD1 4.24Å; F762-L814 HydrophobicContact CG-CD1 4.44Å
763	Q	72.4	Confident	73.3	Confident	135 Å²	135	68.9 Å²	68.9	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-66.3	-39	177.5	-169.2	172.6	11.1	0	0	112.5	F759 A760	F759-Q763 WeakPolarHBondContact O-CB 3.39Å; F759-Q763 PolarHBondContact O-N 2.74Å; A760-Q763 PolarHBondContact O-N 2.89Å
764	S	68.8	Low	73.2	Confident	95 Å²	95	71.5 Å²	71.5	66%	0.664	39%	0.388	S	S	*	.	H	α-helix	trans	-75.5	-34.3	177.4	70.5	0	0	0	0	113.3	A760 V761	A760-S764 PolarHBondContact O-N 2.78Å; A760-S764 PolarHBondContact O-OG 2.73Å; V761-S764 PolarHBondContact O-N 3.21Å; V761-S764 PolarHBondContact O-OG 3.22Å; V761-S764 VanDerWaalsContact O-OG 3.06Å
765	A	64.5	Low	73	Confident	51 Å²	51	71.4 Å²	71.4	42%	0.421	39%	0.387	S	S	.	.	H	α-helix	trans	-77.7	-20.3	179.7	0	0	0	0	0	114	V761 A767 V770	V761-A765 WeakPolarHBondContact O-CB 3.36Å; V761-A765 PolarHBondContact O-N 3.05Å; A765-A767 PolarHBondContact O-N 3.04Å; A765-A767 VanDerWaalsContact O-N 3.07Å; A765-V770 HydrophobicContact CB-CG2 4.39Å
766	H	61.7	Low	72.7	Confident	184 Å²	184	70.5 Å²	70.5	85%	0.852	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	29.5	179.5	-130.3	74.1	0	0	0	114.5	F762	F762-H766 PolarHBondContact O-N 3.21Å; F762-H766 VanDerWaalsContact O-N 3.13Å
767	A	69.2	Low	72.5	Confident	46 Å²	46	72.2 Å²	72.2	38%	0.38	39%	0.388	S	S	.	.	S	Bend	trans	-134.4	139.9	-175.1	0	0	0	0	0	110.5	F762 A765 S769	F762-A767 WeakPolarHBondContact CD1-O 3.44Å; A765-A767 PolarHBondContact O-N 3.04Å; A765-A767 VanDerWaalsContact O-N 3.07Å; A767-S769 PolarHBondContact O-N 3.26Å
768	Q	68.9	Low	72.4	Confident	169 Å²	169	75.5 Å²	75.5	79%	0.79	40%	0.402	S	S	*	.	S	Bend	trans	-74.7	-3.6	-179.4	-69.7	-179.2	-34.1	0	0	114.1	L814	Q768-L814 PolarHBondContact O-N 2.63Å
769	S	76.6	Confident	72	Confident	59 Å²	59	75.6 Å²	75.6	41%	0.413	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	136.3	176.6	62.6	0	0	0	0	112.4	A767 I812	A767-S769 PolarHBondContact O-N 3.26Å; S769-I812 VanDerWaalsContact CA-O 3.32Å; S769-I812 WeakPolarHBondContact CA-O 3Å
770	V	78.3	Confident	71.9	Confident	11 Å²	11	71.7 Å²	71.7	7%	0.067	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	135.4	180	179.3	0	0	0	0	109.5	F762 A765 K774 L775 I812	F762-V770 HydrophobicContact CD1-CG2 3.97Å; F762-V770 HydrophobicContact CE1-CB 4.31Å; F762-V770 HydrophobicContact CE1-CG2 3.67Å; F762-V770 HydrophobicContact CZ-CB 4.19Å; F762-V770 HydrophobicContact CZ-CG2 3.98Å; A765-V770 HydrophobicContact CB-CG2 4.39Å; V770-K774 HydrophobicContact CG1-CB 4.3Å; V770-L775 HydrophobicContact CG1-CB 4.3Å; V770-I812 PolarHBondContact N-O 3.15Å; V770-I812 PolarHBondContact O-N 3.37Å
771	K	78.1	Confident	71.6	Confident	130 Å²	130	75.4 Å²	75.4	57%	0.565	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	139.5	174	-68.7	-167.4	174.9	-167.4	0	110.6	T773 K774 L775 I811	K771-T773 PolarHBondContact O-N 3.48Å; K771-T773 VanDerWaalsContact O-N 3.13Å; K771-K774 PolarHBondContact O-N 2.93Å; K771-L775 PolarHBondContact O-N 3.18Å; K771-I811 HydrophobicContact CG-CG1 4.4Å
772	M	74.2	Confident	70.9	Confident	23 Å²	23	83.2 Å²	83.2	11%	0.113	43%	0.429	C	S	.	.	H	α-helix	trans	-55.8	-34.7	-177	-167.8	167.8	69.3	0	0	113.3	K774 L775 M776 D810	M772-K774 PolarHBondContact O-N 3.1Å; M772-L775 PolarHBondContact O-N 3.05Å; M772-M776 VanDerWaalsContact O-CG 3.25Å; M772-M776 WeakPolarHBondContact O-CG 3.42Å; M772-M776 PolarHBondContact O-N 3.35Å; M772-D810 HydrophobicContact CB-CB 4.47Å; M772-D810 PolarHBondContact N-O 2.93Å
773	T	74.8	Confident	70.1	Confident	98 Å²	98	86.1 Å²	86.1	60%	0.601	44%	0.439	S	S	*	.	H	α-helix	trans	-61.5	-43.9	175.6	51.9	0	0	0	0	113.3	K771 M776 D777	K771-T773 PolarHBondContact O-N 3.48Å; K771-T773 VanDerWaalsContact O-N 3.13Å; T773-M776 PolarHBondContact O-N 2.87Å; T773-D777 PolarHBondContact O-N 3.41Å
774	K	72.3	Confident	69.1	Low	140 Å²	140	89.4 Å²	89.4	61%	0.609	46%	0.455	S	S	*	.	H	α-helix	trans	-66.7	-37.6	176.9	-70.4	-170.6	172.5	-170	0	112.1	V770 K771 M772 M776 D777 E778	V770-K774 HydrophobicContact CG1-CB 4.3Å; K771-K774 PolarHBondContact O-N 2.93Å; M772-K774 PolarHBondContact O-N 3.1Å; K774-M776 VanDerWaalsContact C-N 3.32Å; K774-D777 PolarHBondContact O-N 2.83Å; K774-E778 PolarHBondContact O-N 3.33Å; K774-E778 VanDerWaalsContact O-N 3.09Å
775	L	75	Confident	68.8	Low	0 Å²	0	88 Å²	88	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-61.9	-41.9	175.1	-172.8	113.9	0	0	0	111.1	F754 L758 V770 K771 M772 I779 V792 I812	F754-L775 HydrophobicContact CE2-CD2 4.27Å; F754-L775 HydrophobicContact CZ-CD2 4.16Å; L758-L775 HydrophobicContact CD1-CD1 4.13Å; L758-L775 HydrophobicContact CG-CD1 4.22Å; V770-L775 HydrophobicContact CG1-CB 4.3Å; K771-L775 PolarHBondContact O-N 3.18Å; M772-L775 PolarHBondContact O-N 3.05Å; L775-I779 HydrophobicContact CD1-CD1 4.42Å; L775-I779 HydrophobicContact CD2-CD1 3.62Å; L775-I779 HydrophobicContact CG-CD1 3.68Å; L775-I779 HydrophobicContact CG-CG1 4.45Å; L775-I779 WeakPolarHBondContact O-CB 3.45Å; L775-I779 VanDerWaalsContact O-CG1 3.25Å; L775-I779 WeakPolarHBondContact O-CG1 3.49Å; L775-I779 PolarHBondContact O-N 3.47Å; L775-V792 HydrophobicContact CD2-CG1 4.06Å; L775-I812 HydrophobicContact CB-CD1 4.45Å; L775-I812 HydrophobicContact CD1-CD1 4.12Å; L775-I812 HydrophobicContact CD2-CD1 3.99Å; L775-I812 HydrophobicContact CG-CD1 4.41Å
776	M	70.3	Confident	68.8	Low	35 Å²	35	95 Å²	95	17%	0.172	46%	0.46	C	S	.	.	H	α-helix	trans	-66.4	-38.4	176.8	-67.7	-70	-86.4	0	0	112.8	M772 T773 K774 N780 E789 V792	M772-M776 VanDerWaalsContact O-CG 3.25Å; M772-M776 WeakPolarHBondContact O-CG 3.42Å; M772-M776 PolarHBondContact O-N 3.35Å; T773-M776 PolarHBondContact O-N 2.87Å; K774-M776 VanDerWaalsContact C-N 3.32Å; M776-N780 WeakPolarHBondContact O-CB 3.41Å; M776-N780 PolarHBondContact O-N 2.89Å; M776-N780 PolarHBondContact O-ND2 3.14Å; M776-E789 HydrophobicContact CE-CB 3.96Å; M776-E789 HydrophobicContact CE-CG 4.34Å; M776-V792 HydrophobicContact CE-CG2 4.49Å; M776-V792 HydrophobicContact SD-CB 4.02Å; M776-V792 HydrophobicContact SD-CG1 4.02Å; M776-V792 HydrophobicContact SD-CG2 3.7Å
777	D	73.6	Confident	69.3	Low	105 Å²	105	87 Å²	87	56%	0.561	42%	0.423	S	S	*	.	H	α-helix	trans	-67	-42.7	177.4	-72.4	-24.1	0	0	0	112	T773 K774 K781	T773-D777 PolarHBondContact O-N 3.41Å; K774-D777 PolarHBondContact O-N 2.83Å; D777-K781 VanDerWaalsContact O-CG 3.29Å; D777-K781 WeakPolarHBondContact O-CG 3.4Å; D777-K781 PolarHBondContact O-N 3.09Å
778	E	67.4	Low	69.6	Low	84 Å²	84	88.3 Å²	88.3	39%	0.393	43%	0.426	S	S	.	.	H	α-helix	trans	-73.5	-41.9	178.8	-60.9	-51.8	145.1	0	0	112.7	V761 K774 N780 K781	V761-E778 HydrophobicContact CG2-CB 3.77Å; K774-E778 PolarHBondContact O-N 3.33Å; K774-E778 VanDerWaalsContact O-N 3.09Å; E778-N780 VanDerWaalsContact C-N 3.27Å; E778-N780 PolarHBondContact O-N 3.48Å; E778-K781 PolarHBondContact O-N 2.83Å; E778-K781 IonicContact OE1-NZ 2.65Å; E778-K781 PolarHBondContact OE1-NZ 2.98Å; E778-K781 VanDerWaalsContact OE2-CD 3.32Å; E778-K781 WeakPolarHBondContact OE2-CD 3.29Å; E778-K781 IonicContact OE2-NZ 2.95Å; E778-K781 PolarHBondContact OE2-NZ 3.2Å
779	I	69.9	Low	69.7	Low	6 Å²	6	85 Å²	85	3%	0.031	41%	0.411	C	S	.	.	H	α-helix	trans	-62.1	-34.2	179.1	-72.1	174.7	0	0	0	112.1	F754 L775 F787	F754-I779 HydrophobicContact CD2-CD1 4.01Å; F754-I779 HydrophobicContact CE2-CD1 3.56Å; F754-I779 HydrophobicContact CZ-CD1 4.43Å; L775-I779 HydrophobicContact CD1-CD1 4.42Å; L775-I779 HydrophobicContact CD2-CD1 3.62Å; L775-I779 HydrophobicContact CG-CD1 3.68Å; L775-I779 HydrophobicContact CG-CG1 4.45Å; L775-I779 WeakPolarHBondContact O-CB 3.45Å; L775-I779 VanDerWaalsContact O-CG1 3.25Å; L775-I779 WeakPolarHBondContact O-CG1 3.49Å; L775-I779 PolarHBondContact O-N 3.47Å; I779-F787 HydrophobicContact CG2-CB 4.44Å; I779-F787 HydrophobicContact CG2-CD2 3.58Å; I779-F787 HydrophobicContact CG2-CE2 4.12Å; I779-F787 HydrophobicContact CG2-CG 4.21Å
780	N	71.2	Confident	69.6	Low	46 Å²	46	92.5 Å²	92.5	25%	0.246	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-4.6	-179.5	-70.8	-62.3	0	0	0	114.4	M776 E778 R786 F787	M776-N780 WeakPolarHBondContact O-CB 3.41Å; M776-N780 PolarHBondContact O-N 2.89Å; M776-N780 PolarHBondContact O-ND2 3.14Å; E778-N780 VanDerWaalsContact C-N 3.27Å; E778-N780 PolarHBondContact O-N 3.48Å; N780-R786 WeakPolarHBondContact OD1-CA 3.47Å; N780-F787 PolarHBondContact OD1-N 3.2Å; N780-F787 VanDerWaalsContact OD1-N 3.14Å
781	K	69.1	Low	69.6	Low	133 Å²	133	93.9 Å²	93.9	58%	0.578	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-34.1	177.7	-88.8	169.6	-168.4	174.8	0	113.8	D777 E778	D777-K781 VanDerWaalsContact O-CG 3.29Å; D777-K781 WeakPolarHBondContact O-CG 3.4Å; D777-K781 PolarHBondContact O-N 3.09Å; E778-K781 PolarHBondContact O-N 2.83Å; E778-K781 IonicContact OE1-NZ 2.65Å; E778-K781 PolarHBondContact OE1-NZ 2.98Å; E778-K781 VanDerWaalsContact OE2-CD 3.32Å; E778-K781 WeakPolarHBondContact OE2-CD 3.29Å; E778-K781 IonicContact OE2-NZ 2.95Å; E778-K781 PolarHBondContact OE2-NZ 3.2Å
782	E	58.2	Low	69.5	Low	178 Å²	178	87.8 Å²	87.8	83%	0.832	41%	0.409	S	S	*	.	S	Bend	trans	-103.5	4	-168.5	-62.9	-166.3	150.2	0	0	114.7
783	R	58.3	Low	69.7	Low	80 Å²	80	92.1 Å²	92.1	30%	0.302	42%	0.424	S	S	.	.			trans	-139	146.4	-169.2	-62.4	-167	-177.1	-176.5	9.2	115.9	E753 S757	E753-R783 IonicContact OE2-NH1 3.2Å; E753-R783 PolarHBondContact OE2-NH1 3.08Å; S757-R783 PolarHBondContact OG-NH2 3.45Å
784	E	51.6	Low	69.9	Low	205 Å²	205	89.5 Å²	89.5	96%	0.958	41%	0.413	S	S	*	.	S	Bend	trans	-74.9	-30.1	179	-60.7	-173.8	147.2	0	0	113.2
785	S	60.8	Low	70.2	Confident	64 Å²	64	83.1 Å²	83.1	45%	0.448	39%	0.386	S	S	.	.	S	Bend	trans	-97	99.3	176.3	56.4	0	0	0	0	111.5	F787	S785-F787 PolarHBondContact O-N 3.24Å
786	R	66.1	Low	70.4	Confident	199 Å²	199	83.4 Å²	83.4	75%	0.751	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-61.9	135.8	177.6	-67.7	-176.1	178.3	-175.8	-1.2	111.5	R750 N780	R750-R786 PolarHBondContact NH2-O 3.4Å; N780-R786 WeakPolarHBondContact OD1-CA 3.47Å
787	F	70.6	Confident	70.8	Confident	15 Å²	15	83.9 Å²	83.9	7%	0.066	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-84.8	131.7	171.6	-75.5	-95.5	0	0	0	110.1	R750 I779 N780 S785 V792	R750-F787 HydrophobicContact CG-CE1 3.75Å; R750-F787 HydrophobicContact CG-CZ 3.95Å; I779-F787 HydrophobicContact CG2-CB 4.44Å; I779-F787 HydrophobicContact CG2-CD2 3.58Å; I779-F787 HydrophobicContact CG2-CE2 4.12Å; I779-F787 HydrophobicContact CG2-CG 4.21Å; N780-F787 PolarHBondContact OD1-N 3.2Å; N780-F787 VanDerWaalsContact OD1-N 3.14Å; S785-F787 PolarHBondContact O-N 3.24Å; F787-V792 HydrophobicContact CB-CG2 3.82Å
788	T	76.4	Confident	71	Confident	75 Å²	75	85.8 Å²	85.8	46%	0.46	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-81.9	150.8	174.8	63.1	0	0	0	0	111	R790 E791 V792	T788-R790 PolarHBondContact O-N 2.71Å; T788-R790 VanDerWaalsContact O-N 3.12Å; T788-E791 PolarHBondContact N-OE2 3.14Å; T788-E791 PolarHBondContact O-N 2.7Å; T788-E791 WeakPolarHBondContact OG1-CG 3.41Å; T788-E791 PolarHBondContact OG1-N 3.45Å; T788-E791 PolarHBondContact OG1-OE2 3.32Å; T788-V792 PolarHBondContact O-N 3.19Å
789	E	72	Confident	71.4	Confident	99 Å²	99	82.2 Å²	82.2	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-57.4	-30.2	179.5	-163.9	-160.6	132.9	0	0	112.7	M776 R793	M776-E789 HydrophobicContact CE-CB 3.96Å; M776-E789 HydrophobicContact CE-CG 4.34Å; E789-R793 VanDerWaalsContact O-CB 3.31Å; E789-R793 WeakPolarHBondContact O-CB 3.44Å; E789-R793 PolarHBondContact O-N 2.95Å; E789-R793 IonicContact OE1-CZ 2.73Å; E789-R793 IonicContact OE1-NH1 2.71Å; E789-R793 PolarHBondContact OE1-NH1 3.09Å; E789-R793 IonicContact OE1-NH2 3.63Å; E789-R793 PolarHBondContact OE1-NH2 3.16Å
790	R	73.6	Confident	71.9	Confident	216 Å²	216	86 Å²	86	82%	0.815	40%	0.398	S	S	*	.	H	α-helix	trans	-70	-42.9	176.1	-66.6	-176.5	177.2	-177.1	-1.4	112.1	T788 A794	T788-R790 PolarHBondContact O-N 2.71Å; T788-R790 VanDerWaalsContact O-N 3.12Å; R790-A794 WeakPolarHBondContact O-CB 3.32Å; R790-A794 PolarHBondContact O-N 3.23Å
791	E	78.6	Confident	72.2	Confident	41 Å²	41	90.1 Å²	90.1	19%	0.192	42%	0.42	C	S	.	.	H	α-helix	trans	-64.8	-42.1	175.8	-70.2	163.1	145.9	0	0	111.5	R750 T788 A794 A795	R750-E791 IonicContact CZ-OE1 3.3Å; R750-E791 IonicContact CZ-OE2 2.91Å; R750-E791 IonicContact NH1-OE1 3.28Å; R750-E791 PolarHBondContact NH1-OE1 3.3Å; R750-E791 IonicContact NH1-OE2 3.6Å; R750-E791 IonicContact NH2-OE1 2.65Å; R750-E791 PolarHBondContact NH2-OE1 2.89Å; R750-E791 IonicContact NH2-OE2 3.15Å; R750-E791 PolarHBondContact NH2-OE2 3.13Å; R750-E791 VanDerWaalsContact NH2-OE2 3.14Å; T788-E791 PolarHBondContact N-OE2 3.14Å; T788-E791 PolarHBondContact O-N 2.7Å; T788-E791 WeakPolarHBondContact OG1-CG 3.41Å; T788-E791 PolarHBondContact OG1-N 3.45Å; T788-E791 PolarHBondContact OG1-OE2 3.32Å; E791-A794 PolarHBondContact O-N 3.04Å; E791-A795 WeakPolarHBondContact O-CB 3.43Å; E791-A795 PolarHBondContact O-N 2.79Å
792	V	76.2	Confident	72.7	Confident	1 Å²	1	87.4 Å²	87.4	1%	0.006	41%	0.411	C	S	.	.	H	α-helix	trans	-66.9	-43.7	178.7	173.6	0	0	0	0	111.4	F754 L775 M776 F787 T788 A794 A795 L796	F754-V792 HydrophobicContact CE2-CB 4.35Å; F754-V792 HydrophobicContact CE2-CG1 3.86Å; F754-V792 HydrophobicContact CE2-CG2 3.98Å; F754-V792 HydrophobicContact CZ-CG1 3.93Å; L775-V792 HydrophobicContact CD2-CG1 4.06Å; M776-V792 HydrophobicContact CE-CG2 4.49Å; M776-V792 HydrophobicContact SD-CB 4.02Å; M776-V792 HydrophobicContact SD-CG1 4.02Å; M776-V792 HydrophobicContact SD-CG2 3.7Å; F787-V792 HydrophobicContact CB-CG2 3.82Å; T788-V792 PolarHBondContact O-N 3.19Å; V792-A794 VanDerWaalsContact C-N 3.34Å; V792-A794 PolarHBondContact O-N 3.09Å; V792-A795 PolarHBondContact O-N 3.5Å; V792-L796 HydrophobicContact CG1-CD1 3.9Å; V792-L796 HydrophobicContact CG1-CG 4.44Å; V792-L796 WeakPolarHBondContact O-CB 3.37Å; V792-L796 VanDerWaalsContact O-CG 3.31Å; V792-L796 WeakPolarHBondContact O-CG 3.17Å; V792-L796 PolarHBondContact O-N 3.2Å
793	R	78.8	Confident	73.6	Confident	114 Å²	114	85 Å²	85	43%	0.43	40%	0.404	S	S	.	.	H	α-helix	trans	-63.8	-37.9	175.8	-170.1	177	-77.7	111.5	-7.2	111.9	E789 A797	E789-R793 VanDerWaalsContact O-CB 3.31Å; E789-R793 WeakPolarHBondContact O-CB 3.44Å; E789-R793 PolarHBondContact O-N 2.95Å; E789-R793 IonicContact OE1-CZ 2.73Å; E789-R793 IonicContact OE1-NH1 2.71Å; E789-R793 PolarHBondContact OE1-NH1 3.09Å; E789-R793 IonicContact OE1-NH2 3.63Å; E789-R793 PolarHBondContact OE1-NH2 3.16Å; R793-A797 WeakPolarHBondContact O-CB 3.42Å; R793-A797 PolarHBondContact O-N 3.47Å
794	A	78.9	Confident	74.3	Confident	44 Å²	44	85.3 Å²	85.3	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-68.2	-40.3	174.7	0	0	0	0	0	112.9	R790 E791 V792 A797 R798	R790-A794 WeakPolarHBondContact O-CB 3.32Å; R790-A794 PolarHBondContact O-N 3.23Å; E791-A794 PolarHBondContact O-N 3.04Å; V792-A794 VanDerWaalsContact C-N 3.34Å; V792-A794 PolarHBondContact O-N 3.09Å; A794-A797 PolarHBondContact O-N 3.17Å; A794-R798 PolarHBondContact O-N 3.33Å; A794-R798 VanDerWaalsContact O-N 3.16Å
795	A	77.1	Confident	75.6	Confident	5 Å²	5	75.6 Å²	75.6	4%	0.041	36%	0.364	C	S	.	.	H	α-helix	trans	-64.6	-42.1	175.1	0	0	0	0	0	111.9	F754 E791 V792 R798 M799	F754-A795 HydrophobicContact CD1-CB 3.88Å; F754-A795 HydrophobicContact CE1-CB 4Å; F754-A795 HydrophobicContact CG-CB 4.3Å; E791-A795 WeakPolarHBondContact O-CB 3.43Å; E791-A795 PolarHBondContact O-N 2.79Å; V792-A795 PolarHBondContact O-N 3.5Å; A795-R798 PolarHBondContact O-N 2.84Å; A795-M799 WeakPolarHBondContact O-CG 3.28Å; A795-M799 PolarHBondContact O-N 2.98Å
796	L	79.1	Confident	76.5	Confident	6 Å²	6	78 Å²	78	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-65.9	-40.6	176.2	-72.3	169.2	0	0	0	112.4	F754 L758 V792 R798 M799 Q800 V805 V807 I812	F754-L796 HydrophobicContact CE1-CD2 4.11Å; F754-L796 HydrophobicContact CE1-CG 4.29Å; F754-L796 HydrophobicContact CZ-CD2 4.13Å; F754-L796 HydrophobicContact CZ-CG 4.11Å; L758-L796 HydrophobicContact CD1-CD2 3.99Å; V792-L796 HydrophobicContact CG1-CD1 3.9Å; V792-L796 HydrophobicContact CG1-CG 4.44Å; V792-L796 WeakPolarHBondContact O-CB 3.37Å; V792-L796 VanDerWaalsContact O-CG 3.31Å; V792-L796 WeakPolarHBondContact O-CG 3.17Å; V792-L796 PolarHBondContact O-N 3.2Å; L796-R798 PolarHBondContact O-N 2.97Å; L796-M799 CarbonylContact O-C 3.57Å; L796-M799 PolarHBondContact O-N 3.26Å; L796-M799 VanDerWaalsContact O-N 3.13Å; L796-Q800 PolarHBondContact O-N 3.39Å; L796-V805 HydrophobicContact CD2-CG1 4.29Å; L796-V807 HydrophobicContact CB-CG2 4.34Å; L796-I812 HydrophobicContact CD1-CD1 3.69Å; L796-I812 HydrophobicContact CD1-CG1 4.33Å; L796-I812 HydrophobicContact CD2-CD1 4.12Å; L796-I812 HydrophobicContact CD2-CG2 4.27Å
797	A	78.8	Confident	77.1	Confident	46 Å²	46	70.8 Å²	70.8	38%	0.38	35%	0.347	S	S	.	.	H	α-helix	trans	-58.6	-46.2	174.5	0	0	0	0	0	111.6	R793 A794 M799 Q800 D801	R793-A797 WeakPolarHBondContact O-CB 3.42Å; R793-A797 PolarHBondContact O-N 3.47Å; A794-A797 PolarHBondContact O-N 3.17Å; A797-M799 VanDerWaalsContact C-N 3.29Å; A797-M799 PolarHBondContact O-N 2.97Å; A797-Q800 WeakPolarHBondContact O-CA 3.37Å; A797-Q800 WeakPolarHBondContact O-CB 3.46Å; A797-Q800 PolarHBondContact O-N 2.93Å; A797-D801 PolarHBondContact O-N 3.38Å
798	R	79.4	Confident	77.4	Confident	145 Å²	145	72.5 Å²	72.5	55%	0.547	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-31.3	175.5	-170.7	168.5	-179.3	164.9	5.4	113.2	A794 A795 L796 Q800 D802	A794-R798 PolarHBondContact O-N 3.33Å; A794-R798 VanDerWaalsContact O-N 3.16Å; A795-R798 PolarHBondContact O-N 2.84Å; L796-R798 PolarHBondContact O-N 2.97Å; R798-Q800 VanDerWaalsContact C-N 3.33Å; R798-D802 WeakPolarHBondContact O-CB 3.3Å; R798-D802 VanDerWaalsContact O-CG 3.26Å; R798-D802 PolarHBondContact O-N 2.85Å
799	M	74.8	Confident	77.1	Confident	8 Å²	8	76.5 Å²	76.5	4%	0.039	38%	0.383	C	S	.	.	H	α-helix	trans	-74	-23.5	172.9	-71.8	-176	71.8	0	0	113.5	F754 K755 L758 A795 L796 A797 N803 Q804 V805	F754-M799 HydrophobicContact CD1-SD 4.1Å; F754-M799 HydrophobicContact CE1-SD 4.02Å; K755-M799 HydrophobicContact CD-CE 4.15Å; K755-M799 HydrophobicContact CD-SD 4.34Å; K755-M799 HydrophobicContact CG-CE 3.84Å; K755-M799 HydrophobicContact CG-SD 3.78Å; L758-M799 HydrophobicContact CD2-CE 4.48Å; A795-M799 WeakPolarHBondContact O-CG 3.28Å; A795-M799 PolarHBondContact O-N 2.98Å; L796-M799 CarbonylContact O-C 3.57Å; L796-M799 PolarHBondContact O-N 3.26Å; L796-M799 VanDerWaalsContact O-N 3.13Å; A797-M799 VanDerWaalsContact C-N 3.29Å; A797-M799 PolarHBondContact O-N 2.97Å; M799-N803 PolarHBondContact O-N 3.41Å; M799-Q804 HydrophobicContact CE-CB 4.32Å; M799-Q804 PolarHBondContact O-N 2.96Å; M799-V805 HydrophobicContact CB-CB 4.28Å; M799-V805 HydrophobicContact CB-CG2 4.27Å; M799-V805 HydrophobicContact CE-CG2 3.78Å; M799-V805 PolarHBondContact O-N 3.06Å
800	Q	80.4	Confident	77	Confident	87 Å²	87	76.4 Å²	76.4	41%	0.407	39%	0.386	S	S	.	.	H	α-helix	trans	-75.5	-41	170.4	-175.2	173.4	-8.2	0	0	110.9	L796 A797 R798 D802 N803 V805	L796-Q800 PolarHBondContact O-N 3.39Å; A797-Q800 WeakPolarHBondContact O-CA 3.37Å; A797-Q800 WeakPolarHBondContact O-CB 3.46Å; A797-Q800 PolarHBondContact O-N 2.93Å; R798-Q800 VanDerWaalsContact C-N 3.33Å; Q800-D802 VanDerWaalsContact C-N 3.32Å; Q800-D802 PolarHBondContact O-N 2.75Å; Q800-N803 PolarHBondContact O-N 2.94Å; Q800-V805 WeakPolarHBondContact CA-O 3.43Å
801	D	78.4	Confident	77.2	Confident	131 Å²	131	68.5 Å²	68.5	70%	0.701	36%	0.359	S	S	*	.	H	α-helix	trans	-61.1	-39.1	170.5	-62	-32.6	0	0	0	111.8	A797 N803	A797-D801 PolarHBondContact O-N 3.38Å; D801-N803 PolarHBondContact O-N 3.31Å
802	D	78.3	Confident	77.3	Confident	76 Å²	76	66.6 Å²	66.6	41%	0.406	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-2.7	173	-72.9	-15.6	0	0	0	113.3	K755 R798 Q800 Q804	K755-D802 IonicContact NZ-OD2 2.69Å; K755-D802 PolarHBondContact NZ-OD2 3.35Å; R798-D802 WeakPolarHBondContact O-CB 3.3Å; R798-D802 VanDerWaalsContact O-CG 3.26Å; R798-D802 PolarHBondContact O-N 2.85Å; Q800-D802 VanDerWaalsContact C-N 3.32Å; Q800-D802 PolarHBondContact O-N 2.75Å; D802-Q804 VanDerWaalsContact C-N 3.28Å; D802-Q804 HydrophobicContact CB-CG 3.96Å; D802-Q804 PolarHBondContact O-N 3.41Å
803	N	77.8	Confident	77.3	Confident	128 Å²	128	70.6 Å²	70.6	68%	0.684	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	32.6	-172.1	-65.3	-71.1	0	0	0	115.2	M799 Q800 D801	M799-N803 PolarHBondContact O-N 3.41Å; Q800-N803 PolarHBondContact O-N 2.94Å; D801-N803 PolarHBondContact O-N 3.31Å
804	Q	72.8	Confident	77	Confident	86 Å²	86	68.8 Å²	68.8	40%	0.402	37%	0.366	S	S	.	.	S	Bend	trans	-97.4	-21.7	179.9	-63.3	-175.3	-9	0	0	113.2	M799 D802	M799-Q804 HydrophobicContact CE-CB 4.32Å; M799-Q804 PolarHBondContact O-N 2.96Å; D802-Q804 VanDerWaalsContact C-N 3.28Å; D802-Q804 HydrophobicContact CB-CG 3.96Å; D802-Q804 PolarHBondContact O-N 3.41Å
805	V	79.5	Confident	76.2	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.006	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	138.8	-172.8	173.3	0	0	0	0	109.4	L796 M799 Q800 V807 I812 F813	L796-V805 HydrophobicContact CD2-CG1 4.29Å; M799-V805 HydrophobicContact CB-CB 4.28Å; M799-V805 HydrophobicContact CB-CG2 4.27Å; M799-V805 HydrophobicContact CE-CG2 3.78Å; M799-V805 PolarHBondContact O-N 3.06Å; Q800-V805 WeakPolarHBondContact CA-O 3.43Å; V805-V807 HydrophobicContact CG1-CG2 4.11Å; V805-I812 HydrophobicContact CG1-CG2 3.41Å; V805-I812 VanDerWaalsContact CG1-CG2 3.41Å; V805-F813 WeakPolarHBondContact CA-O 3.47Å
806	M	78.6	Confident	76.2	Confident	115 Å²	115	77.1 Å²	77.1	57%	0.567	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.4	165.8	-79.5	-124.8	-69.4	0	0	110.5	F813 I815	M806-F813 HydrophobicContact CB-CB 4.35Å; M806-F813 PolarHBondContact N-O 3.41Å; M806-F813 PolarHBondContact O-N 2.94Å; M806-I815 HydrophobicContact CB-CD1 4.38Å; M806-I815 HydrophobicContact CB-CG1 4.42Å; M806-I815 HydrophobicContact CG-CD1 3.51Å; M806-I815 HydrophobicContact CG-CG1 3.96Å
807	V	80.1	Confident	76	Confident	47 Å²	47	80.8 Å²	80.8	29%	0.285	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.4	175.9	-175.1	0	0	0	0	109.3	L796 V805 I811	L796-V807 HydrophobicContact CB-CG2 4.34Å; V805-V807 HydrophobicContact CG1-CG2 4.11Å; V807-I811 WeakPolarHBondContact CA-O 3.42Å
808	A	76.6	Confident	75.9	Confident	51 Å²	51	82.7 Å²	82.7	42%	0.421	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	131.2	173.9	0	0	0	0	0	109.7	D810 I811 F813	A808-D810 PolarHBondContact O-N 3.03Å; A808-I811 PolarHBondContact N-O 3.06Å; A808-I811 WeakPolarHBondContact O-CA 3.39Å; A808-I811 WeakPolarHBondContact O-CB 3.36Å; A808-I811 PolarHBondContact O-N 2.8Å; A808-F813 HydrophobicContact CB-CE2 4.35Å
809	D	68.7	Low	75.7	Confident	160 Å²	160	79.1 Å²	79.1	86%	0.856	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	50.3	177.2	-58.9	-24.7	0	0	0	114.9	I811	D809-I811 PolarHBondContact O-N 3.05Å; D809-I811 VanDerWaalsContact O-N 3.12Å
810	D	70.7	Confident	75.7	Confident	97 Å²	97	83.5 Å²	83.5	52%	0.519	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	18.2	-175.6	-66.3	-38	0	0	0	115.4	M772 A808	M772-D810 HydrophobicContact CB-CB 4.47Å; M772-D810 PolarHBondContact N-O 2.93Å; A808-D810 PolarHBondContact O-N 3.03Å
811	I	77.6	Confident	75.4	Confident	50 Å²	50	83.3 Å²	83.3	26%	0.256	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.9	171	-56	172.6	0	0	0	109	K771 V807 A808 D809 F813	K771-I811 HydrophobicContact CG-CG1 4.4Å; V807-I811 WeakPolarHBondContact CA-O 3.42Å; A808-I811 PolarHBondContact N-O 3.06Å; A808-I811 WeakPolarHBondContact O-CA 3.39Å; A808-I811 WeakPolarHBondContact O-CB 3.36Å; A808-I811 PolarHBondContact O-N 2.8Å; D809-I811 PolarHBondContact O-N 3.05Å; D809-I811 VanDerWaalsContact O-N 3.12Å; I811-F813 HydrophobicContact CB-CE2 3.93Å; I811-F813 HydrophobicContact CB-CZ 4.25Å; I811-F813 HydrophobicContact CG2-CD2 4.22Å; I811-F813 HydrophobicContact CG2-CE1 4.22Å; I811-F813 HydrophobicContact CG2-CE2 3.62Å; I811-F813 HydrophobicContact CG2-CZ 3.62Å
812	I	80.4	Confident	75.2	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.005	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122.5	-178.8	-55.5	171.9	0	0	0	107.8	F762 S769 V770 L775 L796 V805	F762-I812 HydrophobicContact CE2-CG2 4.31Å; F762-I812 HydrophobicContact CZ-CB 4.49Å; F762-I812 HydrophobicContact CZ-CG2 4.05Å; S769-I812 VanDerWaalsContact CA-O 3.32Å; S769-I812 WeakPolarHBondContact CA-O 3Å; V770-I812 PolarHBondContact N-O 3.15Å; V770-I812 PolarHBondContact O-N 3.37Å; L775-I812 HydrophobicContact CB-CD1 4.45Å; L775-I812 HydrophobicContact CD1-CD1 4.12Å; L775-I812 HydrophobicContact CD2-CD1 3.99Å; L775-I812 HydrophobicContact CG-CD1 4.41Å; L796-I812 HydrophobicContact CD1-CD1 3.69Å; L796-I812 HydrophobicContact CD1-CG1 4.33Å; L796-I812 HydrophobicContact CD2-CD1 4.12Å; L796-I812 HydrophobicContact CD2-CG2 4.27Å; V805-I812 HydrophobicContact CG1-CG2 3.41Å; V805-I812 VanDerWaalsContact CG1-CG2 3.41Å
813	F	76.4	Confident	75	Confident	84 Å²	84	80.2 Å²	80.2	37%	0.368	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.4	176.5	-60.9	-91.2	0	0	0	109.7	V805 M806 A808 I811	V805-F813 WeakPolarHBondContact CA-O 3.47Å; M806-F813 HydrophobicContact CB-CB 4.35Å; M806-F813 PolarHBondContact N-O 3.41Å; M806-F813 PolarHBondContact O-N 2.94Å; A808-F813 HydrophobicContact CB-CE2 4.35Å; I811-F813 HydrophobicContact CB-CE2 3.93Å; I811-F813 HydrophobicContact CB-CZ 4.25Å; I811-F813 HydrophobicContact CG2-CD2 4.22Å; I811-F813 HydrophobicContact CG2-CE1 4.22Å; I811-F813 HydrophobicContact CG2-CE2 3.62Å; I811-F813 HydrophobicContact CG2-CZ 3.62Å
814	L	73.4	Confident	74.8	Confident	77 Å²	77	76.2 Å²	76.2	40%	0.403	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.8	169.4	-153.2	91.8	0	0	0	109	L758 F762 Q768	L758-L814 HydrophobicContact CD2-CD1 4.2Å; F762-L814 HydrophobicContact CD2-CD1 4.16Å; F762-L814 HydrophobicContact CE1-CB 4.29Å; F762-L814 HydrophobicContact CE2-CD1 4.24Å; F762-L814 HydrophobicContact CG-CD1 4.44Å; Q768-L814 PolarHBondContact O-N 2.63Å
815	I	62.3	Low	74.9	Confident	145 Å²	145	75.3 Å²	75.3	74%	0.744	40%	0.403	S	S	*	.			trans	-94.5	0	177	-51.4	176.3	0	0	0	109.8	M806	M806-I815 HydrophobicContact CB-CD1 4.38Å; M806-I815 HydrophobicContact CB-CG1 4.42Å; M806-I815 HydrophobicContact CG-CD1 3.51Å; M806-I815 HydrophobicContact CG-CG1 3.96Å

Retrieved 815 of 815 residues in 614.2 ms (Link to these results)

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