A0A3Q0KPC1_SCHMA Loading...

Putative atp-dependent RNA helicase AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KPC1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,284 aa.

						>A0A3Q0KPC1_SCHMA|A0A3Q0KPC1
MKDEDALADFLAHKKRLTDIFFPNSKSAIIHHDTSAYDEFWKFLLRLQKIVRKSCSEGLDGCLLSKKSKLNIRTSNYRLEDYVRHSDVSRHSHRSLARSELDCFHLIYDMYLDFLLKRKFARIVKLRIDQSVLPIANFRTELLSTLSKHQVVIVAGDTGCGKSTQVPQYLYYGESNLNDTPGPNSYQNIAVTQPRRIACISLAARVSTEMLNERGSKVGYQVRFERSRTKATRILFLTEGLLLRQMQRDPFLNDYDVIVLDEVHERHWQTDCLLGLVKCLIVVRPKLRVVLMSATINVNTFAKFFNDCPIIQVPGRLYPIDLHYIPLSPVEIANTTDRIDPAPYIRLLRRIDVTYPATERGDLLIFLSGMADIQAIMEPAKAYAEETKRWIILPLHSALSASDQEKVFHVAPDCVRKCILSTNIAETSLTIDGIRFVADSGKVKELSWDSKARMRCLKEFSISKASANQRKGRAGRTGPGVCYRFYTQEDYDNFEAFSTPEIRRVPLETLVLQMLVMGLPDIKKFPFIDPPEMKCIDEALDILKSHGAIIPQNNVLTVTPLGQLLSDIPVEFSIGRMLIMASLLRLTNPVLSLAAGMAIQCPLLPYTAFSGAEQTRRIDALAEYESDHGDAFTLVNVFDEWIKMKSEATGLIKQDHELDEFDNDNDKGCTNIKRWCRRIGAQQQRLHEMVRLRSQFAQLLKDSGLLDSKSTESDKNLSRTQHFKNLNYARRSERMKSKRRRLLTLQDNLSENSESEKEDHHVESDSSKLRKWLSASSRSSINSSNVPVQDLELVLCYNLSSLAQSANIQQNMTQADLQLLKVVLAGGMYPQLAIGDSANAYRVANRGGTAGAGAEMVFHTKNKGFVTLHPNDVFVRKPDVLFPERNLKKRNNNHPNVSKVQKSQTSLSNKNSKQSRDDDFDDEQTEEENIPEVLPSGFAYDHQLLMYLDLMETTKPFLVNTIRVPALPTLLLYCREVDTNADISRIVFDSWLEVRLLDVEAAQRAVATTIWLRSTTQCLMEYELAECLRRRDQTLTGDSGDGCDNGNTTTKTSTKYCSSKKDENKRKIRRLQRILSHSLAAFLAGQPGGAYSIKRLLAADVKQLFRKQDNNDNNICENQSQFKSMPKTCKKINVDDIPLQEPDHESGITFNLFKGGYQVTDYLNIDSLYPEMISVEGRSSVEDIDEPEYYDPSSSYNLAVRLRKQIASGSLNEASSDDNYKCLNENTSLYEPNKNENEEDCFENDDFLDEGKTTCGTCGKFIKIQGTLQTSMLRHRRNCQPYND
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	55	Low	222 Å²	222	100.2 Å²	100.2	100%	1.094	52%	0.518	S	S	*	.				0	130.1	0	-70.9	-170.8	172.5	0	0	106.6	D3	M1-D3 PolarHBondContact O-N 3.11Å
2	K	37.4	Very low	57.2	Low	175 Å²	175	97.8 Å²	97.8	76%	0.761	52%	0.524	S	S	*	.			trans	-63.9	134.7	174.7	-70.7	177.8	174.9	179.8	0	107	E4 D5	K2-E4 PolarHBondContact O-N 2.99Å; K2-D5 PolarHBondContact O-N 3.15Å
3	D	43.6	Very low	59.2	Low	137 Å²	137	93.8 Å²	93.8	73%	0.733	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-55.2	-2.2	-177.6	-95.1	-35.8	0	0	0	115.5	M1 D5	M1-D3 PolarHBondContact O-N 3.11Å; D3-D5 PolarHBondContact O-N 2.84Å
4	E	43	Very low	60.9	Low	170 Å²	170	92.3 Å²	92.3	79%	0.794	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-67.2	-22.4	175.6	-66.1	-167.6	145.2	0	0	113.3	K2	K2-E4 PolarHBondContact O-N 2.99Å
5	D	45	Very low	62.3	Low	128 Å²	128	97.8 Å²	97.8	68%	0.684	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-90.2	-2.7	-177.5	-72	-27.5	0	0	0	114.7	K2 D3 L7	K2-D5 PolarHBondContact O-N 3.15Å; D3-D5 PolarHBondContact O-N 2.84Å; D5-L7 PolarHBondContact O-N 3.47Å
6	A	51.1	Low	63.5	Low	55 Å²	55	97.8 Å²	97.8	46%	0.455	50%	0.496	S	S	.	.	S	Bend	trans	-70.7	-3.1	-174.9	0	0	0	0	0	114.7
7	L	54.9	Low	64.9	Low	31 Å²	31	92 Å²	92	16%	0.162	47%	0.467	C	S	.	.	S	Bend	trans	-119.2	100.5	178.2	-96.5	152.1	0	0	0	109	D5 D9 Q48 R52 L59	D5-L7 PolarHBondContact O-N 3.47Å; L7-D9 PolarHBondContact O-N 3.36Å; L7-Q48 HydrophobicContact CD2-CG 3.89Å; L7-R52 HydrophobicContact CD1-CG 3.8Å; L7-L59 HydrophobicContact CD2-CD1 3.83Å; L7-L59 HydrophobicContact CD2-CD2 3.57Å; L7-L59 HydrophobicContact CD2-CG 4.26Å; L7-L59 HydrophobicContact CG-CD1 4.34Å; L7-L59 HydrophobicContact CG-CD2 4.07Å
8	A	63.2	Low	66.1	Low	12 Å²	12	87.4 Å²	87.4	10%	0.099	44%	0.444	C	S	.	.			trans	-43.4	132.1	169	0	0	0	0	0	110.7	F10 L96 E100	A8-F10 HydrophobicContact CB-CD1 4.14Å; A8-F10 HydrophobicContact CB-CE1 3.86Å; A8-F10 HydrophobicContact CB-CE2 4.49Å; A8-F10 HydrophobicContact CB-CZ 4.05Å; A8-F10 PolarHBondContact O-N 3.23Å; A8-L96 HydrophobicContact CB-CD2 4.1Å; A8-E100 HydrophobicContact CB-CB 4.19Å; A8-E100 HydrophobicContact CB-CG 3.94Å; A8-E100 WeakPolarHBondContact CB-OE1 3.22Å
9	D	72.7	Confident	66.9	Low	99 Å²	99	87.5 Å²	87.5	53%	0.529	45%	0.446	S	S	.	.			trans	-72.4	77.7	170.7	-172.4	2.8	0	0	0	109.5	L7 L11 A12 H13	L7-D9 PolarHBondContact O-N 3.36Å; D9-L11 PolarHBondContact O-N 3.42Å; D9-L11 WeakPolarHBondContact OD1-CB 3.25Å; D9-L11 PolarHBondContact OD1-N 3.1Å; D9-A12 HydrophobicContact CB-CB 4Å; D9-A12 WeakPolarHBondContact O-CB 3.36Å; D9-A12 PolarHBondContact O-N 2.85Å; D9-A12 PolarHBondContact OD1-N 3.15Å; D9-H13 PolarHBondContact O-CD2 3.39Å; D9-H13 PolarHBondContact O-N 3.34Å
10	F	81.9	Confident	67.7	Low	1 Å²	1	83.7 Å²	83.7	0%	0.004	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-22.2	177.9	-64.8	-57.6	0	0	0	112.4	A8 H13 K14 L17 L44 E100 F104 I107	A8-F10 HydrophobicContact CB-CD1 4.14Å; A8-F10 HydrophobicContact CB-CE1 3.86Å; A8-F10 HydrophobicContact CB-CE2 4.49Å; A8-F10 HydrophobicContact CB-CZ 4.05Å; A8-F10 PolarHBondContact O-N 3.23Å; F10-H13 CarbonylContact O-C 3.56Å; F10-H13 PolarHBondContact O-N 2.84Å; F10-K14 PolarHBondContact O-N 2.79Å; F10-L17 HydrophobicContact CB-CD1 3.89Å; F10-L17 HydrophobicContact CD1-CD1 3.82Å; F10-L17 HydrophobicContact CG-CD1 4.29Å; F10-L17 WeakPolarHBondContact O-CD1 3.47Å; F10-L44 HydrophobicContact CB-CD2 4.01Å; F10-L44 HydrophobicContact CD2-CD1 4.14Å; F10-L44 HydrophobicContact CD2-CD2 4.47Å; F10-E100 HydrophobicContact CE1-CB 4.32Å; F10-E100 WeakPolarHBondContact CE1-O 3.31Å; F10-F104 HydrophobicContact CB-CD2 4.25Å; F10-F104 HydrophobicContact CB-CE2 4.26Å; F10-F104 HydrophobicContact CD1-CB 4.35Å; F10-F104 AromaticContact CD1-CD2 3.66Å; F10-F104 HydrophobicContact CD1-CD2 3.66Å; F10-F104 HydrophobicContact CD1-CE2 4.44Å; F10-F104 HydrophobicContact CD1-CG 4.39Å; F10-F104 HydrophobicContact CD2-CD2 4.24Å; F10-F104 HydrophobicContact CE1-CB 3.86Å; F10-F104 AromaticContact CE1-CD2 3.98Å; F10-F104 HydrophobicContact CE1-CD2 3.98Å; F10-F104 HydrophobicContact CE1-CG 4.38Å; F10-F104 AromaticContact CG-CD2 3.8Å; F10-F104 HydrophobicContact CG-CD2 3.8Å; F10-F104 HydrophobicContact CG-CE2 4.3Å; F10-F104 HydrophobicContact CZ-CB 4.22Å; F10-F104 HydrophobicContact CZ-CD2 4.41Å; F10-I107 HydrophobicContact CE2-CD1 4.23Å
11	L	80.7	Confident	68.6	Low	72 Å²	72	79.8 Å²	79.8	38%	0.377	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-36.2	174.9	-72.8	172.2	0	0	0	111.9	D9 H13 K14 W41 L45	D9-L11 PolarHBondContact O-N 3.42Å; D9-L11 WeakPolarHBondContact OD1-CB 3.25Å; D9-L11 PolarHBondContact OD1-N 3.1Å; L11-H13 PolarHBondContact O-N 2.95Å; L11-K14 HydrophobicContact CD2-CD 4.41Å; L11-K14 WeakPolarHBondContact O-CB 3.21Å; L11-K14 PolarHBondContact O-N 3.39Å; L11-K14 VanDerWaalsContact O-N 3.08Å; L11-W41 HydrophobicContact CD2-CE3 3.94Å; L11-W41 HydrophobicContact CD2-CZ3 4.39Å; L11-L45 HydrophobicContact CD1-CD1 4.35Å; L11-L45 HydrophobicContact CD1-CD2 3.73Å; L11-L45 HydrophobicContact CD1-CG 4.29Å
12	A	81.5	Confident	71.2	Confident	72 Å²	72	69.3 Å²	69.3	60%	0.595	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-28.3	170.7	0	0	0	0	0	112.2	D9	D9-A12 HydrophobicContact CB-CB 4Å; D9-A12 WeakPolarHBondContact O-CB 3.36Å; D9-A12 PolarHBondContact O-N 2.85Å; D9-A12 PolarHBondContact OD1-N 3.15Å
13	H	82.3	Confident	73.2	Confident	45 Å²	45	62.2 Å²	62.2	21%	0.208	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	12.7	176.8	-58	-72.5	0	0	0	114.1	D9 F10 L11 K15 R16 L17 R94 L96	D9-H13 PolarHBondContact O-CD2 3.39Å; D9-H13 PolarHBondContact O-N 3.34Å; F10-H13 CarbonylContact O-C 3.56Å; F10-H13 PolarHBondContact O-N 2.84Å; L11-H13 PolarHBondContact O-N 2.95Å; H13-K15 VanDerWaalsContact C-N 3.28Å; H13-K15 PolarHBondContact O-N 3.28Å; H13-K15 VanDerWaalsContact O-N 3.14Å; H13-R16 PolarHBondContact O-N 3.29Å; H13-L17 HydrophobicContact CB-CD1 4.08Å; H13-L17 HydrophobicContact CB-CG 4.32Å; H13-L17 PolarHBondContact O-N 2.88Å; H13-R94 PolarHBondContact CE1-O 3.28Å; H13-L96 HydrophobicContact CB-CD1 3.72Å; H13-L96 HydrophobicContact CB-CD2 4.48Å; H13-L96 HydrophobicContact CB-CG 4.18Å; H13-L96 VanDerWaalsContact CD2-CD2 3.43Å; H13-L96 WeakPolarHBondContact CD2-CD2 3.36Å
14	K	83.9	Confident	74.5	Confident	73 Å²	73	61.7 Å²	61.7	32%	0.317	32%	0.324	S	S	.	.	H	α-helix	trans	-50.4	-45.1	-173.4	179.3	174.4	-177.5	-175.2	0	113	F10 L11 R16 T18 Y37 W41	F10-K14 PolarHBondContact O-N 2.79Å; L11-K14 HydrophobicContact CD2-CD 4.41Å; L11-K14 WeakPolarHBondContact O-CB 3.21Å; L11-K14 PolarHBondContact O-N 3.39Å; L11-K14 VanDerWaalsContact O-N 3.08Å; K14-R16 PolarHBondContact O-N 3Å; K14-T18 WeakPolarHBondContact O-CB 3.33Å; K14-T18 PolarHBondContact O-N 2.81Å; K14-T18 PolarHBondContact O-OG1 2.8Å; K14-Y37 WeakPolarHBondContact CE-OH 3.46Å; K14-W41 HydrophobicContact CB-CH2 4.13Å; K14-W41 HydrophobicContact CB-CZ2 4.49Å; K14-W41 HydrophobicContact CB-CZ3 4.37Å; K14-W41 HydrophobicContact CD-CD2 4.26Å; K14-W41 HydrophobicContact CD-CE3 4.5Å; K14-W41 HydrophobicContact CD-CZ2 4.4Å; K14-W41 HydrophobicContact CG-CD2 4.31Å; K14-W41 HydrophobicContact CG-CE3 4.39Å; K14-W41 HydrophobicContact CG-CH2 3.74Å; K14-W41 HydrophobicContact CG-CZ2 3.62Å; K14-W41 HydrophobicContact CG-CZ3 4.11Å
15	K	81.6	Confident	75.8	Confident	175 Å²	175	55.7 Å²	55.7	76%	0.761	30%	0.301	S	S	*	.	H	α-helix	trans	-59.9	-47.6	179.9	-170.5	177.6	-179.3	-180	0	111.2	H13 T18 D19	H13-K15 VanDerWaalsContact C-N 3.28Å; H13-K15 PolarHBondContact O-N 3.28Å; H13-K15 VanDerWaalsContact O-N 3.14Å; K15-T18 WeakPolarHBondContact O-CB 3.21Å; K15-T18 PolarHBondContact O-N 3.45Å; K15-D19 PolarHBondContact O-N 3.46Å
16	R	82.2	Confident	76.7	Confident	97 Å²	97	56.9 Å²	56.9	37%	0.366	30%	0.3	S	S	.	.	H	α-helix	trans	-67.4	-43.1	-178.4	-158.1	172.8	-150.8	174.3	-3.3	112.4	H13 K14 T18 D19 I20 Y82	H13-R16 PolarHBondContact O-N 3.29Å; K14-R16 PolarHBondContact O-N 3Å; R16-T18 VanDerWaalsContact C-N 3.3Å; R16-T18 PolarHBondContact O-N 3.42Å; R16-D19 PolarHBondContact O-N 2.89Å; R16-I20 WeakPolarHBondContact O-CG1 3.24Å; R16-I20 PolarHBondContact O-N 3.46Å; R16-Y82 HydrophobicContact CG-CE2 4.46Å; R16-Y82 PolarHBondContact NE-OH 2.88Å; R16-Y82 PolarHBondContact NH1-OH 3.14Å; R16-Y82 VanDerWaalsContact NH1-OH 3.16Å; R16-Y82 PolarHBondContact NH2-OH 3.48Å; R16-Y82 VanDerWaalsContact NH2-OH 3.14Å
17	L	86.7	Confident	77.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-67.7	-33.1	176.9	-67.4	167.5	0	0	0	112	F10 H13 I20 F21 W41 L96 L101 F104	F10-L17 HydrophobicContact CB-CD1 3.89Å; F10-L17 HydrophobicContact CD1-CD1 3.82Å; F10-L17 HydrophobicContact CG-CD1 4.29Å; F10-L17 WeakPolarHBondContact O-CD1 3.47Å; H13-L17 HydrophobicContact CB-CD1 4.08Å; H13-L17 HydrophobicContact CB-CG 4.32Å; H13-L17 PolarHBondContact O-N 2.88Å; L17-I20 PolarHBondContact O-N 3.15Å; L17-F21 HydrophobicContact CD2-CD2 4.45Å; L17-F21 HydrophobicContact CD2-CE2 4.21Å; L17-F21 WeakPolarHBondContact O-CD2 3.23Å; L17-F21 PolarHBondContact O-N 3.21Å; L17-W41 HydrophobicContact CB-CH2 4.18Å; L17-W41 HydrophobicContact CD1-CH2 4.46Å; L17-L96 HydrophobicContact CD1-CD1 4.26Å; L17-L96 HydrophobicContact CD2-CD1 3.78Å; L17-L96 HydrophobicContact CG-CD1 4.07Å; L17-L101 HydrophobicContact CD2-CD2 3.9Å; L17-F104 HydrophobicContact CB-CE1 4.09Å; L17-F104 HydrophobicContact CB-CE2 4.37Å; L17-F104 HydrophobicContact CB-CZ 3.87Å; L17-F104 HydrophobicContact CD1-CD2 3.81Å; L17-F104 HydrophobicContact CD1-CE2 3.62Å; L17-F104 HydrophobicContact CD1-CG 4.35Å; L17-F104 HydrophobicContact CD1-CZ 4Å; L17-F104 HydrophobicContact CD2-CB 4.46Å; L17-F104 HydrophobicContact CD2-CD1 3.95Å; L17-F104 HydrophobicContact CD2-CD2 4.28Å; L17-F104 HydrophobicContact CD2-CE1 4.18Å; L17-F104 HydrophobicContact CD2-CE2 4.5Å; L17-F104 HydrophobicContact CD2-CG 3.96Å; L17-F104 HydrophobicContact CD2-CZ 4.42Å; L17-F104 HydrophobicContact CG-CE2 4.38Å; L17-F104 HydrophobicContact CG-CZ 4.32Å
18	T	86.1	Confident	78.3	Confident	9 Å²	9	58.7 Å²	58.7	6%	0.055	31%	0.313	C	S	.	.	H	α-helix	trans	-59.5	-47.5	172.6	-64.7	0	0	0	0	111	K14 K15 R16 I20 F22 H32 Y37	K14-T18 WeakPolarHBondContact O-CB 3.33Å; K14-T18 PolarHBondContact O-N 2.81Å; K14-T18 PolarHBondContact O-OG1 2.8Å; K15-T18 WeakPolarHBondContact O-CB 3.21Å; K15-T18 PolarHBondContact O-N 3.45Å; R16-T18 VanDerWaalsContact C-N 3.3Å; R16-T18 PolarHBondContact O-N 3.42Å; T18-I20 PolarHBondContact O-N 3.43Å; T18-F22 HydrophobicContact CG2-CB 4.26Å; T18-F22 CarbonylContact O-C 3.52Å; T18-F22 VanDerWaalsContact O-CA 3.3Å; T18-F22 WeakPolarHBondContact O-CA 3.3Å; T18-F22 WeakPolarHBondContact O-CB 3.47Å; T18-F22 PolarHBondContact O-N 3.35Å; T18-H32 WeakPolarHBondContact CG2-CD2 3.48Å; T18-Y37 HydrophobicContact CG2-CE2 3.87Å; T18-Y37 PolarHBondContact OG1-OH 3.46Å
19	D	82.2	Confident	79	Confident	90 Å²	90	63.6 Å²	63.6	48%	0.481	34%	0.337	S	S	.	.	H	α-helix	trans	-64.4	-27	-179.5	-64.5	-27.2	0	0	0	113.7	K15 R16 R78	K15-D19 PolarHBondContact O-N 3.46Å; R16-D19 PolarHBondContact O-N 2.89Å; D19-R78 PolarHBondContact O-NE 3.4Å
20	I	83.2	Confident	79.3	Confident	10 Å²	10	59.1 Å²	59.1	5%	0.051	31%	0.312	C	S	.	.	H	α-helix	trans	-85.3	-48.8	-180	-63.3	168.9	0	0	0	111.6	R16 L17 T18 N76 R78 L79 Y82	R16-I20 WeakPolarHBondContact O-CG1 3.24Å; R16-I20 PolarHBondContact O-N 3.46Å; L17-I20 PolarHBondContact O-N 3.15Å; T18-I20 PolarHBondContact O-N 3.43Å; I20-N76 PolarHBondContact O-ND2 2.94Å; I20-R78 HydrophobicContact CG2-CB 4.35Å; I20-L79 HydrophobicContact CG2-CB 3.81Å; I20-L79 HydrophobicContact CG2-CD1 4.37Å; I20-Y82 HydrophobicContact CD1-CD1 4.16Å; I20-Y82 HydrophobicContact CD1-CD2 4.08Å; I20-Y82 HydrophobicContact CD1-CE2 4.5Å; I20-Y82 HydrophobicContact CD1-CG 3.9Å
21	F	85.6	Confident	79	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.009	32%	0.324	C	S	.	.	H	α-helix	trans	-101.6	-20.2	-169.6	-70.7	-86.1	0	0	0	114.7	L17 P23 N76 L79 F104 H105 Y108	L17-F21 HydrophobicContact CD2-CD2 4.45Å; L17-F21 HydrophobicContact CD2-CE2 4.21Å; L17-F21 WeakPolarHBondContact O-CD2 3.23Å; L17-F21 PolarHBondContact O-N 3.21Å; F21-P23 WeakPolarHBondContact O-CD 3.05Å; F21-N76 WeakPolarHBondContact CD1-ND2 3.44Å; F21-L79 HydrophobicContact CZ-CD1 4.48Å; F21-L79 HydrophobicContact CZ-CD2 4.01Å; F21-F104 HydrophobicContact CB-CE1 4.18Å; F21-F104 HydrophobicContact CD1-CD1 4.38Å; F21-F104 HydrophobicContact CD1-CE1 4.41Å; F21-F104 AromaticContact CD2-CD1 3.47Å; F21-F104 HydrophobicContact CD2-CD1 3.47Å; F21-F104 VanDerWaalsContact CD2-CD1 3.47Å; F21-F104 AromaticContact CD2-CE1 3.39Å; F21-F104 HydrophobicContact CD2-CE1 3.39Å; F21-F104 HydrophobicContact CE1-CD1 4.27Å; F21-F104 AromaticContact CE2-CD1 3.34Å; F21-F104 HydrophobicContact CE2-CD1 3.34Å; F21-F104 AromaticContact CE2-CE1 3.81Å; F21-F104 HydrophobicContact CE2-CE1 3.81Å; F21-F104 HydrophobicContact CE2-CG 4.39Å; F21-F104 HydrophobicContact CG-CD1 4Å; F21-F104 AromaticContact CG-CE1 3.73Å; F21-F104 HydrophobicContact CG-CE1 3.73Å; F21-F104 AromaticContact CZ-CD1 3.76Å; F21-F104 HydrophobicContact CZ-CD1 3.76Å; F21-F104 HydrophobicContact CZ-CE1 4.46Å; F21-H105 HydrophobicContact CE1-CB 3.68Å; F21-H105 AromaticContact CE1-CD2 3.69Å; F21-H105 AromaticContact CE1-CG 3.68Å; F21-H105 HydrophobicContact CZ-CB 3.76Å; F21-Y108 HydrophobicContact CB-CD2 4Å; F21-Y108 HydrophobicContact CB-CE2 4.05Å; F21-Y108 HydrophobicContact CD1-CD1 4.12Å; F21-Y108 HydrophobicContact CD1-CD2 4.07Å; F21-Y108 AromaticContact CD1-CG 3.82Å; F21-Y108 HydrophobicContact CD1-CG 3.82Å; F21-Y108 HydrophobicContact CG-CD2 4.4Å; F21-Y108 WeakPolarHBondContact O-CE2 3.46Å; F21-Y108 PolarHBondContact O-OH 3.44Å
22	F	86.4	Confident	78.6	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.009	32%	0.319	C	S	.	.	S	Bend	trans	-127.9	56.3	-177	-55.2	-85	0	0	0	110.1	T18 I30 Y37 F40 W41 Y108	T18-F22 HydrophobicContact CG2-CB 4.26Å; T18-F22 CarbonylContact O-C 3.52Å; T18-F22 VanDerWaalsContact O-CA 3.3Å; T18-F22 WeakPolarHBondContact O-CA 3.3Å; T18-F22 WeakPolarHBondContact O-CB 3.47Å; T18-F22 PolarHBondContact O-N 3.35Å; F22-I30 HydrophobicContact CD1-CB 3.8Å; F22-I30 HydrophobicContact CD1-CG2 3.69Å; F22-I30 HydrophobicContact CE1-CB 3.86Å; F22-I30 HydrophobicContact CE1-CD1 3.94Å; F22-I30 HydrophobicContact CE1-CG2 3.74Å; F22-Y37 HydrophobicContact CB-CD2 3.99Å; F22-Y37 HydrophobicContact CB-CE2 4.17Å; F22-Y37 AromaticContact CD1-CD2 3.76Å; F22-Y37 HydrophobicContact CD1-CD2 3.76Å; F22-Y37 HydrophobicContact CD2-CD2 4.12Å; F22-Y37 HydrophobicContact CD2-CE2 4.1Å; F22-Y37 HydrophobicContact CE1-CD2 4.24Å; F22-Y37 AromaticContact CG-CD2 3.68Å; F22-Y37 HydrophobicContact CG-CD2 3.68Å; F22-Y37 HydrophobicContact CG-CE2 4.01Å; F22-F40 HydrophobicContact CE1-CB 4.44Å; F22-F40 HydrophobicContact CE1-CD1 4.36Å; F22-F40 HydrophobicContact CE1-CG 4.29Å; F22-F40 AromaticContact CE2-CD1 3.8Å; F22-F40 HydrophobicContact CE2-CD1 3.8Å; F22-F40 AromaticContact CE2-CE1 3.81Å; F22-F40 HydrophobicContact CE2-CE1 3.81Å; F22-F40 HydrophobicContact CE2-CG 4.47Å; F22-F40 HydrophobicContact CE2-CZ 4.47Å; F22-F40 HydrophobicContact CZ-CB 4.17Å; F22-F40 AromaticContact CZ-CD1 3.34Å; F22-F40 HydrophobicContact CZ-CD1 3.34Å; F22-F40 HydrophobicContact CZ-CD2 4.11Å; F22-F40 AromaticContact CZ-CE1 3.68Å; F22-F40 HydrophobicContact CZ-CE1 3.68Å; F22-F40 HydrophobicContact CZ-CE2 4.38Å; F22-F40 AromaticContact CZ-CG 3.58Å; F22-F40 HydrophobicContact CZ-CG 3.58Å; F22-F40 HydrophobicContact CZ-CZ 4.17Å; F22-W41 HydrophobicContact CE2-CZ2 4.42Å; F22-Y108 HydrophobicContact CD1-CE2 4.15Å; F22-Y108 HydrophobicContact CE1-CD2 4.07Å; F22-Y108 AromaticContact CE1-CE2 3.55Å; F22-Y108 HydrophobicContact CE1-CE2 3.55Å; F22-Y108 HydrophobicContact CE2-CD2 4.22Å; F22-Y108 HydrophobicContact CE2-CE2 4.28Å; F22-Y108 AromaticContact CZ-CD2 3.64Å; F22-Y108 HydrophobicContact CZ-CD2 3.64Å; F22-Y108 AromaticContact CZ-CE2 3.62Å; F22-Y108 HydrophobicContact CZ-CE2 3.62Å
23	P	79.4	Confident	78	Confident	26 Å²	26	63.9 Å²	63.9	17%	0.169	32%	0.324	C	S	.	.			trans	-60.7	146.2	-177.4	26.1	-33	0	0	0	110.3	F21 S25 A28	F21-P23 WeakPolarHBondContact O-CD 3.05Å; P23-S25 PolarHBondContact O-N 2.91Å; P23-A28 HydrophobicContact CG-CB 3.94Å; P23-A28 WeakPolarHBondContact O-CB 3.45Å
24	N	70.5	Confident	77.4	Confident	127 Å²	127	64.2 Å²	64.2	68%	0.679	33%	0.33	S	S	*	.	S	Bend	trans	-71.5	50.1	170.1	-87.9	-13.4	0	0	0	111.8	H32	N24-H32 VanDerWaalsContact OD1-CB 3.3Å; N24-H32 WeakPolarHBondContact OD1-CB 3.22Å
25	S	71	Confident	77.1	Confident	44 Å²	44	64.1 Å²	64.1	31%	0.308	34%	0.338	S	S	.	.	S	Bend	trans	-112.6	143.2	174.5	177.9	0	0	0	0	110.1	P23 S27 A28	P23-S25 PolarHBondContact O-N 2.91Å; S25-S27 PolarHBondContact O-N 2.86Å; S25-S27 PolarHBondContact OG-N 2.94Å; S25-S27 PolarHBondContact OG-OG 3.31Å; S25-A28 WeakPolarHBondContact O-CB 3.42Å; S25-A28 PolarHBondContact O-N 3.46Å
26	K	64.1	Low	77	Confident	153 Å²	153	56.6 Å²	56.6	67%	0.665	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.1	172.6	-69.7	-179.4	-179.2	169.3	0	113.3	A28	K26-A28 VanDerWaalsContact C-N 3.33Å
27	S	67.8	Low	77.2	Confident	104 Å²	104	52.6 Å²	52.6	73%	0.727	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-5	174.7	58.5	0	0	0	0	113.4	S25 I29	S25-S27 PolarHBondContact O-N 2.86Å; S25-S27 PolarHBondContact OG-N 2.94Å; S25-S27 PolarHBondContact OG-OG 3.31Å; S27-I29 PolarHBondContact O-N 2.85Å
28	A	71.5	Confident	77.1	Confident	20 Å²	20	56.7 Å²	56.7	17%	0.165	32%	0.315	C	S	.	.			trans	-63.4	133.3	176.8	0	0	0	0	0	110.6	P23 S25 K26 I30	P23-A28 HydrophobicContact CG-CB 3.94Å; P23-A28 WeakPolarHBondContact O-CB 3.45Å; S25-A28 WeakPolarHBondContact O-CB 3.42Å; S25-A28 PolarHBondContact O-N 3.46Å; K26-A28 VanDerWaalsContact C-N 3.33Å; A28-I30 VanDerWaalsContact C-N 3.27Å; A28-I30 PolarHBondContact O-N 3.29Å
29	I	77.8	Confident	77.1	Confident	115 Å²	115	59.4 Å²	59.4	59%	0.59	33%	0.328	S	S	*	.	S	Bend	trans	-62.4	-39.8	178.9	-56.8	173.7	0	0	0	110.3	S27 T74 L112	S27-I29 PolarHBondContact O-N 2.85Å; I29-T74 HydrophobicContact CD1-CG2 4.08Å; I29-L112 HydrophobicContact CB-CD2 4.43Å; I29-L112 HydrophobicContact CD1-CD1 3.99Å; I29-L112 HydrophobicContact CG2-CD1 4.13Å; I29-L112 HydrophobicContact CG2-CD2 3.5Å; I29-L112 VanDerWaalsContact CG2-CD2 3.5Å; I29-L112 HydrophobicContact CG2-CG 4.48Å
30	I	79.7	Confident	77.5	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	31%	0.305	C	S	.	.	S	Bend	trans	-123	116	170.9	-60	167.7	0	0	0	107.5	F22 A28 A36 Y108 Y111 L112 L115	F22-I30 HydrophobicContact CD1-CB 3.8Å; F22-I30 HydrophobicContact CD1-CG2 3.69Å; F22-I30 HydrophobicContact CE1-CB 3.86Å; F22-I30 HydrophobicContact CE1-CD1 3.94Å; F22-I30 HydrophobicContact CE1-CG2 3.74Å; A28-I30 VanDerWaalsContact C-N 3.27Å; A28-I30 PolarHBondContact O-N 3.29Å; I30-A36 HydrophobicContact CG2-CB 4.02Å; I30-Y108 HydrophobicContact CD1-CE2 4.13Å; I30-Y111 HydrophobicContact CD1-CD1 3.61Å; I30-Y111 HydrophobicContact CD1-CE1 3.64Å; I30-L112 HydrophobicContact CD1-CD2 3.62Å; I30-L112 HydrophobicContact CG1-CD2 3.95Å; I30-L115 HydrophobicContact CD1-CD1 4.27Å
31	H	75.5	Confident	77.8	Confident	54 Å²	54	55.2 Å²	55.2	25%	0.25	30%	0.304	C	S	.	.			trans	-82.8	147.4	176.2	-165.6	-86.9	0	0	0	110.4	D33 T34	H31-D33 VanDerWaalsContact C-N 3.3Å; H31-D33 IonicContact CE1-OD2 4Å; H31-D33 PolarHBondContact CE1-OD2 2.68Å; H31-D33 VanDerWaalsContact CE1-OD2 3.28Å; H31-D33 PolarHBondContact ND1-N 3.16Å; H31-D33 IonicContact ND1-OD2 2.76Å; H31-D33 PolarHBondContact O-N 3.03Å; H31-T34 HydrophobicContact CB-CG2 3.81Å; H31-T34 WeakPolarHBondContact O-CB 3.44Å; H31-T34 PolarHBondContact O-N 3.2Å; H31-T34 VanDerWaalsContact O-N 3.11Å; H31-T34 PolarHBondContact O-OG1 3Å
32	H	70.7	Confident	77.9	Confident	61 Å²	61	62.3 Å²	62.3	28%	0.282	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-43.1	-177.1	-168.1	-93.4	0	0	0	113.1	T18 N24 T34 Y37	T18-H32 WeakPolarHBondContact CG2-CD2 3.48Å; N24-H32 VanDerWaalsContact OD1-CB 3.3Å; N24-H32 WeakPolarHBondContact OD1-CB 3.22Å; H32-T34 PolarHBondContact O-N 3.24Å; H32-T34 VanDerWaalsContact O-N 3.1Å; H32-Y37 AromaticContact CD2-CE2 3.57Å; H32-Y37 AromaticContact CD2-CZ 3.58Å; H32-Y37 AromaticContact NE2-CE1 3.71Å; H32-Y37 AromaticContact NE2-CE2 3.84Å; H32-Y37 AromaticContact NE2-CZ 3.33Å; H32-Y37 VanDerWaalsContact NE2-CZ 3.33Å; H32-Y37 PolarHBondContact NE2-OH 3.06Å; H32-Y37 WeakPolarHBondContact O-CB 3.15Å; H32-Y37 WeakPolarHBondContact O-CD1 3.16Å
33	D	69	Low	77.9	Confident	130 Å²	130	64.5 Å²	64.5	70%	0.695	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	16.4	-178	-48.7	-37.4	0	0	0	114.6	H31	H31-D33 VanDerWaalsContact C-N 3.3Å; H31-D33 IonicContact CE1-OD2 4Å; H31-D33 PolarHBondContact CE1-OD2 2.68Å; H31-D33 VanDerWaalsContact CE1-OD2 3.28Å; H31-D33 PolarHBondContact ND1-N 3.16Å; H31-D33 IonicContact ND1-OD2 2.76Å; H31-D33 PolarHBondContact O-N 3.03Å
34	T	71.4	Confident	78.3	Confident	52 Å²	52	63.3 Å²	63.3	32%	0.319	34%	0.337	S	S	.	.	S	Bend	trans	-100.1	146.7	-179.7	64	0	0	0	0	111.2	H31 H32 A36 Y37	H31-T34 HydrophobicContact CB-CG2 3.81Å; H31-T34 WeakPolarHBondContact O-CB 3.44Å; H31-T34 PolarHBondContact O-N 3.2Å; H31-T34 VanDerWaalsContact O-N 3.11Å; H31-T34 PolarHBondContact O-OG1 3Å; H32-T34 PolarHBondContact O-N 3.24Å; H32-T34 VanDerWaalsContact O-N 3.1Å; T34-A36 PolarHBondContact O-N 3.27Å; T34-Y37 WeakPolarHBondContact O-CB 3.32Å; T34-Y37 PolarHBondContact O-N 2.88Å
35	S	76.2	Confident	79.1	Confident	72 Å²	72	60.5 Å²	60.5	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-56.7	-23.5	171.9	67.8	0	0	0	0	112.9	Y37 D38 E39	S35-Y37 VanDerWaalsContact C-N 3.33Å; S35-D38 PolarHBondContact O-N 3.34Å; S35-E39 VanDerWaalsContact O-CB 3.25Å; S35-E39 WeakPolarHBondContact O-CB 3.41Å; S35-E39 VanDerWaalsContact O-CG 3.27Å; S35-E39 WeakPolarHBondContact O-CG 3.28Å; S35-E39 PolarHBondContact O-N 3.48Å
36	A	80.2	Confident	79.6	Confident	16 Å²	16	67.3 Å²	67.3	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-31	174.9	0	0	0	0	0	112.8	I30 T34 F40 Y111 L115	I30-A36 HydrophobicContact CG2-CB 4.02Å; T34-A36 PolarHBondContact O-N 3.27Å; A36-F40 WeakPolarHBondContact O-CB 3.46Å; A36-F40 PolarHBondContact O-N 3.08Å; A36-Y111 WeakPolarHBondContact CA-OH 3.32Å; A36-Y111 HydrophobicContact CB-CE1 4.44Å; A36-Y111 WeakPolarHBondContact O-CE1 3.45Å; A36-Y111 PolarHBondContact O-OH 3.43Å; A36-Y111 VanDerWaalsContact O-OH 3.09Å; A36-L115 HydrophobicContact CB-CD1 4.38Å
37	Y	85.7	Confident	80.5	Confident	13 Å²	13	60.7 Å²	60.7	5%	0.051	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-49.2	172.4	168.4	-93.6	0	0	0	110.8	K14 T18 F22 H32 T34 S35 E39 F40 W41	K14-Y37 WeakPolarHBondContact CE-OH 3.46Å; T18-Y37 HydrophobicContact CG2-CE2 3.87Å; T18-Y37 PolarHBondContact OG1-OH 3.46Å; F22-Y37 HydrophobicContact CB-CD2 3.99Å; F22-Y37 HydrophobicContact CB-CE2 4.17Å; F22-Y37 AromaticContact CD1-CD2 3.76Å; F22-Y37 HydrophobicContact CD1-CD2 3.76Å; F22-Y37 HydrophobicContact CD2-CD2 4.12Å; F22-Y37 HydrophobicContact CD2-CE2 4.1Å; F22-Y37 HydrophobicContact CE1-CD2 4.24Å; F22-Y37 AromaticContact CG-CD2 3.68Å; F22-Y37 HydrophobicContact CG-CD2 3.68Å; F22-Y37 HydrophobicContact CG-CE2 4.01Å; H32-Y37 AromaticContact CD2-CE2 3.57Å; H32-Y37 AromaticContact CD2-CZ 3.58Å; H32-Y37 AromaticContact NE2-CE1 3.71Å; H32-Y37 AromaticContact NE2-CE2 3.84Å; H32-Y37 AromaticContact NE2-CZ 3.33Å; H32-Y37 VanDerWaalsContact NE2-CZ 3.33Å; H32-Y37 PolarHBondContact NE2-OH 3.06Å; H32-Y37 WeakPolarHBondContact O-CB 3.15Å; H32-Y37 WeakPolarHBondContact O-CD1 3.16Å; T34-Y37 WeakPolarHBondContact O-CB 3.32Å; T34-Y37 PolarHBondContact O-N 2.88Å; S35-Y37 VanDerWaalsContact C-N 3.33Å; Y37-E39 PolarHBondContact O-N 3.36Å; Y37-F40 WeakPolarHBondContact O-CB 3.2Å; Y37-F40 PolarHBondContact O-N 3.41Å; Y37-F40 VanDerWaalsContact O-N 3.16Å; Y37-W41 AromaticContact CD2-NE1 3.7Å; Y37-W41 AromaticContact CE1-CD1 3.79Å; Y37-W41 AromaticContact CE1-NE1 3.59Å; Y37-W41 HydrophobicContact CE2-CZ2 4.39Å; Y37-W41 AromaticContact CE2-NE1 3.1Å; Y37-W41 AromaticContact CZ-CD1 3.73Å; Y37-W41 AromaticContact CZ-NE1 3.03Å; Y37-W41 PolarHBondContact O-N 2.94Å; Y37-W41 PolarHBondContact OH-NE1 3.28Å
38	D	84.9	Confident	81.1	Confident	86 Å²	86	56.6 Å²	56.6	46%	0.46	28%	0.282	S	S	.	.	H	α-helix	trans	-65.9	-39.5	177.5	-65.6	-40.8	0	0	0	112.2	S35 F40 W41 K42	S35-D38 PolarHBondContact O-N 3.34Å; D38-F40 VanDerWaalsContact C-N 3.29Å; D38-F40 PolarHBondContact O-N 3.31Å; D38-W41 PolarHBondContact O-N 3.16Å; D38-K42 WeakPolarHBondContact O-CG 3.28Å; D38-K42 PolarHBondContact O-N 3.04Å
39	E	85.9	Confident	81.5	Confident	67 Å²	67	62.4 Å²	62.4	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-34.3	173.3	-80.6	179.2	-160.2	0	0	111.9	S35 Y37 K42 F43 Y111 R118	S35-E39 VanDerWaalsContact O-CB 3.25Å; S35-E39 WeakPolarHBondContact O-CB 3.41Å; S35-E39 VanDerWaalsContact O-CG 3.27Å; S35-E39 WeakPolarHBondContact O-CG 3.28Å; S35-E39 PolarHBondContact O-N 3.48Å; Y37-E39 PolarHBondContact O-N 3.36Å; E39-K42 PolarHBondContact O-N 3.23Å; E39-F43 VanDerWaalsContact O-CB 3.25Å; E39-F43 WeakPolarHBondContact O-CB 3.22Å; E39-F43 PolarHBondContact O-N 3.36Å; E39-Y111 WeakPolarHBondContact CB-OH 3.34Å; E39-Y111 PolarHBondContact OE2-OH 3.23Å; E39-R118 IonicContact OE2-CZ 3.54Å; E39-R118 IonicContact OE2-NH1 3.18Å; E39-R118 IonicContact OE2-NH2 2.69Å
40	F	90.8	Very high	81.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-46.8	175.5	171.1	-95.2	0	0	0	111.4	F22 A36 Y37 D38 K42 F43 L44 F104 I107 Y108 Y111	F22-F40 HydrophobicContact CE1-CB 4.44Å; F22-F40 HydrophobicContact CE1-CD1 4.36Å; F22-F40 HydrophobicContact CE1-CG 4.29Å; F22-F40 AromaticContact CE2-CD1 3.8Å; F22-F40 HydrophobicContact CE2-CD1 3.8Å; F22-F40 AromaticContact CE2-CE1 3.81Å; F22-F40 HydrophobicContact CE2-CE1 3.81Å; F22-F40 HydrophobicContact CE2-CG 4.47Å; F22-F40 HydrophobicContact CE2-CZ 4.47Å; F22-F40 HydrophobicContact CZ-CB 4.17Å; F22-F40 AromaticContact CZ-CD1 3.34Å; F22-F40 HydrophobicContact CZ-CD1 3.34Å; F22-F40 HydrophobicContact CZ-CD2 4.11Å; F22-F40 AromaticContact CZ-CE1 3.68Å; F22-F40 HydrophobicContact CZ-CE1 3.68Å; F22-F40 HydrophobicContact CZ-CE2 4.38Å; F22-F40 AromaticContact CZ-CG 3.58Å; F22-F40 HydrophobicContact CZ-CG 3.58Å; F22-F40 HydrophobicContact CZ-CZ 4.17Å; A36-F40 WeakPolarHBondContact O-CB 3.46Å; A36-F40 PolarHBondContact O-N 3.08Å; Y37-F40 WeakPolarHBondContact O-CB 3.2Å; Y37-F40 PolarHBondContact O-N 3.41Å; Y37-F40 VanDerWaalsContact O-N 3.16Å; D38-F40 VanDerWaalsContact C-N 3.29Å; D38-F40 PolarHBondContact O-N 3.31Å; F40-K42 VanDerWaalsContact C-N 3.29Å; F40-K42 PolarHBondContact O-N 3.12Å; F40-F43 CarbonylContact O-C 3.58Å; F40-F43 WeakPolarHBondContact O-CA 3.42Å; F40-F43 WeakPolarHBondContact O-CB 3.47Å; F40-F43 PolarHBondContact O-N 3.47Å; F40-F43 VanDerWaalsContact O-N 3.1Å; F40-L44 WeakPolarHBondContact O-CB 3.27Å; F40-L44 PolarHBondContact O-N 3.36Å; F40-F104 HydrophobicContact CE1-CE1 4.24Å; F40-F104 HydrophobicContact CE1-CE2 4Å; F40-F104 AromaticContact CE1-CZ 3.49Å; F40-F104 HydrophobicContact CE1-CZ 3.49Å; F40-F104 VanDerWaalsContact CE1-CZ 3.49Å; F40-F104 HydrophobicContact CZ-CE1 4.08Å; F40-F104 HydrophobicContact CZ-CE2 4.05Å; F40-F104 AromaticContact CZ-CZ 3.65Å; F40-F104 HydrophobicContact CZ-CZ 3.65Å; F40-I107 HydrophobicContact CE2-CG2 4.14Å; F40-I107 HydrophobicContact CZ-CG2 4.29Å; F40-Y108 HydrophobicContact CE2-CD2 4.4Å; F40-Y111 HydrophobicContact CB-CD1 3.9Å; F40-Y111 HydrophobicContact CB-CE1 3.78Å; F40-Y111 HydrophobicContact CB-CG 4.37Å; F40-Y111 AromaticContact CD2-CD1 3.63Å; F40-Y111 HydrophobicContact CD2-CD1 3.63Å; F40-Y111 HydrophobicContact CD2-CD2 4.39Å; F40-Y111 HydrophobicContact CD2-CE1 4.39Å; F40-Y111 AromaticContact CD2-CG 3.64Å; F40-Y111 HydrophobicContact CD2-CG 3.64Å; F40-Y111 HydrophobicContact CG-CD1 4.23Å
41	W	90.3	Very high	81.1	Confident	11 Å²	11	61 Å²	61	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-36.7	178.3	-67.4	106.6	0	0	0	112.1	L11 K14 L17 F22 Y37 D38 L44 L45 F104	L11-W41 HydrophobicContact CD2-CE3 3.94Å; L11-W41 HydrophobicContact CD2-CZ3 4.39Å; K14-W41 HydrophobicContact CB-CH2 4.13Å; K14-W41 HydrophobicContact CB-CZ2 4.49Å; K14-W41 HydrophobicContact CB-CZ3 4.37Å; K14-W41 HydrophobicContact CD-CD2 4.26Å; K14-W41 HydrophobicContact CD-CE3 4.5Å; K14-W41 HydrophobicContact CD-CZ2 4.4Å; K14-W41 HydrophobicContact CG-CD2 4.31Å; K14-W41 HydrophobicContact CG-CE3 4.39Å; K14-W41 HydrophobicContact CG-CH2 3.74Å; K14-W41 HydrophobicContact CG-CZ2 3.62Å; K14-W41 HydrophobicContact CG-CZ3 4.11Å; L17-W41 HydrophobicContact CB-CH2 4.18Å; L17-W41 HydrophobicContact CD1-CH2 4.46Å; F22-W41 HydrophobicContact CE2-CZ2 4.42Å; Y37-W41 AromaticContact CD2-NE1 3.7Å; Y37-W41 AromaticContact CE1-CD1 3.79Å; Y37-W41 AromaticContact CE1-NE1 3.59Å; Y37-W41 HydrophobicContact CE2-CZ2 4.39Å; Y37-W41 AromaticContact CE2-NE1 3.1Å; Y37-W41 AromaticContact CZ-CD1 3.73Å; Y37-W41 AromaticContact CZ-NE1 3.03Å; Y37-W41 PolarHBondContact O-N 2.94Å; Y37-W41 PolarHBondContact OH-NE1 3.28Å; D38-W41 PolarHBondContact O-N 3.16Å; W41-L44 HydrophobicContact CE3-CD2 3.72Å; W41-L44 HydrophobicContact CZ3-CD2 3.7Å; W41-L45 PolarHBondContact O-N 3.47Å; W41-L45 VanDerWaalsContact O-N 3.09Å; W41-F104 HydrophobicContact CH2-CE2 4.11Å; W41-F104 AromaticContact CH2-CZ 3.86Å; W41-F104 HydrophobicContact CH2-CZ 3.86Å; W41-F104 HydrophobicContact CZ3-CE2 4.14Å; W41-F104 HydrophobicContact CZ3-CZ 4.3Å
42	K	86.8	Confident	80.9	Confident	151 Å²	151	66.6 Å²	66.6	66%	0.657	32%	0.315	S	S	*	.	H	α-helix	trans	-66.1	-39.8	171.9	-68.3	173.6	-176.9	174.4	0	111.9	D38 E39 F40 R46	D38-K42 WeakPolarHBondContact O-CG 3.28Å; D38-K42 PolarHBondContact O-N 3.04Å; E39-K42 PolarHBondContact O-N 3.23Å; F40-K42 VanDerWaalsContact C-N 3.29Å; F40-K42 PolarHBondContact O-N 3.12Å; K42-R46 WeakPolarHBondContact O-CB 3.44Å; K42-R46 PolarHBondContact O-N 3.48Å
43	F	87.6	Confident	80.9	Confident	49 Å²	49	73 Å²	73	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-46.8	175.8	170.9	-95.8	0	0	0	111.3	E39 F40 R46 L47 I107 M110 Y111	E39-F43 VanDerWaalsContact O-CB 3.25Å; E39-F43 WeakPolarHBondContact O-CB 3.22Å; E39-F43 PolarHBondContact O-N 3.36Å; F40-F43 CarbonylContact O-C 3.58Å; F40-F43 WeakPolarHBondContact O-CA 3.42Å; F40-F43 WeakPolarHBondContact O-CB 3.47Å; F40-F43 PolarHBondContact O-N 3.47Å; F40-F43 VanDerWaalsContact O-N 3.1Å; F43-R46 PolarHBondContact O-N 3.36Å; F43-L47 HydrophobicContact CE1-CD2 4.26Å; F43-L47 WeakPolarHBondContact O-CB 3.31Å; F43-L47 PolarHBondContact O-N 3.33Å; F43-I107 HydrophobicContact CE1-CG2 4.18Å; F43-M110 HydrophobicContact CE1-CB 4.48Å; F43-M110 HydrophobicContact CZ-CB 4.37Å; F43-Y111 HydrophobicContact CB-CD2 3.86Å; F43-Y111 HydrophobicContact CB-CE2 4.08Å; F43-Y111 AromaticContact CD1-CD2 3.76Å; F43-Y111 HydrophobicContact CD1-CD2 3.76Å; F43-Y111 HydrophobicContact CD1-CG 4.2Å; F43-Y111 HydrophobicContact CD2-CD2 4.08Å; F43-Y111 HydrophobicContact CE1-CD2 4.31Å; F43-Y111 AromaticContact CG-CD2 3.63Å; F43-Y111 HydrophobicContact CG-CD2 3.63Å; F43-Y111 HydrophobicContact CG-CE2 4.29Å; F43-Y111 HydrophobicContact CG-CG 4.5Å
44	L	87.6	Confident	80.7	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.2	-52.8	175.9	175	68.8	0	0	0	111	F10 F40 W41 R46 L47 Q48 F104 I107	F10-L44 HydrophobicContact CB-CD2 4.01Å; F10-L44 HydrophobicContact CD2-CD1 4.14Å; F10-L44 HydrophobicContact CD2-CD2 4.47Å; F40-L44 WeakPolarHBondContact O-CB 3.27Å; F40-L44 PolarHBondContact O-N 3.36Å; W41-L44 HydrophobicContact CE3-CD2 3.72Å; W41-L44 HydrophobicContact CZ3-CD2 3.7Å; L44-R46 VanDerWaalsContact C-N 3.27Å; L44-R46 PolarHBondContact O-N 3.36Å; L44-L47 WeakPolarHBondContact O-CB 3.22Å; L44-L47 PolarHBondContact O-N 2.86Å; L44-L47 VanDerWaalsContact O-N 3.13Å; L44-Q48 HydrophobicContact CD1-CG 4.38Å; L44-Q48 WeakPolarHBondContact O-CG 3.5Å; L44-Q48 PolarHBondContact O-N 3.28Å; L44-F104 HydrophobicContact CD2-CE2 4Å; L44-I107 HydrophobicContact CD1-CD1 3.72Å; L44-I107 HydrophobicContact CD1-CG2 3.75Å
45	L	86.2	Confident	79.8	Confident	69 Å²	69	70 Å²	70	36%	0.361	33%	0.333	S	S	.	.	H	α-helix	trans	-58.5	-40.2	178	-81.6	174.7	0	0	0	112.4	L11 W41 K49	L11-L45 HydrophobicContact CD1-CD1 4.35Å; L11-L45 HydrophobicContact CD1-CD2 3.73Å; L11-L45 HydrophobicContact CD1-CG 4.29Å; W41-L45 PolarHBondContact O-N 3.47Å; W41-L45 VanDerWaalsContact O-N 3.09Å; L45-K49 WeakPolarHBondContact O-CG 3.26Å; L45-K49 PolarHBondContact O-N 3.06Å; L45-K49 VanDerWaalsContact O-N 3.08Å
46	R	82.8	Confident	78.8	Confident	186 Å²	186	72 Å²	72	70%	0.702	35%	0.347	S	S	*	.	H	α-helix	trans	-68.6	-39.8	177.3	-168	172.1	-176	164.7	0.9	111.5	K42 F43 L44 K49 I50	K42-R46 WeakPolarHBondContact O-CB 3.44Å; K42-R46 PolarHBondContact O-N 3.48Å; F43-R46 PolarHBondContact O-N 3.36Å; L44-R46 VanDerWaalsContact C-N 3.27Å; L44-R46 PolarHBondContact O-N 3.36Å; R46-K49 PolarHBondContact O-N 2.71Å; R46-I50 HydrophobicContact CG-CD1 4.25Å; R46-I50 VanDerWaalsContact O-CG1 3.28Å; R46-I50 WeakPolarHBondContact O-CG1 3.41Å; R46-I50 PolarHBondContact O-N 3.24Å
47	L	82.3	Confident	77.5	Confident	14 Å²	14	79 Å²	79	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-64.5	-46.6	176.5	-174.8	67.7	0	0	0	111	F43 L44 K49 I50 V51 I107 M110	F43-L47 HydrophobicContact CE1-CD2 4.26Å; F43-L47 WeakPolarHBondContact O-CB 3.31Å; F43-L47 PolarHBondContact O-N 3.33Å; L44-L47 WeakPolarHBondContact O-CB 3.22Å; L44-L47 PolarHBondContact O-N 2.86Å; L44-L47 VanDerWaalsContact O-N 3.13Å; L47-K49 VanDerWaalsContact C-N 3.31Å; L47-K49 PolarHBondContact O-N 2.86Å; L47-I50 PolarHBondContact O-N 3.38Å; L47-I50 VanDerWaalsContact O-N 3.08Å; L47-V51 WeakPolarHBondContact O-CG2 3.28Å; L47-V51 PolarHBondContact O-N 3.15Å; L47-I107 HydrophobicContact CD2-CB 4.44Å; L47-I107 HydrophobicContact CD2-CD1 4.4Å; L47-I107 HydrophobicContact CD2-CG1 3.91Å; L47-I107 HydrophobicContact CD2-CG2 3.86Å; L47-M110 HydrophobicContact CD1-CE 4.09Å; L47-M110 HydrophobicContact CD2-CE 4.14Å; L47-M110 HydrophobicContact CD2-SD 4.32Å
48	Q	80	Confident	76	Confident	19 Å²	19	79.7 Å²	79.7	9%	0.089	39%	0.388	C	S	.	.	H	α-helix	trans	-57.6	-43	175.1	-71.4	-179.9	-44.3	0	0	111.5	L7 L44 I50 V51 R52	L7-Q48 HydrophobicContact CD2-CG 3.89Å; L44-Q48 HydrophobicContact CD1-CG 4.38Å; L44-Q48 WeakPolarHBondContact O-CG 3.5Å; L44-Q48 PolarHBondContact O-N 3.28Å; Q48-I50 PolarHBondContact O-N 3.27Å; Q48-V51 PolarHBondContact O-N 3.23Å; Q48-R52 WeakPolarHBondContact O-CB 3.35Å; Q48-R52 WeakPolarHBondContact O-CG 3.33Å; Q48-R52 PolarHBondContact O-N 3.23Å
49	K	79.5	Confident	74.6	Confident	141 Å²	141	76.5 Å²	76.5	61%	0.613	37%	0.371	S	S	*	.	H	α-helix	trans	-62.1	-39.9	174	-75.6	178	-178.4	-176.7	0	112.9	L45 R46 L47 K53	L45-K49 WeakPolarHBondContact O-CG 3.26Å; L45-K49 PolarHBondContact O-N 3.06Å; L45-K49 VanDerWaalsContact O-N 3.08Å; R46-K49 PolarHBondContact O-N 2.71Å; L47-K49 VanDerWaalsContact C-N 3.31Å; L47-K49 PolarHBondContact O-N 2.86Å; K49-K53 WeakPolarHBondContact O-CG 3.48Å; K49-K53 PolarHBondContact O-N 3.36Å
50	I	75.4	Confident	73.2	Confident	84 Å²	84	77.8 Å²	77.8	43%	0.431	38%	0.38	S	S	.	.	H	α-helix	trans	-67.3	-45.1	177.6	-69.5	164.3	0	0	0	110.2	R46 L47 Q48 K53 S54	R46-I50 HydrophobicContact CG-CD1 4.25Å; R46-I50 VanDerWaalsContact O-CG1 3.28Å; R46-I50 WeakPolarHBondContact O-CG1 3.41Å; R46-I50 PolarHBondContact O-N 3.24Å; L47-I50 PolarHBondContact O-N 3.38Å; L47-I50 VanDerWaalsContact O-N 3.08Å; Q48-I50 PolarHBondContact O-N 3.27Å; I50-K53 PolarHBondContact O-N 3.28Å; I50-K53 VanDerWaalsContact O-N 3.17Å; I50-S54 WeakPolarHBondContact O-CB 3.42Å; I50-S54 PolarHBondContact O-N 2.72Å; I50-S54 PolarHBondContact O-OG 2.98Å
51	V	73.9	Confident	71.9	Confident	6 Å²	6	79.8 Å²	79.8	4%	0.036	40%	0.401	C	S	.	.	H	α-helix	trans	-63.2	-46	179.2	176.7	0	0	0	0	110.9	L47 Q48 K53 S54 C55 L59	L47-V51 WeakPolarHBondContact O-CG2 3.28Å; L47-V51 PolarHBondContact O-N 3.15Å; Q48-V51 PolarHBondContact O-N 3.23Å; V51-K53 PolarHBondContact O-N 3.43Å; V51-K53 VanDerWaalsContact O-N 3.13Å; V51-S54 WeakPolarHBondContact CA-OG 3.36Å; V51-S54 PolarHBondContact O-N 3.21Å; V51-S54 PolarHBondContact O-OG 3.48Å; V51-C55 PolarHBondContact O-N 3.41Å; V51-L59 HydrophobicContact CB-CD1 4.21Å; V51-L59 HydrophobicContact CG1-CD1 3.71Å; V51-L59 HydrophobicContact CG2-CD1 4.17Å
52	R	71.4	Confident	70.6	Confident	171 Å²	171	80.2 Å²	80.2	65%	0.645	41%	0.405	S	S	*	.	H	α-helix	trans	-56	-30.3	174.6	-76	-179.2	-177.2	176.7	2	113.5	L7 Q48	L7-R52 HydrophobicContact CD1-CG 3.8Å; Q48-R52 WeakPolarHBondContact O-CB 3.35Å; Q48-R52 WeakPolarHBondContact O-CG 3.33Å; Q48-R52 PolarHBondContact O-N 3.23Å
53	K	70.4	Confident	69.6	Low	195 Å²	195	73.1 Å²	73.1	85%	0.848	37%	0.374	S	S	*	.	H	α-helix	trans	-84.6	-23.4	177.2	-76.6	-174.2	176.5	-166.7	0	114.1	K49 I50 V51	K49-K53 WeakPolarHBondContact O-CG 3.48Å; K49-K53 PolarHBondContact O-N 3.36Å; I50-K53 PolarHBondContact O-N 3.28Å; I50-K53 VanDerWaalsContact O-N 3.17Å; V51-K53 PolarHBondContact O-N 3.43Å; V51-K53 VanDerWaalsContact O-N 3.13Å
54	S	64.8	Low	68.6	Low	72 Å²	72	76.3 Å²	76.3	50%	0.503	39%	0.393	S	S	.	.	H	α-helix	trans	-107.7	-15.8	-165.5	49.6	0	0	0	0	115.2	I50 V51	I50-S54 WeakPolarHBondContact O-CB 3.42Å; I50-S54 PolarHBondContact O-N 2.72Å; I50-S54 PolarHBondContact O-OG 2.98Å; V51-S54 WeakPolarHBondContact CA-OG 3.36Å; V51-S54 PolarHBondContact O-N 3.21Å; V51-S54 PolarHBondContact O-OG 3.48Å
55	C	52.4	Low	67.6	Low	47 Å²	47	79.6 Å²	79.6	32%	0.318	42%	0.416	S	S	.	.			trans	-137.2	129	-173	-68	0	0	0	0	113.6	V51 E57	V51-C55 PolarHBondContact O-N 3.41Å; C55-E57 VanDerWaalsContact C-N 3.35Å
56	S	56.5	Low	66.8	Low	115 Å²	115	79.4 Å²	79.4	80%	0.804	41%	0.412	S	S	*	.	S	Bend	trans	-81.5	-11.2	158	48.2	0	0	0	0	112.9
57	E	52.9	Low	66.2	Low	164 Å²	164	75.3 Å²	75.3	77%	0.766	40%	0.4	S	S	*	.	S	Bend	trans	-94.4	14.9	-171.6	-65.4	-174.3	158.2	0	0	115.1	C55	C55-E57 VanDerWaalsContact C-N 3.35Å
58	G	54.7	Low	65.7	Low	26 Å²	26	78.9 Å²	78.9	27%	0.268	43%	0.426	S	S	.	.	H	α-helix	trans	73.6	167.5	179.8	0	0	0	0	0	114.9
59	L	55.2	Low	65.6	Low	20 Å²	20	85.7 Å²	85.7	11%	0.105	46%	0.455	C	S	.	.	H	α-helix	trans	-66.6	-38.2	-169.6	-171.8	65.6	0	0	0	113.3	L7 V51 L63 C103	L7-L59 HydrophobicContact CD2-CD1 3.83Å; L7-L59 HydrophobicContact CD2-CD2 3.57Å; L7-L59 HydrophobicContact CD2-CG 4.26Å; L7-L59 HydrophobicContact CG-CD1 4.34Å; L7-L59 HydrophobicContact CG-CD2 4.07Å; V51-L59 HydrophobicContact CB-CD1 4.21Å; V51-L59 HydrophobicContact CG1-CD1 3.71Å; V51-L59 HydrophobicContact CG2-CD1 4.17Å; L59-L63 HydrophobicContact CD1-CD1 3.86Å; L59-L63 HydrophobicContact CD1-CG 4.28Å; L59-L63 HydrophobicContact CD2-CD1 4.37Å; L59-L63 HydrophobicContact CG-CD1 3.73Å; L59-L63 HydrophobicContact CG-CG 4.42Å; L59-L63 WeakPolarHBondContact O-CG 3.37Å; L59-L63 PolarHBondContact O-N 2.94Å; L59-C103 WeakPolarHBondContact CD2-SG 3.29Å
60	D	56.6	Low	65.6	Low	93 Å²	93	80.2 Å²	80.2	50%	0.497	43%	0.432	S	S	.	.	H	α-helix	trans	-65.4	-45	-173.6	-88.7	-18.8	0	0	0	112.6	C62 L63 L64	D60-C62 PolarHBondContact O-N 2.93Å; D60-L63 PolarHBondContact O-N 3.31Å; D60-L64 HydrophobicContact CB-CD1 4.42Å; D60-L64 WeakPolarHBondContact O-CB 3.37Å; D60-L64 WeakPolarHBondContact O-CD1 3.45Å; D60-L64 PolarHBondContact O-N 3.43Å
61	G	62.1	Low	65.8	Low	43 Å²	43	82 Å²	82	44%	0.443	44%	0.442	S	S	.	.	H	α-helix	trans	-62	-45.5	-178.7	0	0	0	0	0	112.9	L63	G61-L63 PolarHBondContact O-N 3.35Å
62	C	63	Low	66.1	Low	20 Å²	20	83.9 Å²	83.9	14%	0.135	45%	0.452	C	S	.	.	H	α-helix	trans	-64.9	-41.2	179.6	-173.1	0	0	0	0	112.2	D60 S65	D60-C62 PolarHBondContact O-N 2.93Å; C62-S65 PolarHBondContact O-OG 3.22Å
63	L	66.1	Low	66.6	Low	2 Å²	2	83.8 Å²	83.8	1%	0.01	45%	0.452	C	S	.	.	H	α-helix	trans	-75.8	-36	-177.7	-69.7	179.9	0	0	0	112.9	L59 D60 G61 S65 K66 K67 C103 L106 I107 M110	L59-L63 HydrophobicContact CD1-CD1 3.86Å; L59-L63 HydrophobicContact CD1-CG 4.28Å; L59-L63 HydrophobicContact CD2-CD1 4.37Å; L59-L63 HydrophobicContact CG-CD1 3.73Å; L59-L63 HydrophobicContact CG-CG 4.42Å; L59-L63 WeakPolarHBondContact O-CG 3.37Å; L59-L63 PolarHBondContact O-N 2.94Å; D60-L63 PolarHBondContact O-N 3.31Å; G61-L63 PolarHBondContact O-N 3.35Å; L63-S65 VanDerWaalsContact C-N 3.29Å; L63-S65 PolarHBondContact O-N 2.98Å; L63-K66 WeakPolarHBondContact O-CB 3.41Å; L63-K66 PolarHBondContact O-N 3.19Å; L63-K67 PolarHBondContact O-N 2.89Å; L63-C103 WeakPolarHBondContact CD1-SG 3.47Å; L63-L106 HydrophobicContact CB-CD2 3.73Å; L63-I107 HydrophobicContact CD1-CD1 4.48Å; L63-I107 HydrophobicContact CD1-CG1 4.34Å; L63-M110 HydrophobicContact CD2-CE 4.47Å; L63-M110 HydrophobicContact CD2-SD 3.82Å
64	L	66.4	Low	67.1	Low	115 Å²	115	76 Å²	76	60%	0.602	42%	0.42	S	S	*	.	H	α-helix	trans	-57.6	-41.9	177.7	-104.8	99.7	0	0	0	112.2	D60 K66 K67	D60-L64 HydrophobicContact CB-CD1 4.42Å; D60-L64 WeakPolarHBondContact O-CB 3.37Å; D60-L64 WeakPolarHBondContact O-CD1 3.45Å; D60-L64 PolarHBondContact O-N 3.43Å; L64-K66 PolarHBondContact O-N 2.91Å; L64-K67 WeakPolarHBondContact O-CB 3.16Å; L64-K67 PolarHBondContact O-N 3.02Å; L64-K67 VanDerWaalsContact O-N 3.15Å
65	S	67.5	Low	67.9	Low	70 Å²	70	77.6 Å²	77.6	49%	0.49	43%	0.432	S	S	.	.	H	α-helix	trans	-61.2	-28.7	176.9	77.7	0	0	0	0	113.2	C62 L63 S68	C62-S65 PolarHBondContact O-OG 3.22Å; L63-S65 VanDerWaalsContact C-N 3.29Å; L63-S65 PolarHBondContact O-N 2.98Å; S65-S68 PolarHBondContact O-OG 2.67Å; S65-S68 VanDerWaalsContact O-OG 3.1Å
66	K	68.7	Low	69.2	Low	65 Å²	65	76.4 Å²	76.4	28%	0.283	42%	0.422	S	S	.	.	H	α-helix	trans	-83.3	-28.3	178.6	-66.4	179.4	-176.4	168.4	0	111.9	L63 L64 S68 K69 M110	L63-K66 WeakPolarHBondContact O-CB 3.41Å; L63-K66 PolarHBondContact O-N 3.19Å; L64-K66 PolarHBondContact O-N 2.91Å; K66-S68 PolarHBondContact O-N 3.44Å; K66-K69 PolarHBondContact O-N 3.26Å; K66-M110 HydrophobicContact CB-CE 4.47Å; K66-M110 HydrophobicContact CD-CE 3.67Å
67	K	70.5	Confident	70.3	Confident	100 Å²	100	78.2 Å²	78.2	44%	0.435	41%	0.413	S	S	.	.	H	α-helix	trans	-59.5	-28.6	179.7	-171.2	171.8	-175.5	175.1	0	113.8	L63 L64 R73 L106	L63-K67 PolarHBondContact O-N 2.89Å; L64-K67 WeakPolarHBondContact O-CB 3.16Å; L64-K67 PolarHBondContact O-N 3.02Å; L64-K67 VanDerWaalsContact O-N 3.15Å; K67-R73 PolarHBondContact O-NH2 3.18Å; K67-L106 HydrophobicContact CB-CD1 3.73Å; K67-L106 HydrophobicContact CB-CD2 4.1Å; K67-L106 HydrophobicContact CD-CD1 4.08Å; K67-L106 HydrophobicContact CD-CD2 4.27Å; K67-L106 HydrophobicContact CG-CD1 3.66Å; K67-L106 HydrophobicContact CG-CD2 4.47Å
68	S	72.1	Confident	71.5	Confident	88 Å²	88	74.9 Å²	74.9	62%	0.615	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-18.1	176	55.5	0	0	0	0	113.8	S65 K66	S65-S68 PolarHBondContact O-OG 2.67Å; S65-S68 VanDerWaalsContact O-OG 3.1Å; K66-S68 PolarHBondContact O-N 3.44Å
69	K	77.3	Confident	72.8	Confident	162 Å²	162	74 Å²	74	70%	0.704	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	6.3	-176.2	-63.7	-177.6	178.6	178.1	0	114.2	K66	K66-K69 PolarHBondContact O-N 3.26Å
70	L	80.7	Confident	74	Confident	26 Å²	26	77.9 Å²	77.9	14%	0.136	40%	0.4	C	S	.	.			trans	-83.5	133.3	179	-65.7	172.8	0	0	0	110.4	I72 L106 D109 M110 D113	L70-I72 WeakPolarHBondContact CB-O 3.34Å; L70-I72 PolarHBondContact O-N 3.38Å; L70-L106 HydrophobicContact CD1-CD1 3.61Å; L70-D109 HydrophobicContact CD1-CB 4.13Å; L70-M110 HydrophobicContact CD1-CG 4.05Å; L70-M110 HydrophobicContact CD2-CB 4.32Å; L70-M110 HydrophobicContact CD2-CG 3.88Å; L70-D113 HydrophobicContact CD2-CB 3.65Å
71	N	78.3	Confident	75	Confident	121 Å²	121	77.2 Å²	77.2	65%	0.647	40%	0.396	S	S	*	.	S	Bend	trans	-80.7	-8.6	175.4	-60.3	-42.6	0	0	0	112.5	D113 K117	N71-D113 VanDerWaalsContact CB-OD1 3.28Å; N71-D113 WeakPolarHBondContact CB-OD1 3.34Å; N71-D113 PolarHBondContact N-OD1 3.41Å; N71-D113 PolarHBondContact ND2-OD1 3.34Å; N71-K117 WeakPolarHBondContact ND2-CE 3.34Å
72	I	81	Confident	75.8	Confident	46 Å²	46	77 Å²	77	24%	0.236	38%	0.382	C	S	.	.			trans	-127.1	144.1	176.5	-79.2	-175.9	0	0	0	109	L70 T74 L116	L70-I72 WeakPolarHBondContact CB-O 3.34Å; L70-I72 PolarHBondContact O-N 3.38Å; I72-T74 HydrophobicContact CG2-CG2 3.72Å; I72-L116 HydrophobicContact CD1-CD1 3.08Å; I72-L116 HydrophobicContact CD1-CD2 4.49Å; I72-L116 HydrophobicContact CD1-CG 3.63Å; I72-L116 HydrophobicContact CG1-CD1 3.55Å
73	R	80.9	Confident	76.4	Confident	169 Å²	169	76.9 Å²	76.9	64%	0.638	38%	0.381	S	S	*	.			trans	-129.8	132.8	156.5	-67.2	-178	177.9	178.4	-0.1	107.9	K67 D109	K67-R73 PolarHBondContact O-NH2 3.18Å; R73-D109 WeakPolarHBondContact CA-OD2 3.33Å
74	T	82.5	Confident	76.8	Confident	31 Å²	31	85.1 Å²	85.1	19%	0.19	41%	0.412	C	S	.	.			trans	-105.5	146.7	176.3	67.4	0	0	0	0	110.7	I29 I72 H105 D109 L112	I29-T74 HydrophobicContact CD1-CG2 4.08Å; I72-T74 HydrophobicContact CG2-CG2 3.72Å; T74-H105 PolarHBondContact O-CE1 2.95Å; T74-H105 PolarHBondContact O-NE2 2.84Å; T74-H105 PolarHBondContact OG1-NE2 3.04Å; T74-D109 WeakPolarHBondContact CB-OD1 3.22Å; T74-D109 WeakPolarHBondContact CG2-OD1 3.44Å; T74-D109 PolarHBondContact N-OD1 2.7Å; T74-D109 PolarHBondContact N-OD2 3.01Å; T74-D109 PolarHBondContact OG1-OD1 3.13Å; T74-L112 HydrophobicContact CG2-CD1 3.58Å
75	S	80.7	Confident	76.9	Confident	107 Å²	107	85.3 Å²	85.3	75%	0.748	41%	0.409	S	S	*	.			trans	-98.5	125.6	165.3	54.2	0	0	0	0	108.2
76	N	80.8	Confident	76.7	Confident	22 Å²	22	83.8 Å²	83.8	12%	0.118	40%	0.398	C	S	.	.			trans	-110.7	98.1	178.1	-171.1	-14.7	0	0	0	110.2	I20 F21 R78 L79 E80	I20-N76 PolarHBondContact O-ND2 2.94Å; F21-N76 WeakPolarHBondContact CD1-ND2 3.44Å; N76-R78 PolarHBondContact O-N 3.44Å; N76-R78 WeakPolarHBondContact OD1-CB 3.24Å; N76-R78 PolarHBondContact OD1-N 2.84Å; N76-L79 HydrophobicContact CB-CB 3.94Å; N76-L79 WeakPolarHBondContact O-CB 3.44Å; N76-L79 PolarHBondContact O-N 3.07Å; N76-L79 PolarHBondContact OD1-N 2.88Å; N76-E80 PolarHBondContact O-N 3.39Å; N76-E80 VanDerWaalsContact O-N 3.13Å
77	Y	78.9	Confident	76.1	Confident	152 Å²	152	86.4 Å²	86.4	60%	0.596	42%	0.416	S	S	*	.	H	α-helix	trans	-58.7	-32.6	179.5	79.9	-90.4	0	0	0	112.6	L79 E80 D81	Y77-L79 VanDerWaalsContact C-N 3.27Å; Y77-L79 PolarHBondContact O-N 3.19Å; Y77-E80 PolarHBondContact O-N 3.03Å; Y77-D81 VanDerWaalsContact O-CB 3.23Å; Y77-D81 WeakPolarHBondContact O-CB 3.43Å; Y77-D81 PolarHBondContact O-N 2.87Å
78	R	78.1	Confident	75.2	Confident	95 Å²	95	87.5 Å²	87.5	36%	0.358	43%	0.431	S	S	.	.	H	α-helix	trans	-68.5	-32.9	179.5	-59.2	178.7	77.2	75.6	-1	110.9	D19 I20 N76 Y82	D19-R78 PolarHBondContact O-NE 3.4Å; I20-R78 HydrophobicContact CG2-CB 4.35Å; N76-R78 PolarHBondContact O-N 3.44Å; N76-R78 WeakPolarHBondContact OD1-CB 3.24Å; N76-R78 PolarHBondContact OD1-N 2.84Å; R78-Y82 WeakPolarHBondContact O-CB 3.36Å; R78-Y82 PolarHBondContact O-N 3.43Å
79	L	82.2	Confident	73.9	Confident	6 Å²	6	87.8 Å²	87.8	3%	0.031	43%	0.432	C	S	.	.	H	α-helix	trans	-68.3	-48.1	173.4	174.5	63.6	0	0	0	110.2	I20 F21 N76 Y77 D81 Y82 V83 L101 H105	I20-L79 HydrophobicContact CG2-CB 3.81Å; I20-L79 HydrophobicContact CG2-CD1 4.37Å; F21-L79 HydrophobicContact CZ-CD1 4.48Å; F21-L79 HydrophobicContact CZ-CD2 4.01Å; N76-L79 HydrophobicContact CB-CB 3.94Å; N76-L79 WeakPolarHBondContact O-CB 3.44Å; N76-L79 PolarHBondContact O-N 3.07Å; N76-L79 PolarHBondContact OD1-N 2.88Å; Y77-L79 VanDerWaalsContact C-N 3.27Å; Y77-L79 PolarHBondContact O-N 3.19Å; L79-D81 VanDerWaalsContact C-N 3.32Å; L79-D81 PolarHBondContact O-N 2.83Å; L79-Y82 PolarHBondContact O-N 2.93Å; L79-V83 HydrophobicContact CD1-CG2 4.23Å; L79-V83 VanDerWaalsContact O-CG2 3.3Å; L79-V83 WeakPolarHBondContact O-CG2 3.42Å; L79-V83 PolarHBondContact O-N 3.46Å; L79-L101 HydrophobicContact CD1-CB 3.7Å; L79-L101 HydrophobicContact CD1-CD1 3.94Å; L79-L101 HydrophobicContact CD1-CD2 4.11Å; L79-L101 HydrophobicContact CD1-CG 4.14Å; L79-H105 HydrophobicContact CD2-CB 4Å
80	E	80.1	Confident	72.6	Confident	102 Å²	102	90.9 Å²	90.9	48%	0.477	44%	0.44	S	S	.	.	H	α-helix	trans	-60.1	-43.3	177.7	-68.2	-176.2	-164.5	0	0	112	N76 Y77 V83 R84	N76-E80 PolarHBondContact O-N 3.39Å; N76-E80 VanDerWaalsContact O-N 3.13Å; Y77-E80 PolarHBondContact O-N 3.03Å; E80-V83 PolarHBondContact O-N 3.25Å; E80-R84 WeakPolarHBondContact O-CG 3.44Å; E80-R84 PolarHBondContact O-N 3.06Å
81	D	78.2	Confident	70.9	Confident	79 Å²	79	98.3 Å²	98.3	42%	0.422	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-41.4	178.5	-164.3	37.8	0	0	0	111.8	Y77 L79 V83 R84 H85	Y77-D81 VanDerWaalsContact O-CB 3.23Å; Y77-D81 WeakPolarHBondContact O-CB 3.43Å; Y77-D81 PolarHBondContact O-N 2.87Å; L79-D81 VanDerWaalsContact C-N 3.32Å; L79-D81 PolarHBondContact O-N 2.83Å; D81-V83 PolarHBondContact O-N 3.34Å; D81-R84 PolarHBondContact O-N 3.09Å; D81-H85 PolarHBondContact O-N 2.93Å; D81-H85 PolarHBondContact O-ND1 3.4Å; D81-H85 IonicContact OD1-CE1 3.74Å; D81-H85 PolarHBondContact OD1-CE1 2.94Å; D81-H85 IonicContact OD1-ND1 3.29Å; D81-H85 PolarHBondContact OD1-ND1 3.09Å
82	Y	77.3	Confident	69.6	Low	38 Å²	38	95.9 Å²	95.9	15%	0.149	47%	0.465	C	S	.	.	H	α-helix	trans	-59.9	-45	173.6	176.8	-90.5	0	0	0	112	R16 I20 R78 L79 R84 H85 S86 L101	R16-Y82 HydrophobicContact CG-CE2 4.46Å; R16-Y82 PolarHBondContact NE-OH 2.88Å; R16-Y82 PolarHBondContact NH1-OH 3.14Å; R16-Y82 VanDerWaalsContact NH1-OH 3.16Å; R16-Y82 PolarHBondContact NH2-OH 3.48Å; R16-Y82 VanDerWaalsContact NH2-OH 3.14Å; I20-Y82 HydrophobicContact CD1-CD1 4.16Å; I20-Y82 HydrophobicContact CD1-CD2 4.08Å; I20-Y82 HydrophobicContact CD1-CE2 4.5Å; I20-Y82 HydrophobicContact CD1-CG 3.9Å; R78-Y82 WeakPolarHBondContact O-CB 3.36Å; R78-Y82 PolarHBondContact O-N 3.43Å; L79-Y82 PolarHBondContact O-N 2.93Å; Y82-R84 VanDerWaalsContact C-N 3.35Å; Y82-H85 PolarHBondContact O-N 2.86Å; Y82-S86 WeakPolarHBondContact O-CB 3.49Å; Y82-S86 PolarHBondContact O-N 2.79Å; Y82-S86 PolarHBondContact O-OG 3.41Å; Y82-L101 HydrophobicContact CD1-CD1 3.88Å; Y82-L101 HydrophobicContact CE1-CD1 3.74Å
83	V	76	Confident	68.1	Low	18 Å²	18	103.2 Å²	103.2	11%	0.109	50%	0.498	C	S	.	.	H	α-helix	trans	-64.3	-39.7	178.1	171.9	0	0	0	0	111	L79 E80 D81 H85 S86 L101	L79-V83 HydrophobicContact CD1-CG2 4.23Å; L79-V83 VanDerWaalsContact O-CG2 3.3Å; L79-V83 WeakPolarHBondContact O-CG2 3.42Å; L79-V83 PolarHBondContact O-N 3.46Å; E80-V83 PolarHBondContact O-N 3.25Å; D81-V83 PolarHBondContact O-N 3.34Å; V83-H85 PolarHBondContact O-N 2.99Å; V83-S86 PolarHBondContact O-OG 3.25Å; V83-L101 HydrophobicContact CG2-CD1 4.14Å
84	R	74.5	Confident	67	Low	176 Å²	176	105 Å²	105	66%	0.664	51%	0.505	S	S	*	.	H	α-helix	trans	-63.5	-38.7	176.1	-72.6	176.7	-166.7	-163.2	5.9	112.8	E80 D81 Y82	E80-R84 WeakPolarHBondContact O-CG 3.44Å; E80-R84 PolarHBondContact O-N 3.06Å; D81-R84 PolarHBondContact O-N 3.09Å; Y82-R84 VanDerWaalsContact C-N 3.35Å
85	H	69	Low	66.1	Low	119 Å²	119	106.2 Å²	106.2	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-86.1	-23.5	-178.4	-70	87.1	0	0	0	113.6	D81 Y82 V83 D87 V88	D81-H85 PolarHBondContact O-N 2.93Å; D81-H85 PolarHBondContact O-ND1 3.4Å; D81-H85 IonicContact OD1-CE1 3.74Å; D81-H85 PolarHBondContact OD1-CE1 2.94Å; D81-H85 IonicContact OD1-ND1 3.29Å; D81-H85 PolarHBondContact OD1-ND1 3.09Å; Y82-H85 PolarHBondContact O-N 2.86Å; V83-H85 PolarHBondContact O-N 2.99Å; H85-D87 PolarHBondContact O-N 3.06Å; H85-V88 PolarHBondContact O-N 3.3Å
86	S	63	Low	65.6	Low	37 Å²	37	101.6 Å²	101.6	26%	0.259	48%	0.482	S	S	.	.	H	α-helix	trans	-64.2	-30.3	178.3	59	0	0	0	0	112.8	Y82 V83 V88 S89	Y82-S86 WeakPolarHBondContact O-CB 3.49Å; Y82-S86 PolarHBondContact O-N 2.79Å; Y82-S86 PolarHBondContact O-OG 3.41Å; V83-S86 PolarHBondContact O-OG 3.25Å; S86-V88 PolarHBondContact O-N 2.93Å; S86-V88 VanDerWaalsContact O-N 3.15Å; S86-S89 PolarHBondContact O-N 3.43Å; S86-S89 VanDerWaalsContact O-N 3.15Å
87	D	55.5	Low	65.3	Low	121 Å²	121	102.7 Å²	102.7	65%	0.647	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.3	178.8	-74.4	-22.4	0	0	0	112.9	H85	H85-D87 PolarHBondContact O-N 3.06Å
88	V	51.8	Low	65.2	Low	123 Å²	123	103.5 Å²	103.5	75%	0.745	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-21.5	179.5	-173.1	0	0	0	0	112.5	H85 S86	H85-V88 PolarHBondContact O-N 3.3Å; S86-V88 PolarHBondContact O-N 2.93Å; S86-V88 VanDerWaalsContact O-N 3.15Å
89	S	46.1	Very low	65.1	Low	93 Å²	93	102.1 Å²	102.1	65%	0.65	50%	0.501	S	S	*	.			trans	-115.4	67.6	-174.8	-77.2	0	0	0	0	112.7	S86 H91	S86-S89 PolarHBondContact O-N 3.43Å; S86-S89 VanDerWaalsContact O-N 3.15Å; S89-H91 PolarHBondContact O-N 3.37Å
90	R	49.6	Very low	64.9	Low	228 Å²	228	104.6 Å²	104.6	86%	0.86	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	5.2	-180	-78	-174.4	174.4	177.8	-2	117.1
91	H	44.6	Very low	65	Low	182 Å²	182	99.9 Å²	99.9	84%	0.843	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	15.7	-168.8	-67.7	77.3	0	0	0	115.8	S89	S89-H91 PolarHBondContact O-N 3.37Å
92	S	50.1	Low	65.2	Low	69 Å²	69	99.8 Å²	99.8	48%	0.483	49%	0.49	S	S	.	.			trans	-108	101.8	171.8	-170.1	0	0	0	0	111.2	R94 S95	S92-R94 PolarHBondContact O-N 2.87Å; S92-S95 PolarHBondContact O-N 3.23Å
93	H	50.5	Low	65.5	Low	200 Å²	200	98.3 Å²	98.3	93%	0.926	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	12	171.2	-76.6	-81.3	0	0	0	114.6
94	R	56.9	Low	65.9	Low	206 Å²	206	97.5 Å²	97.5	78%	0.777	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	24.1	178.3	-65.1	-173.5	178.6	-178.1	0.1	112.8	H13 S92	H13-R94 PolarHBondContact CE1-O 3.28Å; S92-R94 PolarHBondContact O-N 2.87Å
95	S	65.3	Low	66.5	Low	57 Å²	57	90.3 Å²	90.3	40%	0.399	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-87.4	134.8	176.8	-167.1	0	0	0	0	111.5	S92	S92-S95 PolarHBondContact O-N 3.23Å
96	L	70.1	Confident	67.3	Low	10 Å²	10	85.4 Å²	85.4	5%	0.052	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-62.8	138.7	169.1	-72.9	165.7	0	0	0	110	A8 H13 L17 E100 L101	A8-L96 HydrophobicContact CB-CD2 4.1Å; H13-L96 HydrophobicContact CB-CD1 3.72Å; H13-L96 HydrophobicContact CB-CD2 4.48Å; H13-L96 HydrophobicContact CB-CG 4.18Å; H13-L96 VanDerWaalsContact CD2-CD2 3.43Å; H13-L96 WeakPolarHBondContact CD2-CD2 3.36Å; L17-L96 HydrophobicContact CD1-CD1 4.26Å; L17-L96 HydrophobicContact CD2-CD1 3.78Å; L17-L96 HydrophobicContact CG-CD1 4.07Å; L96-E100 VanDerWaalsContact CA-OE2 3.24Å; L96-E100 WeakPolarHBondContact CA-OE2 3.38Å; L96-E100 HydrophobicContact CD2-CB 4.19Å; L96-E100 VanDerWaalsContact CD2-OE2 3.28Å; L96-E100 WeakPolarHBondContact CD2-OE2 3.39Å; L96-L101 HydrophobicContact CB-CD2 4.2Å; L96-L101 HydrophobicContact CB-CG 4.12Å; L96-L101 HydrophobicContact CD1-CD2 3.82Å
97	A	74.7	Confident	68.5	Low	46 Å²	46	83.8 Å²	83.8	38%	0.38	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-72	156.9	172.7	0	0	0	0	0	111.1	S99 E100 L101	A97-S99 VanDerWaalsContact C-N 3.3Å; A97-S99 PolarHBondContact O-N 3.01Å; A97-E100 HydrophobicContact CB-CG 4.16Å; A97-E100 PolarHBondContact N-OE2 2.93Å; A97-E100 WeakPolarHBondContact O-CB 3.35Å; A97-E100 PolarHBondContact O-N 2.88Å; A97-E100 VanDerWaalsContact O-N 3.12Å; A97-L101 PolarHBondContact O-N 3.31Å; A97-L101 VanDerWaalsContact O-N 3.14Å
98	R	75.7	Confident	70.1	Confident	168 Å²	168	78.6 Å²	78.6	63%	0.634	39%	0.392	S	S	*	.	H	α-helix	trans	-58.2	-40.6	179.6	-176	171.8	179.4	165.6	0.3	112.7	E100 L101 D102	R98-E100 VanDerWaalsContact C-N 3.33Å; R98-E100 PolarHBondContact O-N 3.43Å; R98-L101 PolarHBondContact O-N 2.76Å; R98-D102 PolarHBondContact O-N 3.45Å
99	S	75.5	Confident	71.8	Confident	66 Å²	66	73.2 Å²	73.2	46%	0.462	36%	0.359	S	S	.	.	H	α-helix	trans	-59.8	-41	175.8	47.7	0	0	0	0	112.5	A97 L101 D102 C103	A97-S99 VanDerWaalsContact C-N 3.3Å; A97-S99 PolarHBondContact O-N 3.01Å; S99-L101 VanDerWaalsContact C-N 3.35Å; S99-L101 PolarHBondContact O-N 3.13Å; S99-D102 PolarHBondContact O-N 3.42Å; S99-C103 VanDerWaalsContact O-CB 3.26Å; S99-C103 WeakPolarHBondContact O-CB 3.2Å; S99-C103 PolarHBondContact O-N 3.43Å
100	E	79.6	Confident	73.8	Confident	58 Å²	58	69.8 Å²	69.8	27%	0.271	33%	0.333	S	S	.	.	H	α-helix	trans	-66.4	-38.2	178	-60	174.2	144.1	0	0	111.6	A8 F10 L96 A97 R98 F104	A8-E100 HydrophobicContact CB-CB 4.19Å; A8-E100 HydrophobicContact CB-CG 3.94Å; A8-E100 WeakPolarHBondContact CB-OE1 3.22Å; F10-E100 HydrophobicContact CE1-CB 4.32Å; F10-E100 WeakPolarHBondContact CE1-O 3.31Å; L96-E100 VanDerWaalsContact CA-OE2 3.24Å; L96-E100 WeakPolarHBondContact CA-OE2 3.38Å; L96-E100 HydrophobicContact CD2-CB 4.19Å; L96-E100 VanDerWaalsContact CD2-OE2 3.28Å; L96-E100 WeakPolarHBondContact CD2-OE2 3.39Å; A97-E100 HydrophobicContact CB-CG 4.16Å; A97-E100 PolarHBondContact N-OE2 2.93Å; A97-E100 WeakPolarHBondContact O-CB 3.35Å; A97-E100 PolarHBondContact O-N 2.88Å; A97-E100 VanDerWaalsContact O-N 3.12Å; R98-E100 VanDerWaalsContact C-N 3.33Å; R98-E100 PolarHBondContact O-N 3.43Å; E100-F104 PolarHBondContact O-N 3.4Å
101	L	81.9	Confident	75.7	Confident	3 Å²	3	59 Å²	59	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-69	-43	176	-69.9	170	0	0	0	112.5	L17 L79 Y82 V83 L96 A97 R98 S99 C103 F104 H105	L17-L101 HydrophobicContact CD2-CD2 3.9Å; L79-L101 HydrophobicContact CD1-CB 3.7Å; L79-L101 HydrophobicContact CD1-CD1 3.94Å; L79-L101 HydrophobicContact CD1-CD2 4.11Å; L79-L101 HydrophobicContact CD1-CG 4.14Å; Y82-L101 HydrophobicContact CD1-CD1 3.88Å; Y82-L101 HydrophobicContact CE1-CD1 3.74Å; V83-L101 HydrophobicContact CG2-CD1 4.14Å; L96-L101 HydrophobicContact CB-CD2 4.2Å; L96-L101 HydrophobicContact CB-CG 4.12Å; L96-L101 HydrophobicContact CD1-CD2 3.82Å; A97-L101 PolarHBondContact O-N 3.31Å; A97-L101 VanDerWaalsContact O-N 3.14Å; R98-L101 PolarHBondContact O-N 2.76Å; S99-L101 VanDerWaalsContact C-N 3.35Å; S99-L101 PolarHBondContact O-N 3.13Å; L101-C103 VanDerWaalsContact C-N 3.29Å; L101-C103 PolarHBondContact O-N 2.93Å; L101-F104 PolarHBondContact O-N 3.3Å; L101-H105 PolarHBondContact O-N 3.16Å
102	D	81.8	Confident	77.8	Confident	78 Å²	78	50.8 Å²	50.8	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-38.8	175.2	-72.1	-24.7	0	0	0	110.9	R98 S99 H105 L106	R98-D102 PolarHBondContact O-N 3.45Å; S99-D102 PolarHBondContact O-N 3.42Å; D102-H105 PolarHBondContact O-N 3.41Å; D102-L106 PolarHBondContact O-N 2.91Å
103	C	82.5	Confident	79.6	Confident	7 Å²	7	47.8 Å²	47.8	5%	0.047	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-45.9	171.8	173.3	0	0	0	0	111.5	L59 L63 S99 L101 H105 L106 I107	L59-C103 WeakPolarHBondContact CD2-SG 3.29Å; L63-C103 WeakPolarHBondContact CD1-SG 3.47Å; S99-C103 VanDerWaalsContact O-CB 3.26Å; S99-C103 WeakPolarHBondContact O-CB 3.2Å; S99-C103 PolarHBondContact O-N 3.43Å; L101-C103 VanDerWaalsContact C-N 3.29Å; L101-C103 PolarHBondContact O-N 2.93Å; C103-H105 VanDerWaalsContact C-N 3.33Å; C103-H105 PolarHBondContact O-N 3.04Å; C103-L106 WeakPolarHBondContact O-CB 3.31Å; C103-L106 PolarHBondContact O-N 3.35Å; C103-I107 WeakPolarHBondContact O-CG1 3.43Å; C103-I107 PolarHBondContact O-N 3.05Å
104	F	86.1	Confident	81.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-39.5	176.2	-170.1	-87.5	0	0	0	112.2	F10 L17 F21 F40 W41 L44 E100 L101 L106 I107 Y108	F10-F104 HydrophobicContact CB-CD2 4.25Å; F10-F104 HydrophobicContact CB-CE2 4.26Å; F10-F104 HydrophobicContact CD1-CB 4.35Å; F10-F104 AromaticContact CD1-CD2 3.66Å; F10-F104 HydrophobicContact CD1-CD2 3.66Å; F10-F104 HydrophobicContact CD1-CE2 4.44Å; F10-F104 HydrophobicContact CD1-CG 4.39Å; F10-F104 HydrophobicContact CD2-CD2 4.24Å; F10-F104 HydrophobicContact CE1-CB 3.86Å; F10-F104 AromaticContact CE1-CD2 3.98Å; F10-F104 HydrophobicContact CE1-CD2 3.98Å; F10-F104 HydrophobicContact CE1-CG 4.38Å; F10-F104 AromaticContact CG-CD2 3.8Å; F10-F104 HydrophobicContact CG-CD2 3.8Å; F10-F104 HydrophobicContact CG-CE2 4.3Å; F10-F104 HydrophobicContact CZ-CB 4.22Å; F10-F104 HydrophobicContact CZ-CD2 4.41Å; L17-F104 HydrophobicContact CB-CE1 4.09Å; L17-F104 HydrophobicContact CB-CE2 4.37Å; L17-F104 HydrophobicContact CB-CZ 3.87Å; L17-F104 HydrophobicContact CD1-CD2 3.81Å; L17-F104 HydrophobicContact CD1-CE2 3.62Å; L17-F104 HydrophobicContact CD1-CG 4.35Å; L17-F104 HydrophobicContact CD1-CZ 4Å; L17-F104 HydrophobicContact CD2-CB 4.46Å; L17-F104 HydrophobicContact CD2-CD1 3.95Å; L17-F104 HydrophobicContact CD2-CD2 4.28Å; L17-F104 HydrophobicContact CD2-CE1 4.18Å; L17-F104 HydrophobicContact CD2-CE2 4.5Å; L17-F104 HydrophobicContact CD2-CG 3.96Å; L17-F104 HydrophobicContact CD2-CZ 4.42Å; L17-F104 HydrophobicContact CG-CE2 4.38Å; L17-F104 HydrophobicContact CG-CZ 4.32Å; F21-F104 HydrophobicContact CB-CE1 4.18Å; F21-F104 HydrophobicContact CD1-CD1 4.38Å; F21-F104 HydrophobicContact CD1-CE1 4.41Å; F21-F104 AromaticContact CD2-CD1 3.47Å; F21-F104 HydrophobicContact CD2-CD1 3.47Å; F21-F104 VanDerWaalsContact CD2-CD1 3.47Å; F21-F104 AromaticContact CD2-CE1 3.39Å; F21-F104 HydrophobicContact CD2-CE1 3.39Å; F21-F104 HydrophobicContact CE1-CD1 4.27Å; F21-F104 AromaticContact CE2-CD1 3.34Å; F21-F104 HydrophobicContact CE2-CD1 3.34Å; F21-F104 AromaticContact CE2-CE1 3.81Å; F21-F104 HydrophobicContact CE2-CE1 3.81Å; F21-F104 HydrophobicContact CE2-CG 4.39Å; F21-F104 HydrophobicContact CG-CD1 4Å; F21-F104 AromaticContact CG-CE1 3.73Å; F21-F104 HydrophobicContact CG-CE1 3.73Å; F21-F104 AromaticContact CZ-CD1 3.76Å; F21-F104 HydrophobicContact CZ-CD1 3.76Å; F21-F104 HydrophobicContact CZ-CE1 4.46Å; F40-F104 HydrophobicContact CE1-CE1 4.24Å; F40-F104 HydrophobicContact CE1-CE2 4Å; F40-F104 AromaticContact CE1-CZ 3.49Å; F40-F104 HydrophobicContact CE1-CZ 3.49Å; F40-F104 VanDerWaalsContact CE1-CZ 3.49Å; F40-F104 HydrophobicContact CZ-CE1 4.08Å; F40-F104 HydrophobicContact CZ-CE2 4.05Å; F40-F104 AromaticContact CZ-CZ 3.65Å; F40-F104 HydrophobicContact CZ-CZ 3.65Å; W41-F104 HydrophobicContact CH2-CE2 4.11Å; W41-F104 AromaticContact CH2-CZ 3.86Å; W41-F104 HydrophobicContact CH2-CZ 3.86Å; W41-F104 HydrophobicContact CZ3-CE2 4.14Å; W41-F104 HydrophobicContact CZ3-CZ 4.3Å; L44-F104 HydrophobicContact CD2-CE2 4Å; E100-F104 PolarHBondContact O-N 3.4Å; L101-F104 PolarHBondContact O-N 3.3Å; F104-L106 VanDerWaalsContact C-N 3.32Å; F104-L106 PolarHBondContact O-N 3.2Å; F104-I107 PolarHBondContact O-N 3.23Å; F104-I107 VanDerWaalsContact O-N 3.16Å; F104-Y108 PolarHBondContact O-N 3.13Å
105	H	86.6	Confident	82.7	Confident	25 Å²	25	33.9 Å²	33.9	12%	0.116	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-42.4	174.8	-167.3	-179.9	0	0	0	111.3	F21 T74 L79 L101 D102 C103 I107 Y108 D109	F21-H105 HydrophobicContact CE1-CB 3.68Å; F21-H105 AromaticContact CE1-CD2 3.69Å; F21-H105 AromaticContact CE1-CG 3.68Å; F21-H105 HydrophobicContact CZ-CB 3.76Å; T74-H105 PolarHBondContact O-CE1 2.95Å; T74-H105 PolarHBondContact O-NE2 2.84Å; T74-H105 PolarHBondContact OG1-NE2 3.04Å; L79-H105 HydrophobicContact CD2-CB 4Å; L101-H105 PolarHBondContact O-N 3.16Å; D102-H105 PolarHBondContact O-N 3.41Å; C103-H105 VanDerWaalsContact C-N 3.33Å; C103-H105 PolarHBondContact O-N 3.04Å; H105-I107 VanDerWaalsContact C-N 3.33Å; H105-I107 PolarHBondContact O-N 2.88Å; H105-Y108 WeakPolarHBondContact O-CB 3.34Å; H105-Y108 PolarHBondContact O-N 3.08Å; H105-D109 IonicContact CD2-OD1 2.71Å; H105-D109 IonicContact NE2-OD1 3.8Å; H105-D109 PolarHBondContact O-N 3.29Å
106	L	86.3	Confident	83.7	Confident	17 Å²	17	33.6 Å²	33.6	9%	0.089	17%	0.17	C	C	.	.	H	α-helix	trans	-60.9	-41.7	173.9	-180	57.6	0	0	0	112.1	L63 K67 L70 D102 C103 F104 Y108 D109 M110	L63-L106 HydrophobicContact CB-CD2 3.73Å; K67-L106 HydrophobicContact CB-CD1 3.73Å; K67-L106 HydrophobicContact CB-CD2 4.1Å; K67-L106 HydrophobicContact CD-CD1 4.08Å; K67-L106 HydrophobicContact CD-CD2 4.27Å; K67-L106 HydrophobicContact CG-CD1 3.66Å; K67-L106 HydrophobicContact CG-CD2 4.47Å; L70-L106 HydrophobicContact CD1-CD1 3.61Å; D102-L106 PolarHBondContact O-N 2.91Å; C103-L106 WeakPolarHBondContact O-CB 3.31Å; C103-L106 PolarHBondContact O-N 3.35Å; F104-L106 VanDerWaalsContact C-N 3.32Å; F104-L106 PolarHBondContact O-N 3.2Å; L106-Y108 VanDerWaalsContact C-N 3.32Å; L106-Y108 PolarHBondContact O-N 2.86Å; L106-D109 PolarHBondContact O-N 2.69Å; L106-M110 VanDerWaalsContact O-CG 3.25Å; L106-M110 WeakPolarHBondContact O-CG 3.47Å; L106-M110 PolarHBondContact O-N 3.18Å
107	I	87.1	Confident	84.5	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-38.3	176	-63.7	167.2	0	0	0	111.4	F10 F40 F43 L44 L47 L63 C103 F104 H105 M110 Y111	F10-I107 HydrophobicContact CE2-CD1 4.23Å; F40-I107 HydrophobicContact CE2-CG2 4.14Å; F40-I107 HydrophobicContact CZ-CG2 4.29Å; F43-I107 HydrophobicContact CE1-CG2 4.18Å; L44-I107 HydrophobicContact CD1-CD1 3.72Å; L44-I107 HydrophobicContact CD1-CG2 3.75Å; L47-I107 HydrophobicContact CD2-CB 4.44Å; L47-I107 HydrophobicContact CD2-CD1 4.4Å; L47-I107 HydrophobicContact CD2-CG1 3.91Å; L47-I107 HydrophobicContact CD2-CG2 3.86Å; L63-I107 HydrophobicContact CD1-CD1 4.48Å; L63-I107 HydrophobicContact CD1-CG1 4.34Å; C103-I107 WeakPolarHBondContact O-CG1 3.43Å; C103-I107 PolarHBondContact O-N 3.05Å; F104-I107 PolarHBondContact O-N 3.23Å; F104-I107 VanDerWaalsContact O-N 3.16Å; H105-I107 VanDerWaalsContact C-N 3.33Å; H105-I107 PolarHBondContact O-N 2.88Å; I107-M110 WeakPolarHBondContact O-CB 3.34Å; I107-M110 PolarHBondContact O-N 2.66Å; I107-Y111 PolarHBondContact O-N 3.34Å
108	Y	88.7	Confident	84.8	Confident	11 Å²	11	39.7 Å²	39.7	4%	0.043	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-48.4	172.6	-178.6	-94.6	0	0	0	111.6	F21 F22 I30 F40 F104 H105 L106 M110 Y111 L112	F21-Y108 HydrophobicContact CB-CD2 4Å; F21-Y108 HydrophobicContact CB-CE2 4.05Å; F21-Y108 HydrophobicContact CD1-CD1 4.12Å; F21-Y108 HydrophobicContact CD1-CD2 4.07Å; F21-Y108 AromaticContact CD1-CG 3.82Å; F21-Y108 HydrophobicContact CD1-CG 3.82Å; F21-Y108 HydrophobicContact CG-CD2 4.4Å; F21-Y108 WeakPolarHBondContact O-CE2 3.46Å; F21-Y108 PolarHBondContact O-OH 3.44Å; F22-Y108 HydrophobicContact CD1-CE2 4.15Å; F22-Y108 HydrophobicContact CE1-CD2 4.07Å; F22-Y108 AromaticContact CE1-CE2 3.55Å; F22-Y108 HydrophobicContact CE1-CE2 3.55Å; F22-Y108 HydrophobicContact CE2-CD2 4.22Å; F22-Y108 HydrophobicContact CE2-CE2 4.28Å; F22-Y108 AromaticContact CZ-CD2 3.64Å; F22-Y108 HydrophobicContact CZ-CD2 3.64Å; F22-Y108 AromaticContact CZ-CE2 3.62Å; F22-Y108 HydrophobicContact CZ-CE2 3.62Å; I30-Y108 HydrophobicContact CD1-CE2 4.13Å; F40-Y108 HydrophobicContact CE2-CD2 4.4Å; F104-Y108 PolarHBondContact O-N 3.13Å; H105-Y108 WeakPolarHBondContact O-CB 3.34Å; H105-Y108 PolarHBondContact O-N 3.08Å; L106-Y108 VanDerWaalsContact C-N 3.32Å; L106-Y108 PolarHBondContact O-N 2.86Å; Y108-M110 VanDerWaalsContact C-N 3.33Å; Y108-M110 PolarHBondContact O-N 2.99Å; Y108-Y111 PolarHBondContact O-N 2.94Å; Y108-Y111 VanDerWaalsContact O-N 3.12Å; Y108-L112 HydrophobicContact CD1-CD1 3.89Å; Y108-L112 HydrophobicContact CD1-CG 4.26Å; Y108-L112 HydrophobicContact CE1-CD1 3.37Å; Y108-L112 HydrophobicContact CE1-CG 3.96Å; Y108-L112 PolarHBondContact O-N 3.17Å
109	D	89	Confident	85.1	Confident	11 Å²	11	37.9 Å²	37.9	6%	0.059	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-39.4	176.1	-80.1	-3.6	0	0	0	112.1	L70 R73 T74 H105 L106 Y111 L112 D113	L70-D109 HydrophobicContact CD1-CB 4.13Å; R73-D109 WeakPolarHBondContact CA-OD2 3.33Å; T74-D109 WeakPolarHBondContact CB-OD1 3.22Å; T74-D109 WeakPolarHBondContact CG2-OD1 3.44Å; T74-D109 PolarHBondContact N-OD1 2.7Å; T74-D109 PolarHBondContact N-OD2 3.01Å; T74-D109 PolarHBondContact OG1-OD1 3.13Å; H105-D109 IonicContact CD2-OD1 2.71Å; H105-D109 IonicContact NE2-OD1 3.8Å; H105-D109 PolarHBondContact O-N 3.29Å; L106-D109 PolarHBondContact O-N 2.69Å; D109-Y111 VanDerWaalsContact C-N 3.31Å; D109-Y111 PolarHBondContact O-N 3.39Å; D109-L112 PolarHBondContact O-N 2.98Å; D109-D113 WeakPolarHBondContact O-CB 3.38Å; D109-D113 PolarHBondContact O-N 3.12Å
110	M	87.8	Confident	85.6	Confident	21 Å²	21	40.5 Å²	40.5	10%	0.103	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-40.3	173.2	-72.1	175.7	67.9	0	0	112.4	F43 L47 L63 K66 L70 L106 I107 Y108 F114	F43-M110 HydrophobicContact CE1-CB 4.48Å; F43-M110 HydrophobicContact CZ-CB 4.37Å; L47-M110 HydrophobicContact CD1-CE 4.09Å; L47-M110 HydrophobicContact CD2-CE 4.14Å; L47-M110 HydrophobicContact CD2-SD 4.32Å; L63-M110 HydrophobicContact CD2-CE 4.47Å; L63-M110 HydrophobicContact CD2-SD 3.82Å; K66-M110 HydrophobicContact CB-CE 4.47Å; K66-M110 HydrophobicContact CD-CE 3.67Å; L70-M110 HydrophobicContact CD1-CG 4.05Å; L70-M110 HydrophobicContact CD2-CB 4.32Å; L70-M110 HydrophobicContact CD2-CG 3.88Å; L106-M110 VanDerWaalsContact O-CG 3.25Å; L106-M110 WeakPolarHBondContact O-CG 3.47Å; L106-M110 PolarHBondContact O-N 3.18Å; I107-M110 WeakPolarHBondContact O-CB 3.34Å; I107-M110 PolarHBondContact O-N 2.66Å; Y108-M110 VanDerWaalsContact C-N 3.33Å; Y108-M110 PolarHBondContact O-N 2.99Å; M110-F114 WeakPolarHBondContact O-CB 3.33Å; M110-F114 PolarHBondContact O-N 3.39Å
111	Y	89.6	Confident	85.9	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-70.5	-38.6	177.2	-176.9	-111.2	0	0	0	112.1	I30 A36 E39 F40 F43 I107 Y108 D109 F114 L115	I30-Y111 HydrophobicContact CD1-CD1 3.61Å; I30-Y111 HydrophobicContact CD1-CE1 3.64Å; A36-Y111 WeakPolarHBondContact CA-OH 3.32Å; A36-Y111 HydrophobicContact CB-CE1 4.44Å; A36-Y111 WeakPolarHBondContact O-CE1 3.45Å; A36-Y111 PolarHBondContact O-OH 3.43Å; A36-Y111 VanDerWaalsContact O-OH 3.09Å; E39-Y111 WeakPolarHBondContact CB-OH 3.34Å; E39-Y111 PolarHBondContact OE2-OH 3.23Å; F40-Y111 HydrophobicContact CB-CD1 3.9Å; F40-Y111 HydrophobicContact CB-CE1 3.78Å; F40-Y111 HydrophobicContact CB-CG 4.37Å; F40-Y111 AromaticContact CD2-CD1 3.63Å; F40-Y111 HydrophobicContact CD2-CD1 3.63Å; F40-Y111 HydrophobicContact CD2-CD2 4.39Å; F40-Y111 HydrophobicContact CD2-CE1 4.39Å; F40-Y111 AromaticContact CD2-CG 3.64Å; F40-Y111 HydrophobicContact CD2-CG 3.64Å; F40-Y111 HydrophobicContact CG-CD1 4.23Å; F43-Y111 HydrophobicContact CB-CD2 3.86Å; F43-Y111 HydrophobicContact CB-CE2 4.08Å; F43-Y111 AromaticContact CD1-CD2 3.76Å; F43-Y111 HydrophobicContact CD1-CD2 3.76Å; F43-Y111 HydrophobicContact CD1-CG 4.2Å; F43-Y111 HydrophobicContact CD2-CD2 4.08Å; F43-Y111 HydrophobicContact CE1-CD2 4.31Å; F43-Y111 AromaticContact CG-CD2 3.63Å; F43-Y111 HydrophobicContact CG-CD2 3.63Å; F43-Y111 HydrophobicContact CG-CE2 4.29Å; F43-Y111 HydrophobicContact CG-CG 4.5Å; I107-Y111 PolarHBondContact O-N 3.34Å; Y108-Y111 PolarHBondContact O-N 2.94Å; Y108-Y111 VanDerWaalsContact O-N 3.12Å; D109-Y111 VanDerWaalsContact C-N 3.31Å; D109-Y111 PolarHBondContact O-N 3.39Å; Y111-F114 HydrophobicContact CD2-CD1 4.19Å; Y111-F114 HydrophobicContact CE2-CD1 4.12Å; Y111-F114 WeakPolarHBondContact O-CB 3.28Å; Y111-F114 PolarHBondContact O-N 2.91Å; Y111-L115 HydrophobicContact CD1-CD1 4.04Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.51Å; Y111-L115 HydrophobicContact CE1-CD2 4.44Å; Y111-L115 HydrophobicContact CE1-CG 3.96Å; Y111-L115 HydrophobicContact CE2-CD2 4.48Å; Y111-L115 HydrophobicContact CE2-CG 4.42Å; Y111-L115 WeakPolarHBondContact O-CG 3.43Å; Y111-L115 PolarHBondContact O-N 2.76Å
112	L	88.8	Confident	85.9	Confident	9 Å²	9	48.5 Å²	48.5	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-44.5	173.5	-70.3	-174.4	0	0	0	112.1	I29 I30 T74 Y108 D109 F114 L115 L116	I29-L112 HydrophobicContact CB-CD2 4.43Å; I29-L112 HydrophobicContact CD1-CD1 3.99Å; I29-L112 HydrophobicContact CG2-CD1 4.13Å; I29-L112 HydrophobicContact CG2-CD2 3.5Å; I29-L112 VanDerWaalsContact CG2-CD2 3.5Å; I29-L112 HydrophobicContact CG2-CG 4.48Å; I30-L112 HydrophobicContact CD1-CD2 3.62Å; I30-L112 HydrophobicContact CG1-CD2 3.95Å; T74-L112 HydrophobicContact CG2-CD1 3.58Å; Y108-L112 HydrophobicContact CD1-CD1 3.89Å; Y108-L112 HydrophobicContact CD1-CG 4.26Å; Y108-L112 HydrophobicContact CE1-CD1 3.37Å; Y108-L112 HydrophobicContact CE1-CG 3.96Å; Y108-L112 PolarHBondContact O-N 3.17Å; D109-L112 PolarHBondContact O-N 2.98Å; L112-F114 VanDerWaalsContact C-N 3.32Å; L112-F114 PolarHBondContact O-N 2.75Å; L112-L115 PolarHBondContact O-N 3.28Å; L112-L116 PolarHBondContact O-N 3.02Å
113	D	88.3	Confident	86.1	Confident	6 Å²	6	47.6 Å²	47.6	3%	0.032	22%	0.22	C	C	.	.	H	α-helix	trans	-61	-40.8	174.2	179.5	73.6	0	0	0	111.5	L70 N71 D109 L116 K117	L70-D113 HydrophobicContact CD2-CB 3.65Å; N71-D113 VanDerWaalsContact CB-OD1 3.28Å; N71-D113 WeakPolarHBondContact CB-OD1 3.34Å; N71-D113 PolarHBondContact N-OD1 3.41Å; N71-D113 PolarHBondContact ND2-OD1 3.34Å; D109-D113 WeakPolarHBondContact O-CB 3.38Å; D109-D113 PolarHBondContact O-N 3.12Å; D113-L116 PolarHBondContact O-N 3.4Å; D113-K117 WeakPolarHBondContact O-CB 3.35Å; D113-K117 WeakPolarHBondContact O-CG 3.36Å; D113-K117 PolarHBondContact O-N 2.92Å; D113-K117 IonicContact OD1-NZ 3.01Å; D113-K117 WeakPolarHBondContact OD2-CD 3.47Å; D113-K117 WeakPolarHBondContact OD2-CE 3.25Å; D113-K117 IonicContact OD2-NZ 2.92Å; D113-K117 PolarHBondContact OD2-NZ 3.38Å
114	F	86.4	Confident	86.3	Confident	90 Å²	90	51.2 Å²	51.2	40%	0.395	24%	0.242	S	C	.	.	H	α-helix	trans	-60	-46.5	172.2	169.5	-101.3	0	0	0	112.5	M110 Y111 L112 L116 K117 R118	M110-F114 WeakPolarHBondContact O-CB 3.33Å; M110-F114 PolarHBondContact O-N 3.39Å; Y111-F114 HydrophobicContact CD2-CD1 4.19Å; Y111-F114 HydrophobicContact CE2-CD1 4.12Å; Y111-F114 WeakPolarHBondContact O-CB 3.28Å; Y111-F114 PolarHBondContact O-N 2.91Å; L112-F114 VanDerWaalsContact C-N 3.32Å; L112-F114 PolarHBondContact O-N 2.75Å; F114-L116 VanDerWaalsContact C-N 3.34Å; F114-L116 PolarHBondContact O-N 3.05Å; F114-K117 PolarHBondContact O-N 3.44Å; F114-R118 WeakPolarHBondContact O-CB 3.44Å; F114-R118 PolarHBondContact O-N 3.07Å
115	L	85.8	Confident	86.3	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.12	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-39.7	177.4	-73	-178.9	0	0	0	112.2	I30 A36 Y111 L112 R118 K119	I30-L115 HydrophobicContact CD1-CD1 4.27Å; A36-L115 HydrophobicContact CB-CD1 4.38Å; Y111-L115 HydrophobicContact CD1-CD1 4.04Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.51Å; Y111-L115 HydrophobicContact CE1-CD2 4.44Å; Y111-L115 HydrophobicContact CE1-CG 3.96Å; Y111-L115 HydrophobicContact CE2-CD2 4.48Å; Y111-L115 HydrophobicContact CE2-CG 4.42Å; Y111-L115 WeakPolarHBondContact O-CG 3.43Å; Y111-L115 PolarHBondContact O-N 2.76Å; L112-L115 PolarHBondContact O-N 3.28Å; L115-R118 VanDerWaalsContact CD2-NH2 3.26Å; L115-K119 WeakPolarHBondContact O-CG 3.45Å; L115-K119 PolarHBondContact O-N 3.48Å; L115-K119 VanDerWaalsContact O-N 3.07Å
116	L	85.8	Confident	86.2	Confident	51 Å²	51	57.6 Å²	57.6	27%	0.267	27%	0.271	S	S	.	.	H	α-helix	trans	-62.1	-53.7	173.1	-88.4	-159.6	0	0	0	111.5	I72 L112 D113 F114 R118 K119 F120	I72-L116 HydrophobicContact CD1-CD1 3.08Å; I72-L116 HydrophobicContact CD1-CD2 4.49Å; I72-L116 HydrophobicContact CD1-CG 3.63Å; I72-L116 HydrophobicContact CG1-CD1 3.55Å; L112-L116 PolarHBondContact O-N 3.02Å; D113-L116 PolarHBondContact O-N 3.4Å; F114-L116 VanDerWaalsContact C-N 3.34Å; F114-L116 PolarHBondContact O-N 3.05Å; L116-R118 PolarHBondContact O-N 3.4Å; L116-K119 CarbonylContact O-C 3.59Å; L116-K119 WeakPolarHBondContact O-CA 3.37Å; L116-K119 WeakPolarHBondContact O-CB 3.42Å; L116-K119 PolarHBondContact O-N 3.08Å; L116-F120 HydrophobicContact CB-CD2 4.35Å; L116-F120 HydrophobicContact CB-CE2 4.45Å; L116-F120 HydrophobicContact CD1-CE2 4.3Å; L116-F120 HydrophobicContact CD2-CE2 4.4Å; L116-F120 VanDerWaalsContact O-CD2 3.3Å; L116-F120 WeakPolarHBondContact O-CD2 3.35Å; L116-F120 PolarHBondContact O-N 3.42Å
117	K	86.2	Confident	86.3	Confident	95 Å²	95	59.9 Å²	59.9	41%	0.413	28%	0.278	S	S	.	.	H	α-helix	trans	-54.6	-40.9	178.4	-76.7	172.5	175.6	164.3	0	111.1	N71 D113 F114 K119 F120 A121	N71-K117 WeakPolarHBondContact ND2-CE 3.34Å; D113-K117 WeakPolarHBondContact O-CB 3.35Å; D113-K117 WeakPolarHBondContact O-CG 3.36Å; D113-K117 PolarHBondContact O-N 2.92Å; D113-K117 IonicContact OD1-NZ 3.01Å; D113-K117 WeakPolarHBondContact OD2-CD 3.47Å; D113-K117 WeakPolarHBondContact OD2-CE 3.25Å; D113-K117 IonicContact OD2-NZ 2.92Å; D113-K117 PolarHBondContact OD2-NZ 3.38Å; F114-K117 PolarHBondContact O-N 3.44Å; K117-K119 PolarHBondContact O-N 2.93Å; K117-F120 PolarHBondContact O-N 3.46Å; K117-A121 VanDerWaalsContact O-CB 3.29Å; K117-A121 WeakPolarHBondContact O-CB 3.27Å; K117-A121 PolarHBondContact O-N 2.92Å
118	R	82.2	Confident	86.3	Confident	89 Å²	89	64 Å²	64	34%	0.336	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-39.3	174.5	-170.4	171.6	72.4	171.3	-3.8	112.9	E39 F114 L115 L116 R122	E39-R118 IonicContact OE2-CZ 3.54Å; E39-R118 IonicContact OE2-NH1 3.18Å; E39-R118 IonicContact OE2-NH2 2.69Å; F114-R118 WeakPolarHBondContact O-CB 3.44Å; F114-R118 PolarHBondContact O-N 3.07Å; L115-R118 VanDerWaalsContact CD2-NH2 3.26Å; L116-R118 PolarHBondContact O-N 3.4Å; R118-R122 WeakPolarHBondContact O-CG 3.38Å; R118-R122 PolarHBondContact O-N 3.32Å
119	K	82.2	Confident	86.1	Confident	130 Å²	130	67.2 Å²	67.2	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-70.3	-45.6	175.4	-73.3	175.6	-177.7	175	0	111.7	L115 L116 K117 A121 R122 I123	L115-K119 WeakPolarHBondContact O-CG 3.45Å; L115-K119 PolarHBondContact O-N 3.48Å; L115-K119 VanDerWaalsContact O-N 3.07Å; L116-K119 CarbonylContact O-C 3.59Å; L116-K119 WeakPolarHBondContact O-CA 3.37Å; L116-K119 WeakPolarHBondContact O-CB 3.42Å; L116-K119 PolarHBondContact O-N 3.08Å; K117-K119 PolarHBondContact O-N 2.93Å; K119-A121 PolarHBondContact O-N 3.43Å; K119-R122 WeakPolarHBondContact O-CB 3.06Å; K119-R122 PolarHBondContact O-N 3.14Å; K119-R122 VanDerWaalsContact O-N 3.14Å; K119-I123 WeakPolarHBondContact O-CG1 3.34Å; K119-I123 PolarHBondContact O-N 2.91Å
120	F	85.2	Confident	86.1	Confident	121 Å²	121	67.4 Å²	67.4	53%	0.531	32%	0.318	S	S	.	.	H	α-helix	trans	-60	-44.7	176	-81.9	-67.8	0	0	0	111.6	L116 K117 R122 I123 V124	L116-F120 HydrophobicContact CB-CD2 4.35Å; L116-F120 HydrophobicContact CB-CE2 4.45Å; L116-F120 HydrophobicContact CD1-CE2 4.3Å; L116-F120 HydrophobicContact CD2-CE2 4.4Å; L116-F120 VanDerWaalsContact O-CD2 3.3Å; L116-F120 WeakPolarHBondContact O-CD2 3.35Å; L116-F120 PolarHBondContact O-N 3.42Å; K117-F120 PolarHBondContact O-N 3.46Å; F120-R122 PolarHBondContact O-N 3.46Å; F120-I123 PolarHBondContact O-N 2.93Å; F120-V124 WeakPolarHBondContact O-CG2 3.36Å; F120-V124 PolarHBondContact O-N 3.4Å
121	A	86.6	Confident	86	Confident	60 Å²	60	69.9 Å²	69.9	50%	0.496	34%	0.337	S	S	.	.	H	α-helix	trans	-57.9	-36.5	175.6	0	0	0	0	0	112.5	K117 K119 K125	K117-A121 VanDerWaalsContact O-CB 3.29Å; K117-A121 WeakPolarHBondContact O-CB 3.27Å; K117-A121 PolarHBondContact O-N 2.92Å; K119-A121 PolarHBondContact O-N 3.43Å; A121-K125 VanDerWaalsContact O-CB 3.28Å; A121-K125 WeakPolarHBondContact O-CB 3.47Å; A121-K125 PolarHBondContact O-N 3.49Å
122	R	81.9	Confident	86	Confident	169 Å²	169	74 Å²	74	64%	0.638	36%	0.363	S	S	*	.	H	α-helix	trans	-68.1	-40.2	174.2	-71.6	174.4	-178.2	-172	-0.4	112.6	R118 K119 F120 L126	R118-R122 WeakPolarHBondContact O-CG 3.38Å; R118-R122 PolarHBondContact O-N 3.32Å; K119-R122 WeakPolarHBondContact O-CB 3.06Å; K119-R122 PolarHBondContact O-N 3.14Å; K119-R122 VanDerWaalsContact O-N 3.14Å; F120-R122 PolarHBondContact O-N 3.46Å; R122-L126 WeakPolarHBondContact O-CB 3.26Å; R122-L126 PolarHBondContact O-N 2.89Å
123	I	85.1	Confident	85.9	Confident	59 Å²	59	74.6 Å²	74.6	30%	0.303	37%	0.365	S	S	.	.	H	α-helix	trans	-66.8	-45.7	176.9	-64.8	169.4	0	0	0	110.3	K119 F120 K125 L126 R127 L211	K119-I123 WeakPolarHBondContact O-CG1 3.34Å; K119-I123 PolarHBondContact O-N 2.91Å; F120-I123 PolarHBondContact O-N 2.93Å; I123-K125 VanDerWaalsContact C-N 3.35Å; I123-K125 PolarHBondContact O-N 3.23Å; I123-L126 WeakPolarHBondContact O-CB 3.28Å; I123-L126 PolarHBondContact O-N 2.91Å; I123-L126 VanDerWaalsContact O-N 3.16Å; I123-R127 WeakPolarHBondContact O-CG 3.26Å; I123-R127 PolarHBondContact O-N 3.49Å; I123-L211 HydrophobicContact CD1-CD1 4.4Å; I123-L211 HydrophobicContact CG1-CD2 4.09Å; I123-L211 HydrophobicContact CG2-CD1 4.18Å
124	V	87.6	Confident	86	Confident	84 Å²	84	75.2 Å²	75.2	51%	0.509	37%	0.37	S	S	.	.	H	α-helix	trans	-58.5	-48.7	175.9	171.5	0	0	0	0	110	F120 L126 R127 I128	F120-V124 WeakPolarHBondContact O-CG2 3.36Å; F120-V124 PolarHBondContact O-N 3.4Å; V124-L126 VanDerWaalsContact C-N 3.32Å; V124-L126 PolarHBondContact O-N 2.9Å; V124-R127 PolarHBondContact O-N 2.9Å; V124-I128 HydrophobicContact CG1-CD1 3.79Å; V124-I128 HydrophobicContact CG1-CG1 4.47Å; V124-I128 WeakPolarHBondContact O-CG1 3.19Å; V124-I128 PolarHBondContact O-N 3.41Å
125	K	85.3	Confident	86.3	Confident	132 Å²	132	71 Å²	71	57%	0.574	35%	0.351	S	S	*	.	H	α-helix	trans	-56.1	-46.8	174.3	-178.5	176.6	177.8	177.2	0	111.7	A121 I123 R127 I128 D129	A121-K125 VanDerWaalsContact O-CB 3.28Å; A121-K125 WeakPolarHBondContact O-CB 3.47Å; A121-K125 PolarHBondContact O-N 3.49Å; I123-K125 VanDerWaalsContact C-N 3.35Å; I123-K125 PolarHBondContact O-N 3.23Å; K125-R127 VanDerWaalsContact C-N 3.33Å; K125-R127 PolarHBondContact O-N 3.41Å; K125-I128 PolarHBondContact O-N 3.3Å; K125-D129 WeakPolarHBondContact O-CB 3.18Å; K125-D129 PolarHBondContact O-N 3.24Å
126	L	85.3	Confident	86.5	Confident	27 Å²	27	71.1 Å²	71.1	14%	0.141	36%	0.356	C	S	.	.	H	α-helix	trans	-59.1	-43	178.8	-174.7	149.3	0	0	0	112.1	R122 I123 V124 D129 Q130 T208 E209	R122-L126 WeakPolarHBondContact O-CB 3.26Å; R122-L126 PolarHBondContact O-N 2.89Å; I123-L126 WeakPolarHBondContact O-CB 3.28Å; I123-L126 PolarHBondContact O-N 2.91Å; I123-L126 VanDerWaalsContact O-N 3.16Å; V124-L126 VanDerWaalsContact C-N 3.32Å; V124-L126 PolarHBondContact O-N 2.9Å; L126-D129 PolarHBondContact O-N 3.47Å; L126-Q130 HydrophobicContact CD2-CG 4.29Å; L126-Q130 WeakPolarHBondContact O-CG 3.18Å; L126-Q130 PolarHBondContact O-N 3.33Å; L126-T208 HydrophobicContact CD1-CG2 4.5Å; L126-E209 HydrophobicContact CD1-CG 4.3Å; L126-E209 HydrophobicContact CD2-CB 4.48Å
127	R	87.6	Confident	86.8	Confident	64 Å²	64	75.1 Å²	75.1	24%	0.242	38%	0.377	C	S	.	.	H	α-helix	trans	-67.7	-38.9	177.6	-67.4	-57.5	-170.8	-145.6	1.9	112.5	I123 V124 K125 Q130 S131 E209	I123-R127 WeakPolarHBondContact O-CG 3.26Å; I123-R127 PolarHBondContact O-N 3.49Å; V124-R127 PolarHBondContact O-N 2.9Å; K125-R127 VanDerWaalsContact C-N 3.33Å; K125-R127 PolarHBondContact O-N 3.41Å; R127-Q130 PolarHBondContact O-N 3Å; R127-S131 PolarHBondContact O-N 2.88Å; R127-S131 PolarHBondContact O-OG 3.27Å; R127-E209 PolarHBondContact NH1-O 2.9Å
128	I	87.4	Confident	87.2	Confident	90 Å²	90	72.5 Å²	72.5	46%	0.462	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-51.6	172.9	-67.5	167.1	0	0	0	109.5	V124 K125 Q130 S131 V132	V124-I128 HydrophobicContact CG1-CD1 3.79Å; V124-I128 HydrophobicContact CG1-CG1 4.47Å; V124-I128 WeakPolarHBondContact O-CG1 3.19Å; V124-I128 PolarHBondContact O-N 3.41Å; K125-I128 PolarHBondContact O-N 3.3Å; I128-Q130 PolarHBondContact O-N 2.96Å; I128-S131 PolarHBondContact O-N 2.92Å; I128-S131 PolarHBondContact O-OG 3.42Å; I128-V132 HydrophobicContact CG2-CG2 4.31Å; I128-V132 WeakPolarHBondContact O-CG2 3.41Å; I128-V132 PolarHBondContact O-N 3.16Å
129	D	84.8	Confident	87.7	Confident	79 Å²	79	70.3 Å²	70.3	42%	0.422	36%	0.358	S	S	.	.	H	α-helix	trans	-56.4	-39.9	179.6	-66.6	-12.1	0	0	0	111.1	K125 L126	K125-D129 WeakPolarHBondContact O-CB 3.18Å; K125-D129 PolarHBondContact O-N 3.24Å; L126-D129 PolarHBondContact O-N 3.47Å
130	Q	87.6	Confident	88.2	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.065	36%	0.361	C	S	.	.	H	α-helix	trans	-64.6	-41.6	174.2	-75	-176.7	-56.1	0	0	113	L126 R127 I128 V132 L133	L126-Q130 HydrophobicContact CD2-CG 4.29Å; L126-Q130 WeakPolarHBondContact O-CG 3.18Å; L126-Q130 PolarHBondContact O-N 3.33Å; R127-Q130 PolarHBondContact O-N 3Å; I128-Q130 PolarHBondContact O-N 2.96Å; Q130-V132 VanDerWaalsContact C-N 3.29Å; Q130-V132 PolarHBondContact O-N 3.49Å; Q130-L133 WeakPolarHBondContact O-CB 3.48Å; Q130-L133 PolarHBondContact O-N 3.42Å
131	S	86.7	Confident	88.7	Confident	74 Å²	74	67.7 Å²	67.7	52%	0.517	36%	0.356	S	S	.	.	H	α-helix	trans	-69.7	-24.9	-179.3	69.3	0	0	0	0	113.8	R127 I128	R127-S131 PolarHBondContact O-N 2.88Å; R127-S131 PolarHBondContact O-OG 3.27Å; I128-S131 PolarHBondContact O-N 2.92Å; I128-S131 PolarHBondContact O-OG 3.42Å
132	V	88.3	Confident	89.1	Confident	89 Å²	89	64.9 Å²	64.9	54%	0.539	33%	0.333	S	S	.	.	H	α-helix	trans	-82.8	-16.8	179.6	176.1	0	0	0	0	111.7	I128 Q130 L317	I128-V132 HydrophobicContact CG2-CG2 4.31Å; I128-V132 WeakPolarHBondContact O-CG2 3.41Å; I128-V132 PolarHBondContact O-N 3.16Å; Q130-V132 VanDerWaalsContact C-N 3.29Å; Q130-V132 PolarHBondContact O-N 3.49Å; V132-L317 HydrophobicContact CG1-CD2 3.84Å; V132-L317 WeakPolarHBondContact O-CD2 3.25Å
133	L	88.6	Confident	89.7	Confident	20 Å²	20	57 Å²	57	11%	0.105	30%	0.303	C	S	.	.	S	Bend	trans	-62.5	133.7	178.1	-72.3	167.6	0	0	0	111.1	Q130 I135 A136 Q165 L317	Q130-L133 WeakPolarHBondContact O-CB 3.48Å; Q130-L133 PolarHBondContact O-N 3.42Å; L133-I135 HydrophobicContact CB-CG2 4.17Å; L133-I135 PolarHBondContact O-N 2.95Å; L133-I135 VanDerWaalsContact O-N 3.11Å; L133-A136 WeakPolarHBondContact O-CB 3.37Å; L133-A136 PolarHBondContact O-N 2.96Å; L133-Q165 HydrophobicContact CD1-CG 3.62Å; L133-L317 HydrophobicContact CD2-CD1 3.88Å; L133-L317 HydrophobicContact CD2-CG 4.5Å
134	P	89.2	Confident	90.2	Very high	19 Å²	19	56 Å²	56	12%	0.123	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-52.7	-37.9	-179.8	-28.2	32.3	0	0	0	114.4	A136 N137 F138 C160 V313	P134-A136 PolarHBondContact O-N 3.23Å; P134-N137 PolarHBondContact O-N 3.45Å; P134-F138 WeakPolarHBondContact O-CD2 3.31Å; P134-C160 HydrophobicContact CB-CB 4.06Å; P134-C160 HydrophobicContact CG-CB 4.09Å; P134-V313 HydrophobicContact CB-CG1 3.73Å
135	I	91.8	Very high	90.6	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-62.3	-21.7	178.4	-167.8	64.6	0	0	0	113.3	L133 N137 F138 R139 V154 C160 Q165 V166 Y169 V313	L133-I135 HydrophobicContact CB-CG2 4.17Å; L133-I135 PolarHBondContact O-N 2.95Å; L133-I135 VanDerWaalsContact O-N 3.11Å; I135-N137 VanDerWaalsContact C-N 3.27Å; I135-N137 PolarHBondContact O-N 3.46Å; I135-F138 HydrophobicContact CD1-CB 4.49Å; I135-F138 PolarHBondContact O-N 3.15Å; I135-F138 VanDerWaalsContact O-N 3.09Å; I135-R139 PolarHBondContact O-N 3.5Å; I135-V154 HydrophobicContact CD1-CG1 3.76Å; I135-C160 WeakPolarHBondContact CB-O 3.46Å; I135-C160 WeakPolarHBondContact CG2-O 3.36Å; I135-C160 PolarHBondContact N-O 3.46Å; I135-Q165 HydrophobicContact CG2-CB 3.8Å; I135-Q165 HydrophobicContact CG2-CG 3.77Å; I135-V166 HydrophobicContact CD1-CG2 4.28Å; I135-V166 HydrophobicContact CG1-CG2 4.22Å; I135-Y169 HydrophobicContact CG1-CE2 4.11Å; I135-Y169 HydrophobicContact CG2-CE2 4.38Å; I135-V313 HydrophobicContact CD1-CG2 3.54Å
136	A	91.1	Very high	91.1	Very high	26 Å²	26	46.8 Å²	46.8	22%	0.215	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-61.1	-37.6	179.8	0	0	0	0	0	112.1	L133 P134 F138 R139 Y169	L133-A136 WeakPolarHBondContact O-CB 3.37Å; L133-A136 PolarHBondContact O-N 2.96Å; P134-A136 PolarHBondContact O-N 3.23Å; A136-F138 PolarHBondContact O-N 2.93Å; A136-R139 WeakPolarHBondContact O-CB 3.41Å; A136-R139 PolarHBondContact O-N 3.33Å; A136-Y169 WeakPolarHBondContact CA-OH 3.32Å
137	N	91.8	Very high	91.5	Very high	135 Å²	135	47.6 Å²	47.6	72%	0.722	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-66	-20.7	177.6	-63.4	-26.4	0	0	0	112.8	P134 I135	P134-N137 PolarHBondContact O-N 3.45Å; I135-N137 VanDerWaalsContact C-N 3.27Å; I135-N137 PolarHBondContact O-N 3.46Å
138	F	93.9	Very high	91.8	Very high	41 Å²	41	51.7 Å²	51.7	18%	0.18	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-102.7	5.7	-177.4	-64.9	-92.7	0	0	0	112.9	P134 I135 A136 T140 E141 L142 I311 V313 P314	P134-F138 WeakPolarHBondContact O-CD2 3.31Å; I135-F138 HydrophobicContact CD1-CB 4.49Å; I135-F138 PolarHBondContact O-N 3.15Å; I135-F138 VanDerWaalsContact O-N 3.09Å; A136-F138 PolarHBondContact O-N 2.93Å; F138-T140 PolarHBondContact O-N 3.02Å; F138-E141 VanDerWaalsContact CD1-OE2 3.25Å; F138-E141 WeakPolarHBondContact CD1-OE2 3.23Å; F138-E141 PolarHBondContact O-N 2.83Å; F138-L142 VanDerWaalsContact O-CB 3.31Å; F138-L142 WeakPolarHBondContact O-CB 3.3Å; F138-L142 PolarHBondContact O-N 2.73Å; F138-I311 HydrophobicContact CB-CG2 4.14Å; F138-I311 HydrophobicContact CD1-CG2 3.72Å; F138-I311 HydrophobicContact CG-CG2 4.2Å; F138-V313 HydrophobicContact CB-CG2 4.38Å; F138-V313 HydrophobicContact CD2-CB 4.37Å; F138-V313 HydrophobicContact CD2-CG1 3.98Å; F138-V313 HydrophobicContact CD2-CG2 4.01Å; F138-V313 HydrophobicContact CE2-CB 4.46Å; F138-V313 HydrophobicContact CE2-CG1 4.09Å; F138-V313 HydrophobicContact CG-CG2 4.08Å; F138-P314 VanDerWaalsContact CZ-CD 3.49Å; F138-P314 HydrophobicContact CZ-CG 4.34Å
139	R	93.4	Very high	92.2	Very high	43 Å²	43	51.6 Å²	51.6	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-56.2	-50.7	-179.5	176.1	178.2	174	-179.1	-2.9	111.9	I135 A136 L142 L143 Y169 G173 S175 N178	I135-R139 PolarHBondContact O-N 3.5Å; A136-R139 WeakPolarHBondContact O-CB 3.41Å; A136-R139 PolarHBondContact O-N 3.33Å; R139-L142 PolarHBondContact O-N 2.92Å; R139-L143 HydrophobicContact CG-CD1 4.15Å; R139-L143 WeakPolarHBondContact O-CG 3.48Å; R139-L143 PolarHBondContact O-N 2.7Å; R139-L143 VanDerWaalsContact O-N 3.14Å; R139-Y169 HydrophobicContact CB-CD2 3.97Å; R139-Y169 HydrophobicContact CB-CE2 3.84Å; R139-Y169 HydrophobicContact CB-CG 4.39Å; R139-Y169 HydrophobicContact CG-CD1 4.03Å; R139-Y169 HydrophobicContact CG-CD2 3.89Å; R139-Y169 HydrophobicContact CG-CE1 4.33Å; R139-Y169 HydrophobicContact CG-CE2 4.17Å; R139-Y169 HydrophobicContact CG-CG 3.81Å; R139-G173 PolarHBondContact NH2-O 2.84Å; R139-S175 PolarHBondContact NH2-O 3.01Å; R139-N178 PolarHBondContact NH1-OD1 3.05Å; R139-N178 PolarHBondContact NH2-OD1 2.77Å
140	T	93	Very high	92.8	Very high	104 Å²	104	50.6 Å²	50.6	64%	0.638	28%	0.275	S	S	*	.	H	α-helix	trans	-66.9	-41.7	-177	-49.5	0	0	0	0	111.4	F138 L143 S144	F138-T140 PolarHBondContact O-N 3.02Å; T140-L143 PolarHBondContact O-N 2.76Å; T140-S144 WeakPolarHBondContact O-CB 3.19Å; T140-S144 PolarHBondContact O-N 2.85Å
141	E	95.1	Very high	93.3	Very high	91 Å²	91	50.3 Å²	50.3	43%	0.425	27%	0.274	S	S	.	.	H	α-helix	trans	-61.9	-44.2	176.3	-174	-177.5	159.6	0	0	111.7	F138 S144 T145 I311	F138-E141 VanDerWaalsContact CD1-OE2 3.25Å; F138-E141 WeakPolarHBondContact CD1-OE2 3.23Å; F138-E141 PolarHBondContact O-N 2.83Å; E141-S144 PolarHBondContact O-N 3.4Å; E141-T145 WeakPolarHBondContact O-CB 3.17Å; E141-T145 PolarHBondContact O-N 2.87Å; E141-T145 PolarHBondContact O-OG1 3.38Å; E141-I311 HydrophobicContact CG-CD1 4.29Å; E141-I311 HydrophobicContact CG-CG1 4.45Å
142	L	95.5	Very high	93.8	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-52.5	176.6	175	62.7	0	0	0	112.2	F138 R139 T145 L146 V152 V154 V166 Y169 I311	F138-L142 VanDerWaalsContact O-CB 3.31Å; F138-L142 WeakPolarHBondContact O-CB 3.3Å; F138-L142 PolarHBondContact O-N 2.73Å; R139-L142 PolarHBondContact O-N 2.92Å; L142-T145 PolarHBondContact O-N 3.48Å; L142-L146 VanDerWaalsContact O-CB 3.29Å; L142-L146 WeakPolarHBondContact O-CB 3.48Å; L142-L146 PolarHBondContact O-N 2.87Å; L142-V152 HydrophobicContact CD1-CG1 4.32Å; L142-V154 HydrophobicContact CD1-CG2 3.56Å; L142-V166 HydrophobicContact CD2-CB 4.48Å; L142-V166 HydrophobicContact CD2-CG1 4.09Å; L142-V166 HydrophobicContact CD2-CG2 4.01Å; L142-Y169 HydrophobicContact CD2-CD2 4.35Å; L142-I311 VanDerWaalsContact CA-CD1 3.46Å; L142-I311 HydrophobicContact CB-CD1 4.02Å; L142-I311 HydrophobicContact CD1-CD1 3.94Å
143	L	95.6	Very high	94.2	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-65	-43.4	-177.9	-66.8	172.3	0	0	0	111.4	R139 T140 L146 S147 G173 E174	R139-L143 HydrophobicContact CG-CD1 4.15Å; R139-L143 WeakPolarHBondContact O-CG 3.48Å; R139-L143 PolarHBondContact O-N 2.7Å; R139-L143 VanDerWaalsContact O-N 3.14Å; T140-L143 PolarHBondContact O-N 2.76Å; L143-L146 PolarHBondContact O-N 3.47Å; L143-S147 WeakPolarHBondContact O-CB 3.39Å; L143-S147 PolarHBondContact O-N 2.92Å; L143-G173 VanDerWaalsContact CD1-C 3.45Å; L143-G173 WeakPolarHBondContact CD1-O 3.3Å; L143-E174 HydrophobicContact CD1-CG 4.14Å
144	S	95	Very high	94.6	Very high	39 Å²	39	41.7 Å²	41.7	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-44.7	176.1	-179.1	0	0	0	0	111.9	T140 E141 S147 K148	T140-S144 WeakPolarHBondContact O-CB 3.19Å; T140-S144 PolarHBondContact O-N 2.85Å; E141-S144 PolarHBondContact O-N 3.4Å; S144-S147 PolarHBondContact O-N 2.93Å; S144-S147 PolarHBondContact O-OG 3.28Å; S144-K148 WeakPolarHBondContact O-CG 3.4Å; S144-K148 PolarHBondContact O-N 2.88Å
145	T	96.2	Very high	94.7	Very high	23 Å²	23	40.8 Å²	40.8	14%	0.141	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-41.1	-179	-55.6	0	0	0	0	111.5	E141 L142 S147 K148 H149 V152 P309	E141-T145 WeakPolarHBondContact O-CB 3.17Å; E141-T145 PolarHBondContact O-N 2.87Å; E141-T145 PolarHBondContact O-OG1 3.38Å; L142-T145 PolarHBondContact O-N 3.48Å; T145-S147 VanDerWaalsContact C-N 3.3Å; T145-S147 PolarHBondContact O-N 2.99Å; T145-K148 PolarHBondContact O-N 3.41Å; T145-K148 VanDerWaalsContact O-N 3.15Å; T145-H149 PolarHBondContact O-N 3.34Å; T145-H149 PolarHBondContact O-ND1 3.49Å; T145-V152 HydrophobicContact CG2-CG1 4.22Å; T145-V152 HydrophobicContact CG2-CG2 3.83Å; T145-P309 HydrophobicContact CG2-CB 3.74Å; T145-P309 HydrophobicContact CG2-CG 3.48Å; T145-P309 VanDerWaalsContact CG2-CG 3.48Å
146	L	95.6	Very high	94.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-71	-24.4	177.5	-164.8	67.5	0	0	0	112.9	L142 L143 K148 H149 V152 L170 Y186 R288 V290	L142-L146 VanDerWaalsContact O-CB 3.29Å; L142-L146 WeakPolarHBondContact O-CB 3.48Å; L142-L146 PolarHBondContact O-N 2.87Å; L143-L146 PolarHBondContact O-N 3.47Å; L146-K148 VanDerWaalsContact C-N 3.29Å; L146-H149 CarbonylContact C-O 3.5Å; L146-V152 HydrophobicContact CB-CG2 4.2Å; L146-V152 HydrophobicContact CD1-CB 4.17Å; L146-V152 HydrophobicContact CD1-CG2 3.68Å; L146-L170 HydrophobicContact CD2-CD2 3.31Å; L146-Y186 HydrophobicContact CD2-CE2 4.02Å; L146-R288 HydrophobicContact CD1-CB 3.95Å; L146-R288 HydrophobicContact CD1-CG 4.46Å; L146-R288 HydrophobicContact CD2-CB 4.22Å; L146-R288 HydrophobicContact CG-CB 4.02Å; L146-R288 HydrophobicContact CG-CG 4.19Å; L146-R288 VanDerWaalsContact O-CD 3.26Å; L146-R288 WeakPolarHBondContact O-CD 3.43Å; L146-R288 PolarHBondContact O-NE 3.18Å; L146-V290 HydrophobicContact CD1-CG2 3.91Å; L146-V290 HydrophobicContact CD2-CG2 3.84Å
147	S	92.8	Very high	94.2	Very high	43 Å²	43	41 Å²	41	30%	0.301	21%	0.211	S	C	.	.	H	α-helix	trans	-66.5	-34.7	170.6	79	0	0	0	0	111.6	L143 S144 T145	L143-S147 WeakPolarHBondContact O-CB 3.39Å; L143-S147 PolarHBondContact O-N 2.92Å; S144-S147 PolarHBondContact O-N 2.93Å; S144-S147 PolarHBondContact O-OG 3.28Å; T145-S147 VanDerWaalsContact C-N 3.3Å; T145-S147 PolarHBondContact O-N 2.99Å
148	K	94.4	Very high	93.6	Very high	150 Å²	150	35.2 Å²	35.2	65%	0.652	18%	0.18	S	C	*	.	H	α-helix	trans	-89.9	-32.9	-176.3	-64.7	171.6	-174	173.5	0	113.9	S144 T145 L146	S144-K148 WeakPolarHBondContact O-CG 3.4Å; S144-K148 PolarHBondContact O-N 2.88Å; T145-K148 PolarHBondContact O-N 3.41Å; T145-K148 VanDerWaalsContact O-N 3.15Å; L146-K148 VanDerWaalsContact C-N 3.29Å
149	H	96.3	Very high	92.9	Very high	88 Å²	88	34.3 Å²	34.3	41%	0.407	18%	0.182	S	C	.	.			trans	-121.3	139	-176.1	-57.3	85.7	0	0	0	110.5	T145 L146 V151 V152 P309	T145-H149 PolarHBondContact O-N 3.34Å; T145-H149 PolarHBondContact O-ND1 3.49Å; L146-H149 CarbonylContact C-O 3.5Å; H149-V151 VanDerWaalsContact C-N 3.3Å; H149-V151 PolarHBondContact O-N 3.42Å; H149-V152 HydrophobicContact CB-CG2 4.4Å; H149-P309 HydrophobicContact CB-CG 3.96Å
150	Q	96.7	Very high	92.5	Very high	59 Å²	59	32.2 Å²	32.2	28%	0.276	17%	0.174	S	C	.	.	S	Bend	trans	-67.3	-31.9	177.2	-74.8	-177.5	-91.2	0	0	112.9	I281 R284 P285 R288 V289	Q150-I281 PolarHBondContact NE2-O 3.37Å; Q150-R284 PolarHBondContact NE2-O 2.65Å; Q150-R284 VanDerWaalsContact NE2-O 3.09Å; Q150-P285 VanDerWaalsContact NE2-CA 3.32Å; Q150-P285 PolarHBondContact NE2-O 3.42Å; Q150-R288 CarbonylContact O-C 3.57Å; Q150-R288 WeakPolarHBondContact O-CA 3.45Å; Q150-V289 PolarHBondContact O-N 3.3Å
151	V	97.9	Very high	92.2	Very high	8 Å²	8	27.8 Å²	27.8	5%	0.048	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	132.2	-177.2	-170.4	0	0	0	0	109.2	H149 I281 V289 L291 F305 C308	H149-V151 VanDerWaalsContact C-N 3.3Å; H149-V151 PolarHBondContact O-N 3.42Å; V151-I281 HydrophobicContact CG2-CD1 3.75Å; V151-I281 HydrophobicContact CG2-CG2 4.3Å; V151-V289 WeakPolarHBondContact CA-O 3.41Å; V151-V289 HydrophobicContact CG1-CB 4.29Å; V151-V289 HydrophobicContact CG1-CG1 4.34Å; V151-V289 HydrophobicContact CG2-CB 4.17Å; V151-L291 HydrophobicContact CG1-CD1 4.4Å; V151-L291 HydrophobicContact CG1-CG 4.41Å; V151-F305 HydrophobicContact CB-CB 4.46Å; V151-F305 HydrophobicContact CG1-CB 4.11Å; V151-F305 HydrophobicContact CG1-CD1 4.18Å; V151-F305 HydrophobicContact CG1-CD2 4.25Å; V151-F305 HydrophobicContact CG1-CG 3.94Å; V151-F305 HydrophobicContact CG2-CD1 3.95Å; V151-F305 HydrophobicContact CG2-CE1 4.49Å; V151-F305 HydrophobicContact CG2-CG 4.43Å; V151-C308 HydrophobicContact CB-CB 4.18Å; V151-C308 HydrophobicContact CG1-CB 4.39Å
152	V	97.9	Very high	92.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	137	175.1	-178.5	0	0	0	0	109.4	L142 T145 L146 H149 V289 V290 L291 P309 I311	L142-V152 HydrophobicContact CD1-CG1 4.32Å; T145-V152 HydrophobicContact CG2-CG1 4.22Å; T145-V152 HydrophobicContact CG2-CG2 3.83Å; L146-V152 HydrophobicContact CB-CG2 4.2Å; L146-V152 HydrophobicContact CD1-CB 4.17Å; L146-V152 HydrophobicContact CD1-CG2 3.68Å; H149-V152 HydrophobicContact CB-CG2 4.4Å; V152-V289 PolarHBondContact N-O 3.29Å; V152-V290 WeakPolarHBondContact O-CA 3.43Å; V152-L291 PolarHBondContact O-N 3.05Å; V152-P309 HydrophobicContact CG2-CG 4.12Å; V152-I311 HydrophobicContact CG1-CD1 3.77Å; V152-I311 HydrophobicContact CG1-CG1 4.12Å
153	I	97	Very high	91.9	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128	172.3	-63.7	164.6	0	0	0	108.8	A155 L291 V298 F301 A302 C308 P309 I310 I311	I153-A155 HydrophobicContact CG2-CB 4.47Å; I153-L291 CarbonylContact C-O 3.54Å; I153-L291 WeakPolarHBondContact CA-O 3.4Å; I153-L291 HydrophobicContact CG1-CB 4.05Å; I153-L291 HydrophobicContact CG1-CD1 4.01Å; I153-L291 HydrophobicContact CG1-CG 4.38Å; I153-V298 HydrophobicContact CG2-CB 4.4Å; I153-V298 HydrophobicContact CG2-CG1 4.35Å; I153-F301 HydrophobicContact CD1-CB 3.73Å; I153-A302 VanDerWaalsContact CD1-CA 3.47Å; I153-A302 HydrophobicContact CD1-CB 3.74Å; I153-A302 VanDerWaalsContact CD1-N 3.27Å; I153-C308 VanDerWaalsContact CD1-SG 3.56Å; I153-P309 PolarHBondContact N-O 3.34Å; I153-I310 HydrophobicContact CB-CG1 4.33Å; I153-I310 HydrophobicContact CB-CG2 4.46Å; I153-I310 HydrophobicContact CD1-CG1 4.27Å; I153-I310 HydrophobicContact CG2-CG2 4.27Å; I153-I311 PolarHBondContact O-N 3.35Å
154	V	95.7	Very high	91.7	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	108.9	170.6	-176.6	0	0	0	0	108.5	I135 L142 K162 V290 L291 M292 S293 V313	I135-V154 HydrophobicContact CD1-CG1 3.76Å; L142-V154 HydrophobicContact CD1-CG2 3.56Å; V154-K162 HydrophobicContact CG1-CD 4.07Å; V154-K162 HydrophobicContact CG1-CG 4.09Å; V154-V290 HydrophobicContact CG2-CG1 3.85Å; V154-L291 PolarHBondContact N-O 3.19Å; V154-M292 HydrophobicContact CB-CG 4.32Å; V154-M292 WeakPolarHBondContact O-CA 3.4Å; V154-S293 PolarHBondContact O-N 2.85Å; V154-V313 HydrophobicContact CG1-CG2 4.28Å
155	A	93	Very high	91.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.3	-176.4	0	0	0	0	0	110.2	I153 S293 V298 I310 I311 Q312 V313	I153-A155 HydrophobicContact CG2-CB 4.47Å; A155-S293 WeakPolarHBondContact CA-O 3.32Å; A155-V298 HydrophobicContact CB-CB 4.47Å; A155-V298 HydrophobicContact CB-CG1 3.54Å; A155-I310 HydrophobicContact CB-CG2 4.24Å; A155-I311 PolarHBondContact N-O 3.14Å; A155-Q312 CarbonylContact O-C 3.5Å; A155-Q312 WeakPolarHBondContact O-CA 3.22Å; A155-V313 PolarHBondContact O-N 3.28Å
156	G	88.9	Confident	91.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179	160.4	174.8	0	0	0	0	0	111.9	K162 S293 A294 V313	G156-K162 WeakPolarHBondContact O-CE 3.43Å; G156-K162 PolarHBondContact O-NZ 2.97Å; G156-S293 PolarHBondContact N-O 3.03Å; G156-A294 CarbonylContact C-O 3.57Å; G156-A294 VanDerWaalsContact C-O 3.32Å; G156-A294 CarbonylContact O-C 3.52Å; G156-A294 VanDerWaalsContact O-C 3.26Å; G156-A294 WeakPolarHBondContact O-CA 3.33Å; G156-V313 WeakPolarHBondContact CA-O 3.46Å
157	D	82.4	Confident	91.8	Very high	32 Å²	32	22.7 Å²	22.7	17%	0.171	12%	0.122	C	C	.	.			trans	-60.3	165.7	-173.8	-82.4	2.7	0	0	0	113.5	G159 C160 K162 R316	D157-G159 PolarHBondContact O-N 2.99Å; D157-C160 PolarHBondContact O-N 2.94Å; D157-C160 PolarHBondContact O-SG 3.42Å; D157-K162 PolarHBondContact O-NZ 3.19Å; D157-K162 VanDerWaalsContact O-NZ 3.09Å; D157-R316 HydrophobicContact CB-CG 4.18Å; D157-R316 IonicContact OD2-CZ 3.22Å; D157-R316 VanDerWaalsContact OD2-CZ 3.25Å; D157-R316 IonicContact OD2-NE 2.87Å; D157-R316 PolarHBondContact OD2-NE 3.36Å; D157-R316 IonicContact OD2-NH2 3.16Å; D157-R316 PolarHBondContact OD2-NH2 2.92Å
158	T	79.9	Confident	91.9	Very high	13 Å²	13	20.8 Å²	20.8	8%	0.08	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	137.1	169.4	47.8	0	0	0	0	111	G472	T158-G472 WeakPolarHBondContact CB-O 3.29Å; T158-G472 VanDerWaalsContact OG1-C 3.24Å; T158-G472 VanDerWaalsContact OG1-CA 3.22Å; T158-G472 WeakPolarHBondContact OG1-CA 3.39Å; T158-G472 PolarHBondContact OG1-O 3.35Å
159	G	77.9	Confident	91.9	Very high	21 Å²	21	14.3 Å²	14.3	22%	0.216	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-4	178.8	0	0	0	0	0	115.5	D157 G161	D157-G159 PolarHBondContact O-N 2.99Å; G159-G161 PolarHBondContact O-N 3.48Å
160	C	85.7	Confident	91.9	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.06	C	C	.	.	S	Bend	trans	-73.3	-10.1	176.5	70.2	0	0	0	0	114.4	P134 I135 D157 K162 V313	P134-C160 HydrophobicContact CB-CB 4.06Å; P134-C160 HydrophobicContact CG-CB 4.09Å; I135-C160 WeakPolarHBondContact CB-O 3.46Å; I135-C160 WeakPolarHBondContact CG2-O 3.36Å; I135-C160 PolarHBondContact N-O 3.46Å; D157-C160 PolarHBondContact O-N 2.94Å; D157-C160 PolarHBondContact O-SG 3.42Å; C160-K162 VanDerWaalsContact SG-CG 3.59Å; C160-K162 PolarHBondContact SG-NZ 3.19Å; C160-K162 VanDerWaalsContact SG-NZ 3.42Å; C160-V313 HydrophobicContact CB-CG1 4.22Å
161	G	87.8	Confident	91.9	Very high	10 Å²	10	7.9 Å²	7.9	10%	0.103	5%	0.05	C	C	.	.	S	Bend	trans	104.4	5.2	172.3	0	0	0	0	0	117	G159 S163 T164 Q165	G159-G161 PolarHBondContact O-N 3.48Å; G161-S163 PolarHBondContact O-N 3.45Å; G161-T164 PolarHBondContact O-N 3.26Å; G161-T164 PolarHBondContact O-OG1 3.14Å; G161-Q165 WeakPolarHBondContact O-CB 3.3Å; G161-Q165 WeakPolarHBondContact O-CG 3.43Å; G161-Q165 PolarHBondContact O-N 3.49Å
162	K	91.4	Very high	91.7	Very high	14 Å²	14	7.9 Å²	7.9	6%	0.061	5%	0.049	C	C	.	.	H	α-helix	trans	-49.1	-63.6	-176.1	-64.4	179.2	-50.6	-66.3	0	114.1	V154 G156 D157 C160 T164 Q165 V166 M292 S293	V154-K162 HydrophobicContact CG1-CD 4.07Å; V154-K162 HydrophobicContact CG1-CG 4.09Å; G156-K162 WeakPolarHBondContact O-CE 3.43Å; G156-K162 PolarHBondContact O-NZ 2.97Å; D157-K162 PolarHBondContact O-NZ 3.19Å; D157-K162 VanDerWaalsContact O-NZ 3.09Å; C160-K162 VanDerWaalsContact SG-CG 3.59Å; C160-K162 PolarHBondContact SG-NZ 3.19Å; C160-K162 VanDerWaalsContact SG-NZ 3.42Å; K162-T164 PolarHBondContact O-N 3.19Å; K162-T164 VanDerWaalsContact O-N 3.09Å; K162-Q165 PolarHBondContact O-N 2.65Å; K162-V166 VanDerWaalsContact O-CB 3.28Å; K162-V166 WeakPolarHBondContact O-CB 3.39Å; K162-V166 WeakPolarHBondContact O-CG2 3.06Å; K162-V166 PolarHBondContact O-N 2.69Å; K162-M292 HydrophobicContact CB-SD 3.92Å; K162-S293 VanDerWaalsContact CE-O 3.27Å; K162-S293 WeakPolarHBondContact CE-O 3.32Å
163	S	92.3	Very high	91.4	Very high	18 Å²	18	7.9 Å²	7.9	13%	0.126	5%	0.049	C	C	.	.	H	α-helix	trans	-62.9	-20.1	-173.1	-44.2	0	0	0	0	114.4	G161 D261	G161-S163 PolarHBondContact O-N 3.45Å; S163-D261 WeakPolarHBondContact CB-OD2 3.47Å; S163-D261 PolarHBondContact OG-OD2 2.72Å
164	T	92.1	Very high	90.8	Very high	16 Å²	16	12.1 Å²	12.1	10%	0.098	7%	0.069	C	C	.	.	H	α-helix	trans	-98.7	-45.8	177.9	52.8	0	0	0	0	112.2	G161 K162 Q168 L202 R205 V206	G161-T164 PolarHBondContact O-N 3.26Å; G161-T164 PolarHBondContact O-OG1 3.14Å; K162-T164 PolarHBondContact O-N 3.19Å; K162-T164 VanDerWaalsContact O-N 3.09Å; T164-Q168 WeakPolarHBondContact O-CG 3.33Å; T164-Q168 PolarHBondContact O-NE2 2.92Å; T164-L202 HydrophobicContact CG2-CD2 4.05Å; T164-R205 HydrophobicContact CG2-CG 3.88Å; T164-V206 HydrophobicContact CG2-CG2 4.41Å
165	Q	94.2	Very high	90.1	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.009	7%	0.074	C	C	.	.	H	α-helix	trans	-87.1	-37.3	-171.5	-55.2	-41.8	-69.4	0	0	113.5	L133 I135 G161 K162 Q168 Y169 E209	L133-Q165 HydrophobicContact CD1-CG 3.62Å; I135-Q165 HydrophobicContact CG2-CB 3.8Å; I135-Q165 HydrophobicContact CG2-CG 3.77Å; G161-Q165 WeakPolarHBondContact O-CB 3.3Å; G161-Q165 WeakPolarHBondContact O-CG 3.43Å; G161-Q165 PolarHBondContact O-N 3.49Å; K162-Q165 PolarHBondContact O-N 2.65Å; Q165-Q168 CarbonylContact O-C 3.48Å; Q165-Q168 WeakPolarHBondContact O-CA 3.32Å; Q165-Q168 WeakPolarHBondContact O-CB 3.48Å; Q165-Q168 PolarHBondContact O-N 2.94Å; Q165-Y169 HydrophobicContact CB-CD2 4.45Å; Q165-Y169 HydrophobicContact CB-CE1 3.93Å; Q165-Y169 HydrophobicContact CB-CE2 3.82Å; Q165-Y169 WeakPolarHBondContact O-CD1 3.11Å; Q165-Y169 VanDerWaalsContact O-CG 3.28Å; Q165-Y169 PolarHBondContact O-N 3.29Å; Q165-E209 PolarHBondContact NE2-OE2 2.79Å
166	V	96.1	Very high	88.9	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.3	-48.1	-177.7	169	0	0	0	0	111.9	I135 L142 K162 Q168 Y169 L170 V290 M292	I135-V166 HydrophobicContact CD1-CG2 4.28Å; I135-V166 HydrophobicContact CG1-CG2 4.22Å; L142-V166 HydrophobicContact CD2-CB 4.48Å; L142-V166 HydrophobicContact CD2-CG1 4.09Å; L142-V166 HydrophobicContact CD2-CG2 4.01Å; K162-V166 VanDerWaalsContact O-CB 3.28Å; K162-V166 WeakPolarHBondContact O-CB 3.39Å; K162-V166 WeakPolarHBondContact O-CG2 3.06Å; K162-V166 PolarHBondContact O-N 2.69Å; V166-Q168 PolarHBondContact O-N 3.06Å; V166-Y169 PolarHBondContact O-N 3.18Å; V166-Y169 VanDerWaalsContact O-N 3.12Å; V166-L170 HydrophobicContact CG1-CD1 4.04Å; V166-L170 HydrophobicContact CG1-CG 4.37Å; V166-L170 VanDerWaalsContact O-CG 3.32Å; V166-L170 WeakPolarHBondContact O-CG 3.34Å; V166-L170 PolarHBondContact O-N 2.76Å; V166-V290 HydrophobicContact CG1-CG1 4.25Å; V166-M292 HydrophobicContact CB-SD 3.67Å; V166-M292 HydrophobicContact CG1-SD 3.77Å; V166-M292 HydrophobicContact CG2-SD 3.79Å
167	P	96.6	Very high	87.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.7	-34.1	175.4	-25.1	35.7	0	0	0	113.5	Y171 V191 I234 F236	P167-Y171 WeakPolarHBondContact O-CB 3.47Å; P167-Y171 PolarHBondContact O-N 2.82Å; P167-Y171 VanDerWaalsContact O-N 3.15Å; P167-V191 HydrophobicContact CB-CG2 4.08Å; P167-V191 HydrophobicContact CG-CG1 4.48Å; P167-V191 HydrophobicContact CG-CG2 3.87Å; P167-I234 HydrophobicContact CB-CD1 4.25Å; P167-I234 HydrophobicContact CB-CG2 3.96Å; P167-I234 WeakPolarHBondContact O-CD1 3.17Å; P167-F236 HydrophobicContact CG-CZ 4.18Å
168	Q	95.2	Very high	87.1	Confident	3 Å²	3	26.6 Å²	26.6	1%	0.014	15%	0.147	C	C	.	.	H	α-helix	trans	-70.6	-41.6	176.8	-64.2	178.3	66.9	0	0	111.3	T164 Q165 V166 L170 Y171 Y172 V206 E209 M210	T164-Q168 WeakPolarHBondContact O-CG 3.33Å; T164-Q168 PolarHBondContact O-NE2 2.92Å; Q165-Q168 CarbonylContact O-C 3.48Å; Q165-Q168 WeakPolarHBondContact O-CA 3.32Å; Q165-Q168 WeakPolarHBondContact O-CB 3.48Å; Q165-Q168 PolarHBondContact O-N 2.94Å; V166-Q168 PolarHBondContact O-N 3.06Å; Q168-L170 VanDerWaalsContact C-N 3.35Å; Q168-Y171 PolarHBondContact O-N 3Å; Q168-Y172 HydrophobicContact CB-CD2 4.35Å; Q168-Y172 HydrophobicContact CB-CE2 4.45Å; Q168-Y172 WeakPolarHBondContact O-CD2 3.3Å; Q168-Y172 PolarHBondContact O-N 2.95Å; Q168-V206 HydrophobicContact CG-CG1 3.83Å; Q168-E209 PolarHBondContact NE2-OE2 3.37Å; Q168-M210 HydrophobicContact CG-CG 3.83Å; Q168-M210 HydrophobicContact CG-SD 4.07Å
169	Y	95.5	Very high	86.7	Confident	14 Å²	14	30.5 Å²	30.5	6%	0.055	17%	0.167	C	C	.	.	H	α-helix	trans	-62.8	-43.3	177.8	-60.5	-15.8	0	0	0	111.2	I135 A136 R139 L142 Q165 V166 Y171 Y172 G173	I135-Y169 HydrophobicContact CG1-CE2 4.11Å; I135-Y169 HydrophobicContact CG2-CE2 4.38Å; A136-Y169 WeakPolarHBondContact CA-OH 3.32Å; R139-Y169 HydrophobicContact CB-CD2 3.97Å; R139-Y169 HydrophobicContact CB-CE2 3.84Å; R139-Y169 HydrophobicContact CB-CG 4.39Å; R139-Y169 HydrophobicContact CG-CD1 4.03Å; R139-Y169 HydrophobicContact CG-CD2 3.89Å; R139-Y169 HydrophobicContact CG-CE1 4.33Å; R139-Y169 HydrophobicContact CG-CE2 4.17Å; R139-Y169 HydrophobicContact CG-CG 3.81Å; L142-Y169 HydrophobicContact CD2-CD2 4.35Å; Q165-Y169 HydrophobicContact CB-CD2 4.45Å; Q165-Y169 HydrophobicContact CB-CE1 3.93Å; Q165-Y169 HydrophobicContact CB-CE2 3.82Å; Q165-Y169 WeakPolarHBondContact O-CD1 3.11Å; Q165-Y169 VanDerWaalsContact O-CG 3.28Å; Q165-Y169 PolarHBondContact O-N 3.29Å; V166-Y169 PolarHBondContact O-N 3.18Å; V166-Y169 VanDerWaalsContact O-N 3.12Å; Y169-Y171 VanDerWaalsContact C-N 3.32Å; Y169-Y171 PolarHBondContact O-N 3.35Å; Y169-Y172 PolarHBondContact O-N 3.46Å; Y169-G173 WeakPolarHBondContact O-CA 3.21Å; Y169-G173 PolarHBondContact O-N 3.35Å
170	L	96.8	Very high	86.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.9	-41.9	174.6	-64.4	171.6	0	0	0	111.8	L146 V166 Q168 S185 Y186 I189 V257 V259 V290	L146-L170 HydrophobicContact CD2-CD2 3.31Å; V166-L170 HydrophobicContact CG1-CD1 4.04Å; V166-L170 HydrophobicContact CG1-CG 4.37Å; V166-L170 VanDerWaalsContact O-CG 3.32Å; V166-L170 WeakPolarHBondContact O-CG 3.34Å; V166-L170 PolarHBondContact O-N 2.76Å; Q168-L170 VanDerWaalsContact C-N 3.35Å; L170-S185 WeakPolarHBondContact O-CA 3.48Å; L170-Y186 HydrophobicContact CB-CD2 4.12Å; L170-Y186 HydrophobicContact CD2-CD2 4.06Å; L170-Y186 HydrophobicContact CD2-CE2 4.01Å; L170-Y186 WeakPolarHBondContact O-CD2 3.44Å; L170-Y186 PolarHBondContact O-N 2.9Å; L170-I189 HydrophobicContact CB-CD1 3.71Å; L170-I189 HydrophobicContact CB-CG1 4.38Å; L170-I189 HydrophobicContact CD1-CG2 4.28Å; L170-V257 HydrophobicContact CD1-CG1 3.98Å; L170-V259 HydrophobicContact CD1-CG2 3.53Å; L170-V290 HydrophobicContact CD1-CG2 4.43Å; L170-V290 HydrophobicContact CD2-CG2 4.46Å
171	Y	95.5	Very high	86.6	Confident	12 Å²	12	36 Å²	36	5%	0.047	20%	0.197	C	C	.	.	H	α-helix	trans	-71.2	-40.7	180	175.7	-100.4	0	0	0	113.4	P167 Q168 Y169 P181 S185 M210 R233 I234	P167-Y171 WeakPolarHBondContact O-CB 3.47Å; P167-Y171 PolarHBondContact O-N 2.82Å; P167-Y171 VanDerWaalsContact O-N 3.15Å; Q168-Y171 PolarHBondContact O-N 3Å; Y169-Y171 VanDerWaalsContact C-N 3.32Å; Y169-Y171 PolarHBondContact O-N 3.35Å; Y171-P181 HydrophobicContact CE1-CG 4.25Å; Y171-P181 HydrophobicContact CE2-CG 4.39Å; Y171-S185 VanDerWaalsContact O-CB 3.29Å; Y171-S185 WeakPolarHBondContact O-CB 3.39Å; Y171-M210 HydrophobicContact CD1-CE 3.37Å; Y171-M210 HydrophobicContact CE1-CE 3.68Å; Y171-M210 HydrophobicContact CG-CE 4.12Å; Y171-R233 HydrophobicContact CD2-CB 3.87Å; Y171-R233 HydrophobicContact CE2-CB 3.61Å; Y171-R233 HydrophobicContact CE2-CG 3.81Å; Y171-I234 HydrophobicContact CG-CD1 4.37Å
172	Y	93.7	Very high	86.5	Confident	9 Å²	9	36.4 Å²	36.4	4%	0.035	20%	0.202	C	C	.	.	H	α-helix	trans	-85	-21.3	-178.2	-70.7	-61.4	0	0	0	113.6	Q168 Y169 S175 N178 G182 M210	Q168-Y172 HydrophobicContact CB-CD2 4.35Å; Q168-Y172 HydrophobicContact CB-CE2 4.45Å; Q168-Y172 WeakPolarHBondContact O-CD2 3.3Å; Q168-Y172 PolarHBondContact O-N 2.95Å; Y169-Y172 PolarHBondContact O-N 3.46Å; Y172-S175 WeakPolarHBondContact O-CB 3.34Å; Y172-S175 PolarHBondContact O-N 3.05Å; Y172-N178 HydrophobicContact CD2-CB 4.2Å; Y172-N178 VanDerWaalsContact CE1-C 3.41Å; Y172-N178 WeakPolarHBondContact CE1-O 3.44Å; Y172-N178 HydrophobicContact CE2-CB 4.16Å; Y172-N178 HydrophobicContact CG-CB 4.48Å; Y172-N178 PolarHBondContact OH-O 2.83Å; Y172-G182 PolarHBondContact O-N 2.89Å; Y172-M210 HydrophobicContact CE2-CE 3.76Å; Y172-M210 HydrophobicContact CE2-CG 4.43Å; Y172-M210 VanDerWaalsContact OH-CE 3.32Å; Y172-M210 WeakPolarHBondContact OH-CE 3.41Å
173	G	92	Very high	86.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	-144.2	-174.2	0	0	0	0	0	112.1	R139 L143 Y169 S175 P183	R139-G173 PolarHBondContact NH2-O 2.84Å; L143-G173 VanDerWaalsContact CD1-C 3.45Å; L143-G173 WeakPolarHBondContact CD1-O 3.3Å; Y169-G173 WeakPolarHBondContact O-CA 3.21Å; Y169-G173 PolarHBondContact O-N 3.35Å; G173-S175 PolarHBondContact O-N 2.9Å; G173-S175 VanDerWaalsContact O-N 3.14Å; G173-P183 WeakPolarHBondContact CA-O 3.3Å
174	E	84.9	Confident	85.8	Confident	90 Å²	90	42.2 Å²	42.2	42%	0.421	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	32.1	-179.8	-66.6	174	-161	0	0	113.3	L143 P183 N184	L143-E174 HydrophobicContact CD1-CG 4.14Å; E174-P183 PolarHBondContact N-O 3.34Å; E174-N184 PolarHBondContact OE1-ND2 2.99Å
175	S	79.7	Confident	85.8	Confident	17 Å²	17	43.1 Å²	43.1	12%	0.119	24%	0.244	C	C	.	.			trans	-78.8	129.3	173.9	-173.5	0	0	0	0	112.2	R139 Y172 G173 L177 T180	R139-S175 PolarHBondContact NH2-O 3.01Å; Y172-S175 WeakPolarHBondContact O-CB 3.34Å; Y172-S175 PolarHBondContact O-N 3.05Å; G173-S175 PolarHBondContact O-N 2.9Å; G173-S175 VanDerWaalsContact O-N 3.14Å; S175-L177 VanDerWaalsContact C-N 3.31Å; S175-L177 PolarHBondContact OG-N 3.3Å; S175-L177 PolarHBondContact OG-O 2.73Å; S175-T180 VanDerWaalsContact CB-O 3.26Å; S175-T180 WeakPolarHBondContact CB-O 3.44Å; S175-T180 PolarHBondContact OG-O 3.11Å
176	N	68.8	Low	85.9	Confident	170 Å²	170	44.5 Å²	44.5	91%	0.909	25%	0.249	S	C	*	.	S	Bend	trans	-67.5	-31.3	171.9	-71.3	-24.4	0	0	0	112.4
177	L	65.3	Low	85.7	Confident	112 Å²	112	47.9 Å²	47.9	59%	0.586	27%	0.265	S	S	*	.	S	Bend	trans	-103.1	111.3	176.3	-133.3	76.8	0	0	0	107.4	S175 D179	S175-L177 VanDerWaalsContact C-N 3.31Å; S175-L177 PolarHBondContact OG-N 3.3Å; S175-L177 PolarHBondContact OG-O 2.73Å; L177-D179 HydrophobicContact CD2-CB 4.35Å; L177-D179 WeakPolarHBondContact CD2-OD2 3.38Å; L177-D179 PolarHBondContact O-N 2.89Å
178	N	67.6	Low	85.7	Confident	37 Å²	37	50.6 Å²	50.6	20%	0.198	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	39.7	176.6	-69.7	-15.3	0	0	0	112.8	R139 Y172	R139-N178 PolarHBondContact NH1-OD1 3.05Å; R139-N178 PolarHBondContact NH2-OD1 2.77Å; Y172-N178 HydrophobicContact CD2-CB 4.2Å; Y172-N178 VanDerWaalsContact CE1-C 3.41Å; Y172-N178 WeakPolarHBondContact CE1-O 3.44Å; Y172-N178 HydrophobicContact CE2-CB 4.16Å; Y172-N178 HydrophobicContact CG-CB 4.48Å; Y172-N178 PolarHBondContact OH-O 2.83Å
179	D	70.8	Confident	85.8	Confident	95 Å²	95	50.5 Å²	50.5	51%	0.508	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-33.9	-178.4	-66.3	-26	0	0	0	111.2	L177	L177-D179 HydrophobicContact CD2-CB 4.35Å; L177-D179 WeakPolarHBondContact CD2-OD2 3.38Å; L177-D179 PolarHBondContact O-N 2.89Å
180	T	77.3	Confident	85.9	Confident	87 Å²	87	49.8 Å²	49.8	53%	0.534	28%	0.276	S	S	.	.	S	Bend	trans	-127.4	142	178.6	51.8	0	0	0	0	111.6	S175 G182	S175-T180 VanDerWaalsContact CB-O 3.26Å; S175-T180 WeakPolarHBondContact CB-O 3.44Å; S175-T180 PolarHBondContact OG-O 3.11Å; T180-G182 PolarHBondContact O-N 3.26Å
181	P	84.8	Confident	86	Confident	49 Å²	49	49.8 Å²	49.8	32%	0.318	28%	0.276	S	S	.	.			trans	-59.9	133.9	172.2	-21.4	33.4	0	0	0	111.6	Y171 S185	Y171-P181 HydrophobicContact CE1-CG 4.25Å; Y171-P181 HydrophobicContact CE2-CG 4.39Å; P181-S185 WeakPolarHBondContact CB-OG 3.16Å
182	G	86.5	Confident	86.1	Confident	19 Å²	19	49.2 Å²	49.2	20%	0.196	27%	0.274	C	S	.	.			trans	-105.3	-162.8	176.8	0	0	0	0	0	113.2	Y172 T180 S185	Y172-G182 PolarHBondContact O-N 2.89Å; T180-G182 PolarHBondContact O-N 3.26Å; G182-S185 VanDerWaalsContact O-CB 3.24Å; G182-S185 WeakPolarHBondContact O-CB 3.39Å; G182-S185 PolarHBondContact O-N 2.99Å; G182-S185 PolarHBondContact O-OG 3.21Å
183	P	84.1	Confident	86.2	Confident	84 Å²	84	48.8 Å²	48.8	55%	0.545	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	150.8	170.3	-20.2	32.1	0	0	0	111.4	G173 E174 S185	G173-P183 WeakPolarHBondContact CA-O 3.3Å; E174-P183 PolarHBondContact N-O 3.34Å; P183-S185 PolarHBondContact O-N 2.9Å; P183-S185 VanDerWaalsContact O-N 3.16Å
184	N	85.4	Confident	86.1	Confident	71 Å²	71	50 Å²	50	38%	0.38	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	27.8	-178.5	-60.5	-29.3	0	0	0	114.2	E174	E174-N184 PolarHBondContact OE1-ND2 2.99Å
185	S	91.8	Very high	86.1	Confident	35 Å²	35	47.6 Å²	47.6	25%	0.245	27%	0.267	C	S	.	.			trans	-89	151.5	172.4	59.7	0	0	0	0	112.3	L170 Y171 P181 G182 P183	L170-S185 WeakPolarHBondContact O-CA 3.48Å; Y171-S185 VanDerWaalsContact O-CB 3.29Å; Y171-S185 WeakPolarHBondContact O-CB 3.39Å; P181-S185 WeakPolarHBondContact CB-OG 3.16Å; G182-S185 VanDerWaalsContact O-CB 3.24Å; G182-S185 WeakPolarHBondContact O-CB 3.39Å; G182-S185 PolarHBondContact O-N 2.99Å; G182-S185 PolarHBondContact O-OG 3.21Å; P183-S185 PolarHBondContact O-N 2.9Å; P183-S185 VanDerWaalsContact O-N 3.16Å
186	Y	94.9	Very high	86.5	Confident	30 Å²	30	50.4 Å²	50.4	12%	0.118	28%	0.275	C	S	.	.			trans	-117.6	140.9	178.7	-57.1	-83.1	0	0	0	111	L146 L170 D256 V257 R288	L146-Y186 HydrophobicContact CD2-CE2 4.02Å; L170-Y186 HydrophobicContact CB-CD2 4.12Å; L170-Y186 HydrophobicContact CD2-CD2 4.06Å; L170-Y186 HydrophobicContact CD2-CE2 4.01Å; L170-Y186 WeakPolarHBondContact O-CD2 3.44Å; L170-Y186 PolarHBondContact O-N 2.9Å; Y186-D256 HydrophobicContact CD1-CB 3.92Å; Y186-V257 HydrophobicContact CD1-CG2 3.2Å; Y186-V257 HydrophobicContact CD2-CG2 3.53Å; Y186-V257 HydrophobicContact CE1-CG2 3.67Å; Y186-V257 HydrophobicContact CE2-CG2 3.99Å; Y186-V257 HydrophobicContact CG-CG2 3.11Å; Y186-R288 HydrophobicContact CE1-CB 4.46Å; Y186-R288 HydrophobicContact CE1-CG 3.9Å
187	Q	92	Very high	87.1	Confident	71 Å²	71	43.8 Å²	43.8	33%	0.332	24%	0.239	S	C	.	.	S	Bend	trans	-96.6	-36	-173.5	-63.9	-57.2	-46.3	0	0	112.1	R233 D256	Q187-R233 CarbonylContact O-C 3.55Å; Q187-R233 WeakPolarHBondContact O-CA 3.06Å; Q187-R233 WeakPolarHBondContact O-CB 3.32Å; Q187-R233 WeakPolarHBondContact O-CD 3.4Å; Q187-R233 VanDerWaalsContact O-O 3.09Å; Q187-D256 PolarHBondContact N-OD2 3.11Å
188	N	96.2	Very high	88.2	Confident	57 Å²	57	38.4 Å²	38.4	31%	0.305	21%	0.211	S	C	.	.			trans	-119.7	96.2	-177.8	-57.5	-43.4	0	0	0	110.8	D254 D256 V257	N188-D254 WeakPolarHBondContact CB-O 3.44Å; N188-D254 PolarHBondContact ND2-O 3.12Å; N188-D256 PolarHBondContact N-OD2 3.29Å; N188-D256 PolarHBondContact O-N 2.8Å; N188-V257 PolarHBondContact O-N 3.12Å
189	I	98.3	Very high	89.3	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.7	-175.7	-58.4	157.5	0	0	0	109	L170 V191 R233 I234 L235 V257 V259	L170-I189 HydrophobicContact CB-CD1 3.71Å; L170-I189 HydrophobicContact CB-CG1 4.38Å; L170-I189 HydrophobicContact CD1-CG2 4.28Å; I189-V191 HydrophobicContact CG2-CG2 3.97Å; I189-R233 PolarHBondContact N-O 3.04Å; I189-I234 HydrophobicContact CD1-CG1 4.13Å; I189-L235 PolarHBondContact O-N 3.4Å; I189-V257 HydrophobicContact CG1-CB 4.43Å; I189-V259 HydrophobicContact CG2-CG2 4.14Å
190	A	98.3	Very high	90.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130	167.9	0	0	0	0	0	109.7	L237 Y255 V257 I258 V259	A190-L237 HydrophobicContact CB-CD2 4Å; A190-Y255 HydrophobicContact CB-CD1 3.6Å; A190-Y255 HydrophobicContact CB-CD2 4.27Å; A190-Y255 HydrophobicContact CB-CE1 3.72Å; A190-Y255 HydrophobicContact CB-CE2 4.38Å; A190-Y255 HydrophobicContact CB-CG 3.89Å; A190-V257 PolarHBondContact N-O 3.19Å; A190-I258 HydrophobicContact CB-CG1 4.47Å; A190-V259 PolarHBondContact O-N 3.17Å
191	V	98.3	Very high	90.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	109.3	173.7	-172.1	0	0	0	0	108.5	P167 I189 I234 L235 F236 L237 V259	P167-V191 HydrophobicContact CB-CG2 4.08Å; P167-V191 HydrophobicContact CG-CG1 4.48Å; P167-V191 HydrophobicContact CG-CG2 3.87Å; I189-V191 HydrophobicContact CG2-CG2 3.97Å; V191-I234 HydrophobicContact CG2-CG2 4.15Å; V191-L235 PolarHBondContact N-O 3.17Å; V191-F236 HydrophobicContact CB-CD1 3.81Å; V191-F236 HydrophobicContact CB-CE1 3.9Å; V191-F236 HydrophobicContact CB-CG 4.3Å; V191-F236 HydrophobicContact CB-CZ 4.44Å; V191-F236 HydrophobicContact CG1-CD1 3.79Å; V191-F236 HydrophobicContact CG1-CE1 3.6Å; V191-F236 HydrophobicContact CG1-CZ 4.4Å; V191-F236 HydrophobicContact CG2-CE1 4.34Å; V191-F236 HydrophobicContact CG2-CZ 4.42Å; V191-F236 CarbonylContact O-C 3.53Å; V191-F236 VanDerWaalsContact O-CA 3.29Å; V191-F236 WeakPolarHBondContact O-CA 3.46Å; V191-L237 PolarHBondContact O-N 3.04Å; V191-V259 CarbonylContact C-O 3.54Å; V191-V259 WeakPolarHBondContact CA-O 3.3Å; V191-V259 HydrophobicContact CB-CB 4.37Å; V191-V259 HydrophobicContact CG1-CB 4.17Å; V191-V259 HydrophobicContact CG1-CG1 4.19Å; V191-V259 HydrophobicContact CG2-CB 4.14Å; V191-V259 HydrophobicContact CG2-CG2 4.29Å
192	T	97.5	Very high	90.7	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	146.2	177.7	65.8	0	0	0	0	111	L237 L242 V259 L260 D261 L273	T192-L237 CarbonylContact C-O 3.26Å; T192-L237 VanDerWaalsContact CA-O 3.23Å; T192-L237 WeakPolarHBondContact CA-O 3.25Å; T192-L237 HydrophobicContact CG2-CD2 4.45Å; T192-L242 HydrophobicContact CG2-CB 4.22Å; T192-L242 HydrophobicContact CG2-CD2 3.47Å; T192-L242 VanDerWaalsContact CG2-CD2 3.47Å; T192-L242 HydrophobicContact CG2-CG 4.47Å; T192-V259 PolarHBondContact N-O 3.1Å; T192-V259 PolarHBondContact OG1-O 2.98Å; T192-L260 HydrophobicContact CG2-CD2 3.79Å; T192-L260 WeakPolarHBondContact OG1-CA 3.3Å; T192-L260 VanDerWaalsContact OG1-CD2 3.28Å; T192-L260 WeakPolarHBondContact OG1-CD2 3.49Å; T192-D261 WeakPolarHBondContact O-CB 3.34Å; T192-L273 HydrophobicContact CG2-CD1 4.5Å
193	Q	95.1	Very high	90.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142	170.8	-68.6	-67.7	-39.6	0	0	108.8	R195 A198 C199 L202 F236 L237 T238 D261 S428	Q193-R195 VanDerWaalsContact C-N 3.33Å; Q193-R195 PolarHBondContact O-N 3Å; Q193-A198 HydrophobicContact CB-CB 4.35Å; Q193-C199 HydrophobicContact CB-CB 4.12Å; Q193-L202 HydrophobicContact CG-CD1 4.01Å; Q193-F236 HydrophobicContact CG-CD1 4.24Å; Q193-L237 PolarHBondContact N-O 2.77Å; Q193-T238 WeakPolarHBondContact O-CA 3.44Å; Q193-D261 PolarHBondContact NE2-OD2 2.97Å; Q193-S428 PolarHBondContact OE1-OG 2.78Å
194	P	89.5	Confident	91	Very high	24 Å²	24	25.3 Å²	25.3	16%	0.156	13%	0.131	C	C	.	.	S	Bend	trans	-68.8	-35.4	-179.1	23.3	-32.2	0	0	0	112	E239 E262 H267	P194-E239 WeakPolarHBondContact CA-OE1 3.44Å; P194-E239 WeakPolarHBondContact CB-OE1 3.3Å; P194-E262 HydrophobicContact CG-CB 4.48Å; P194-H267 WeakPolarHBondContact CB-CD2 3.38Å; P194-H267 WeakPolarHBondContact CB-NE2 3.44Å
195	R	86.8	Confident	91.1	Very high	41 Å²	41	25.8 Å²	25.8	16%	0.155	13%	0.127	C	C	.	.	S	Bend	trans	-108.1	140.2	-173.6	-58	-170.6	-175.6	92.2	13.1	112.5	Q193 I197 A198 C199 E265 T427	Q193-R195 VanDerWaalsContact C-N 3.33Å; Q193-R195 PolarHBondContact O-N 3Å; R195-I197 HydrophobicContact CB-CG2 4.22Å; R195-I197 PolarHBondContact O-N 3.07Å; R195-A198 HydrophobicContact CB-CB 4.12Å; R195-A198 WeakPolarHBondContact O-CB 3.49Å; R195-A198 PolarHBondContact O-N 2.98Å; R195-C199 PolarHBondContact O-N 2.92Å; R195-E265 IonicContact CZ-OE2 3.37Å; R195-E265 IonicContact NH1-OE2 2.79Å; R195-E265 IonicContact NH2-OE2 3.86Å; R195-E265 PolarHBondContact NH2-OE2 3.1Å; R195-T427 PolarHBondContact NH1-OG1 3.17Å
196	R	86.8	Confident	91.1	Very high	76 Å²	76	24.1 Å²	24.1	29%	0.287	12%	0.116	S	C	.	.	H	α-helix	trans	-55.4	-46.7	173.2	170.1	168.5	174	-156.3	-0.7	112.6	A198 C199 I200 V222 E225	R196-A198 VanDerWaalsContact C-N 3.33Å; R196-A198 PolarHBondContact O-N 2.86Å; R196-C199 WeakPolarHBondContact O-CB 3.29Å; R196-C199 PolarHBondContact O-N 3.31Å; R196-I200 HydrophobicContact CG-CD1 3.86Å; R196-I200 WeakPolarHBondContact O-CG1 3.37Å; R196-I200 PolarHBondContact O-N 3.47Å; R196-V222 HydrophobicContact CB-CB 4.41Å; R196-V222 HydrophobicContact CB-CG1 4.35Å; R196-V222 HydrophobicContact CG-CB 3.9Å; R196-V222 HydrophobicContact CG-CG1 4.01Å; R196-V222 HydrophobicContact CG-CG2 3.85Å; R196-E225 IonicContact CZ-OE1 3.27Å; R196-E225 IonicContact NH2-OE1 2.72Å; R196-E225 PolarHBondContact NH2-OE1 2.82Å
197	I	82.7	Confident	90.9	Very high	30 Å²	30	23 Å²	23	15%	0.154	11%	0.112	C	C	.	.	H	α-helix	trans	-64.6	-36.2	-179	-168.9	173	0	0	0	112.5	R195 S201 Q404 F408 L429	R195-I197 HydrophobicContact CB-CG2 4.22Å; R195-I197 PolarHBondContact O-N 3.07Å; I197-S201 VanDerWaalsContact O-CB 3.27Å; I197-S201 WeakPolarHBondContact O-CB 3.31Å; I197-S201 PolarHBondContact O-N 3.21Å; I197-S201 PolarHBondContact O-OG 3.34Å; I197-Q404 HydrophobicContact CD1-CB 4.15Å; I197-F408 HydrophobicContact CD1-CE2 3.99Å; I197-F408 HydrophobicContact CD1-CZ 4.02Å; I197-F408 HydrophobicContact CG1-CE2 4.36Å; I197-F408 HydrophobicContact CG1-CZ 4.27Å; I197-L429 HydrophobicContact CB-CD2 4.4Å; I197-L429 HydrophobicContact CD1-CD1 4.41Å; I197-L429 HydrophobicContact CD1-CD2 4.19Å; I197-L429 HydrophobicContact CG1-CD2 3.93Å; I197-L429 HydrophobicContact CG2-CD1 4.29Å; I197-L429 HydrophobicContact CG2-CD2 3.84Å; I197-L429 HydrophobicContact CG2-CG 4.39Å
198	A	87.7	Confident	90.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.2	-48.3	173	0	0	0	0	0	111.3	Q193 R195 R196 I200 S201 L202 S428	Q193-A198 HydrophobicContact CB-CB 4.35Å; R195-A198 HydrophobicContact CB-CB 4.12Å; R195-A198 WeakPolarHBondContact O-CB 3.49Å; R195-A198 PolarHBondContact O-N 2.98Å; R196-A198 VanDerWaalsContact C-N 3.33Å; R196-A198 PolarHBondContact O-N 2.86Å; A198-I200 VanDerWaalsContact C-N 3.32Å; A198-I200 PolarHBondContact O-N 3.28Å; A198-S201 PolarHBondContact O-N 3.33Å; A198-S201 PolarHBondContact O-OG 3.12Å; A198-L202 VanDerWaalsContact O-CB 3.28Å; A198-L202 WeakPolarHBondContact O-CB 3.5Å; A198-L202 WeakPolarHBondContact O-CG 3.49Å; A198-L202 PolarHBondContact O-N 2.9Å; A198-S428 VanDerWaalsContact CB-CB 3.41Å
199	C	90.9	Very high	90.2	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-55.1	-44.8	176.8	-177.5	0	0	0	0	112.5	Q193 R195 R196 A203 V222 F236 L237	Q193-C199 HydrophobicContact CB-CB 4.12Å; R195-C199 PolarHBondContact O-N 2.92Å; R196-C199 WeakPolarHBondContact O-CB 3.29Å; R196-C199 PolarHBondContact O-N 3.31Å; C199-A203 VanDerWaalsContact O-CB 3.24Å; C199-A203 WeakPolarHBondContact O-CB 3.38Å; C199-A203 PolarHBondContact O-N 2.92Å; C199-V222 HydrophobicContact CB-CG1 3.78Å; C199-V222 VanDerWaalsContact SG-CG1 3.57Å; C199-F236 VanDerWaalsContact SG-CB 3.56Å; C199-F236 PolarHBondContact SG-O 2.95Å; C199-F236 VanDerWaalsContact SG-O 3.32Å; C199-L237 PolarHBondContact SG-N 3.14Å
200	I	86.4	Confident	89.7	Confident	48 Å²	48	19.6 Å²	19.6	25%	0.246	10%	0.097	C	C	.	.	H	α-helix	trans	-71.8	-48.3	-179.9	-63.9	169.3	0	0	0	110.9	R196 A198 A203 A204 Y220 V222	R196-I200 HydrophobicContact CG-CD1 3.86Å; R196-I200 WeakPolarHBondContact O-CG1 3.37Å; R196-I200 PolarHBondContact O-N 3.47Å; A198-I200 VanDerWaalsContact C-N 3.32Å; A198-I200 PolarHBondContact O-N 3.28Å; I200-A203 PolarHBondContact O-N 3.12Å; I200-A204 WeakPolarHBondContact O-CB 3.27Å; I200-A204 PolarHBondContact O-N 3.13Å; I200-Y220 HydrophobicContact CD1-CE2 4.21Å; I200-Y220 HydrophobicContact CG1-CD2 3.79Å; I200-Y220 HydrophobicContact CG1-CE2 3.71Å; I200-Y220 HydrophobicContact CG1-CG 4.26Å; I200-Y220 HydrophobicContact CG2-CE1 4.37Å; I200-V222 HydrophobicContact CD1-CG2 4.34Å; I200-V222 HydrophobicContact CG1-CG1 4.43Å
201	S	84.3	Confident	89.1	Confident	20 Å²	20	24 Å²	24	14%	0.14	12%	0.12	C	C	.	.	H	α-helix	trans	-66.5	-42	-176.3	57.8	0	0	0	0	112.5	I197 A198 A204 R205	I197-S201 VanDerWaalsContact O-CB 3.27Å; I197-S201 WeakPolarHBondContact O-CB 3.31Å; I197-S201 PolarHBondContact O-N 3.21Å; I197-S201 PolarHBondContact O-OG 3.34Å; A198-S201 PolarHBondContact O-N 3.33Å; A198-S201 PolarHBondContact O-OG 3.12Å; S201-A204 PolarHBondContact O-N 3.35Å; S201-R205 WeakPolarHBondContact O-CB 3.43Å; S201-R205 PolarHBondContact O-N 3.25Å
202	L	90.3	Very high	88.4	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-66.4	-43	176	-73.5	169.1	0	0	0	111.8	T164 Q193 A198 A204 R205 V206 F236	T164-L202 HydrophobicContact CG2-CD2 4.05Å; Q193-L202 HydrophobicContact CG-CD1 4.01Å; A198-L202 VanDerWaalsContact O-CB 3.28Å; A198-L202 WeakPolarHBondContact O-CB 3.5Å; A198-L202 WeakPolarHBondContact O-CG 3.49Å; A198-L202 PolarHBondContact O-N 2.9Å; L202-A204 VanDerWaalsContact C-N 3.29Å; L202-A204 PolarHBondContact O-N 2.99Å; L202-R205 PolarHBondContact O-N 3.1Å; L202-V206 WeakPolarHBondContact O-CB 3.49Å; L202-V206 WeakPolarHBondContact O-CG2 3.13Å; L202-V206 PolarHBondContact O-N 2.89Å; L202-F236 HydrophobicContact CB-CD1 4.05Å; L202-F236 HydrophobicContact CB-CE1 3.75Å; L202-F236 HydrophobicContact CB-CZ 4.27Å; L202-F236 HydrophobicContact CD1-CE1 4.45Å
203	A	91.8	Very high	87.2	Confident	4 Å²	4	28.9 Å²	28.9	3%	0.033	14%	0.144	C	C	.	.	H	α-helix	trans	-60.2	-40.8	174.3	0	0	0	0	0	111.9	C199 I200 S207 V218 Y220 F236	C199-A203 VanDerWaalsContact O-CB 3.24Å; C199-A203 WeakPolarHBondContact O-CB 3.38Å; C199-A203 PolarHBondContact O-N 2.92Å; I200-A203 PolarHBondContact O-N 3.12Å; A203-S207 WeakPolarHBondContact O-CB 3.28Å; A203-S207 PolarHBondContact O-N 3.35Å; A203-V218 HydrophobicContact CB-CG1 4.32Å; A203-V218 WeakPolarHBondContact O-CG1 3.32Å; A203-Y220 HydrophobicContact CB-CD1 4.18Å; A203-Y220 HydrophobicContact CB-CG 4.46Å; A203-F236 HydrophobicContact CB-CB 4.13Å; A203-F236 HydrophobicContact CB-CD2 3.66Å; A203-F236 HydrophobicContact CB-CE2 4.37Å; A203-F236 HydrophobicContact CB-CG 4.04Å
204	A	86.3	Confident	85.8	Confident	23 Å²	23	38.3 Å²	38.3	19%	0.19	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-44.6	174.8	0	0	0	0	0	111.8	I200 S201 L202 S207 T208	I200-A204 WeakPolarHBondContact O-CB 3.27Å; I200-A204 PolarHBondContact O-N 3.13Å; S201-A204 PolarHBondContact O-N 3.35Å; L202-A204 VanDerWaalsContact C-N 3.29Å; L202-A204 PolarHBondContact O-N 2.99Å; A204-S207 WeakPolarHBondContact O-CB 3.47Å; A204-S207 PolarHBondContact O-N 3.3Å; A204-T208 PolarHBondContact O-N 2.86Å; A204-T208 PolarHBondContact O-OG1 3.24Å
205	R	86.4	Confident	85.1	Confident	81 Å²	81	39.2 Å²	39.2	31%	0.306	19%	0.193	S	C	.	.	H	α-helix	trans	-63.9	-48.8	179.4	-179.5	63.6	-171.5	-160.2	2.2	112.2	T164 S201 L202 S207 T208 E209	T164-R205 HydrophobicContact CG2-CG 3.88Å; S201-R205 WeakPolarHBondContact O-CB 3.43Å; S201-R205 PolarHBondContact O-N 3.25Å; L202-R205 PolarHBondContact O-N 3.1Å; R205-S207 VanDerWaalsContact C-N 3.31Å; R205-S207 PolarHBondContact O-N 2.83Å; R205-T208 WeakPolarHBondContact O-CB 3.42Å; R205-T208 PolarHBondContact O-N 3.37Å; R205-T208 VanDerWaalsContact O-N 3.13Å; R205-E209 IonicContact CZ-OE1 3.51Å; R205-E209 VanDerWaalsContact CZ-OE1 3.27Å; R205-E209 IonicContact NE-OE1 3.51Å; R205-E209 PolarHBondContact NE-OE1 2.91Å; R205-E209 IonicContact NH2-OE1 3.81Å; R205-E209 PolarHBondContact NH2-OE1 2.86Å; R205-E209 PolarHBondContact O-N 2.84Å
206	V	92.2	Very high	85	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-37.7	177.7	174.9	0	0	0	0	110.8	T164 Q168 L202 T208 E209 M210 V218 I234 F236	T164-V206 HydrophobicContact CG2-CG2 4.41Å; Q168-V206 HydrophobicContact CG-CG1 3.83Å; L202-V206 WeakPolarHBondContact O-CB 3.49Å; L202-V206 WeakPolarHBondContact O-CG2 3.13Å; L202-V206 PolarHBondContact O-N 2.89Å; V206-T208 VanDerWaalsContact C-N 3.32Å; V206-T208 PolarHBondContact O-N 2.8Å; V206-E209 PolarHBondContact O-N 3.35Å; V206-M210 HydrophobicContact CG1-CG 4.21Å; V206-M210 HydrophobicContact CG1-SD 3.85Å; V206-M210 WeakPolarHBondContact O-CB 3.46Å; V206-M210 VanDerWaalsContact O-CG 3.28Å; V206-M210 WeakPolarHBondContact O-CG 3.4Å; V206-M210 PolarHBondContact O-N 3.03Å; V206-V218 HydrophobicContact CB-CG1 4.37Å; V206-V218 HydrophobicContact CG1-CG1 4.29Å; V206-V218 HydrophobicContact CG1-CG2 4.11Å; V206-I234 HydrophobicContact CG1-CD1 4.43Å; V206-F236 HydrophobicContact CB-CE2 4.25Å; V206-F236 HydrophobicContact CB-CZ 4.4Å; V206-F236 HydrophobicContact CG2-CE2 4.25Å; V206-F236 HydrophobicContact CG2-CZ 3.9Å
207	S	90.6	Very high	85.2	Confident	5 Å²	5	39.7 Å²	39.7	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-58.9	-41	171.6	175.8	0	0	0	0	112	A203 A204 R205 N212 E213	A203-S207 WeakPolarHBondContact O-CB 3.28Å; A203-S207 PolarHBondContact O-N 3.35Å; A204-S207 WeakPolarHBondContact O-CB 3.47Å; A204-S207 PolarHBondContact O-N 3.3Å; R205-S207 VanDerWaalsContact C-N 3.31Å; R205-S207 PolarHBondContact O-N 2.83Å; S207-N212 CarbonylContact O-C 3.55Å; S207-N212 VanDerWaalsContact O-C 3.29Å; S207-N212 VanDerWaalsContact O-CA 3.31Å; S207-N212 WeakPolarHBondContact O-CA 3.47Å; S207-N212 PolarHBondContact O-N 3.02Å; S207-N212 VanDerWaalsContact OG-C 3.31Å; S207-N212 PolarHBondContact OG-O 3.41Å; S207-E213 PolarHBondContact O-N 2.61Å; S207-E213 VanDerWaalsContact OG-CA 3.27Å; S207-E213 WeakPolarHBondContact OG-CA 3.47Å; S207-E213 PolarHBondContact OG-N 3.48Å
208	T	86.4	Confident	85.7	Confident	40 Å²	40	38.9 Å²	38.9	25%	0.245	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-46.3	173.4	-67.2	0	0	0	0	112.7	L126 A204 R205 V206 M210 L211 E213	L126-T208 HydrophobicContact CD1-CG2 4.5Å; A204-T208 PolarHBondContact O-N 2.86Å; A204-T208 PolarHBondContact O-OG1 3.24Å; R205-T208 WeakPolarHBondContact O-CB 3.42Å; R205-T208 PolarHBondContact O-N 3.37Å; R205-T208 VanDerWaalsContact O-N 3.13Å; V206-T208 VanDerWaalsContact C-N 3.32Å; V206-T208 PolarHBondContact O-N 2.8Å; T208-M210 VanDerWaalsContact C-N 3.32Å; T208-M210 PolarHBondContact O-N 3.37Å; T208-L211 WeakPolarHBondContact O-CA 3.29Å; T208-L211 PolarHBondContact O-N 3.12Å; T208-E213 WeakPolarHBondContact CB-OE1 3.35Å; T208-E213 WeakPolarHBondContact CG2-OE1 3.37Å; T208-E213 WeakPolarHBondContact OG1-CG 3.38Å; T208-E213 PolarHBondContact OG1-OE1 3.02Å
209	E	87.7	Confident	86	Confident	4 Å²	4	39 Å²	39	2%	0.019	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-30.8	-178.3	-72.2	-178.7	-175	0	0	113.7	L126 R127 Q165 Q168 R205 V206 L211	L126-E209 HydrophobicContact CD1-CG 4.3Å; L126-E209 HydrophobicContact CD2-CB 4.48Å; R127-E209 PolarHBondContact NH1-O 2.9Å; Q165-E209 PolarHBondContact NE2-OE2 2.79Å; Q168-E209 PolarHBondContact NE2-OE2 3.37Å; R205-E209 IonicContact CZ-OE1 3.51Å; R205-E209 VanDerWaalsContact CZ-OE1 3.27Å; R205-E209 IonicContact NE-OE1 3.51Å; R205-E209 PolarHBondContact NE-OE1 2.91Å; R205-E209 IonicContact NH2-OE1 3.81Å; R205-E209 PolarHBondContact NH2-OE1 2.86Å; R205-E209 PolarHBondContact O-N 2.84Å; V206-E209 PolarHBondContact O-N 3.35Å; E209-L211 PolarHBondContact O-N 3.28Å
210	M	88.6	Confident	86.1	Confident	14 Å²	14	40 Å²	40	7%	0.069	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	8.6	171.2	-64.1	-177.5	80.2	0	0	113.2	Q168 Y171 Y172 V206 T208 N212 V218 I234	Q168-M210 HydrophobicContact CG-CG 3.83Å; Q168-M210 HydrophobicContact CG-SD 4.07Å; Y171-M210 HydrophobicContact CD1-CE 3.37Å; Y171-M210 HydrophobicContact CE1-CE 3.68Å; Y171-M210 HydrophobicContact CG-CE 4.12Å; Y172-M210 HydrophobicContact CE2-CE 3.76Å; Y172-M210 HydrophobicContact CE2-CG 4.43Å; Y172-M210 VanDerWaalsContact OH-CE 3.32Å; Y172-M210 WeakPolarHBondContact OH-CE 3.41Å; V206-M210 HydrophobicContact CG1-CG 4.21Å; V206-M210 HydrophobicContact CG1-SD 3.85Å; V206-M210 WeakPolarHBondContact O-CB 3.46Å; V206-M210 VanDerWaalsContact O-CG 3.28Å; V206-M210 WeakPolarHBondContact O-CG 3.4Å; V206-M210 PolarHBondContact O-N 3.03Å; T208-M210 VanDerWaalsContact C-N 3.32Å; T208-M210 PolarHBondContact O-N 3.37Å; M210-N212 HydrophobicContact CB-CB 4.05Å; M210-N212 PolarHBondContact O-N 3.46Å; M210-N212 VanDerWaalsContact O-N 3.12Å; M210-V218 HydrophobicContact SD-CG2 3.5Å; M210-V218 WeakPolarHBondContact SD-CG2 3.48Å; M210-I234 HydrophobicContact CE-CD1 4.16Å; M210-I234 HydrophobicContact SD-CD1 3.72Å
211	L	85.6	Confident	86.4	Confident	92 Å²	92	39.3 Å²	39.3	48%	0.482	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	33.3	-175.8	-55.4	177.1	0	0	0	112.7	I123 T208 E209	I123-L211 HydrophobicContact CD1-CD1 4.4Å; I123-L211 HydrophobicContact CG1-CD2 4.09Å; I123-L211 HydrophobicContact CG2-CD1 4.18Å; T208-L211 WeakPolarHBondContact O-CA 3.29Å; T208-L211 PolarHBondContact O-N 3.12Å; E209-L211 PolarHBondContact O-N 3.28Å
212	N	83.6	Confident	86.5	Confident	18 Å²	18	38.6 Å²	38.6	10%	0.096	20%	0.195	C	C	.	.			trans	-120.4	26	-168.5	-164.4	1.6	0	0	0	112.1	S207 M210 R214 G215 K217	S207-N212 CarbonylContact O-C 3.55Å; S207-N212 VanDerWaalsContact O-C 3.29Å; S207-N212 VanDerWaalsContact O-CA 3.31Å; S207-N212 WeakPolarHBondContact O-CA 3.47Å; S207-N212 PolarHBondContact O-N 3.02Å; S207-N212 VanDerWaalsContact OG-C 3.31Å; S207-N212 PolarHBondContact OG-O 3.41Å; M210-N212 HydrophobicContact CB-CB 4.05Å; M210-N212 PolarHBondContact O-N 3.46Å; M210-N212 VanDerWaalsContact O-N 3.12Å; N212-R214 PolarHBondContact O-N 3.48Å; N212-R214 VanDerWaalsContact O-N 3.14Å; N212-G215 PolarHBondContact O-N 3.33Å; N212-G215 VanDerWaalsContact O-N 3.11Å; N212-G215 VanDerWaalsContact OD1-C 3.29Å; N212-G215 WeakPolarHBondContact OD1-CA 2.95Å; N212-G215 PolarHBondContact OD1-N 3.12Å; N212-K217 WeakPolarHBondContact ND2-CB 3.43Å; N212-K217 WeakPolarHBondContact ND2-CD 3.38Å; N212-K217 WeakPolarHBondContact ND2-CG 3.34Å
213	E	71.8	Confident	85.8	Confident	86 Å²	86	43.6 Å²	43.6	40%	0.402	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-33.4	-178.5	-62	-174.6	158.9	0	0	113	S207 T208 M735	S207-E213 PolarHBondContact O-N 2.61Å; S207-E213 VanDerWaalsContact OG-CA 3.27Å; S207-E213 WeakPolarHBondContact OG-CA 3.47Å; S207-E213 PolarHBondContact OG-N 3.48Å; T208-E213 WeakPolarHBondContact CB-OE1 3.35Å; T208-E213 WeakPolarHBondContact CG2-OE1 3.37Å; T208-E213 WeakPolarHBondContact OG1-CG 3.38Å; T208-E213 PolarHBondContact OG1-OE1 3.02Å; E213-M735 WeakPolarHBondContact O-CE 3.22Å
214	R	66.5	Low	84.6	Confident	198 Å²	198	46 Å²	46	75%	0.747	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-9.9	-179.9	-69	-179.3	176	-174.2	-1.3	113.8	N212 R731 M735	N212-R214 PolarHBondContact O-N 3.48Å; N212-R214 VanDerWaalsContact O-N 3.14Å; R214-R731 PolarHBondContact O-NH2 3.01Å; R214-M735 HydrophobicContact CB-CE 4.22Å; R214-M735 HydrophobicContact CG-CE 3.56Å
215	G	73.7	Confident	83.9	Confident	42 Å²	42	47.2 Å²	47.2	43%	0.433	23%	0.226	S	C	.	.	S	Bend	trans	-92.9	-168.9	172.4	0	0	0	0	0	111.2	N212	N212-G215 PolarHBondContact O-N 3.33Å; N212-G215 VanDerWaalsContact O-N 3.11Å; N212-G215 VanDerWaalsContact OD1-C 3.29Å; N212-G215 WeakPolarHBondContact OD1-CA 2.95Å; N212-G215 PolarHBondContact OD1-N 3.12Å
216	S	84.9	Confident	83.8	Confident	45 Å²	45	50 Å²	50	32%	0.315	24%	0.236	S	C	.	.	S	Bend	trans	-129.9	13.4	-171.6	55.1	0	0	0	0	113.3	V218 T229 A231 T232	S216-V218 VanDerWaalsContact C-N 3.3Å; S216-V218 PolarHBondContact O-N 3.33Å; S216-T229 WeakPolarHBondContact CB-OG1 3.37Å; S216-T229 PolarHBondContact OG-OG1 3.04Å; S216-A231 WeakPolarHBondContact OG-CB 3.41Å; S216-T232 WeakPolarHBondContact O-CA 3.33Å; S216-T232 PolarHBondContact O-N 3.13Å; S216-T232 PolarHBondContact O-OG1 3.28Å
217	K	90.6	Very high	83.4	Confident	83 Å²	83	51.3 Å²	51.3	36%	0.361	25%	0.245	S	C	.	.	S	Bend	trans	-67.9	-30	177.8	-41.4	175.8	-180	177.4	0	112.6	N212 A231 R233 I234	N212-K217 WeakPolarHBondContact ND2-CB 3.43Å; N212-K217 WeakPolarHBondContact ND2-CD 3.38Å; N212-K217 WeakPolarHBondContact ND2-CG 3.34Å; K217-A231 WeakPolarHBondContact CA-O 3.35Å; K217-R233 PolarHBondContact O-N 3.25Å; K217-I234 PolarHBondContact O-N 3.46Å
218	V	94.3	Very high	83.3	Confident	13 Å²	13	54 Å²	54	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	123.6	171.9	-173.1	0	0	0	0	108	A203 V206 M210 S216 I234 F236	A203-V218 HydrophobicContact CB-CG1 4.32Å; A203-V218 WeakPolarHBondContact O-CG1 3.32Å; V206-V218 HydrophobicContact CB-CG1 4.37Å; V206-V218 HydrophobicContact CG1-CG1 4.29Å; V206-V218 HydrophobicContact CG1-CG2 4.11Å; M210-V218 HydrophobicContact SD-CG2 3.5Å; M210-V218 WeakPolarHBondContact SD-CG2 3.48Å; S216-V218 VanDerWaalsContact C-N 3.3Å; S216-V218 PolarHBondContact O-N 3.33Å; V218-I234 WeakPolarHBondContact CA-O 3.32Å; V218-I234 HydrophobicContact CG2-CB 4.45Å; V218-I234 HydrophobicContact CG2-CD1 4.43Å; V218-F236 HydrophobicContact CG1-CD2 4.19Å; V218-F236 HydrophobicContact CG1-CE2 4.03Å
219	G	92.5	Very high	83.4	Confident	1 Å²	1	55 Å²	55	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	168	178.4	0	0	0	0	0	111.1	I234 F236	G219-I234 PolarHBondContact N-O 2.91Å; G219-F236 PolarHBondContact O-N 3.23Å
220	Y	93.2	Very high	83.4	Confident	23 Å²	23	64.7 Å²	64.7	9%	0.09	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	155.7	169.8	68.6	-94	0	0	0	110.8	I200 A203 V222 E225 S227 F236	I200-Y220 HydrophobicContact CD1-CE2 4.21Å; I200-Y220 HydrophobicContact CG1-CD2 3.79Å; I200-Y220 HydrophobicContact CG1-CE2 3.71Å; I200-Y220 HydrophobicContact CG1-CG 4.26Å; I200-Y220 HydrophobicContact CG2-CE1 4.37Å; A203-Y220 HydrophobicContact CB-CD1 4.18Å; A203-Y220 HydrophobicContact CB-CG 4.46Å; Y220-V222 HydrophobicContact CD2-CG1 4.32Å; Y220-V222 HydrophobicContact CD2-CG2 4.29Å; Y220-V222 HydrophobicContact CE2-CG2 4.27Å; Y220-E225 HydrophobicContact CE2-CB 4.03Å; Y220-E225 PolarHBondContact OH-OE2 3.06Å; Y220-S227 WeakPolarHBondContact CD1-OG 3.1Å; Y220-S227 WeakPolarHBondContact CE1-OG 3.12Å; Y220-S227 PolarHBondContact N-OG 3.23Å; Y220-S227 PolarHBondContact O-N 3.42Å; Y220-S227 PolarHBondContact O-OG 2.95Å; Y220-F236 CarbonylContact C-O 3.57Å; Y220-F236 WeakPolarHBondContact CA-O 3.41Å
221	Q	92.4	Very high	83.5	Confident	32 Å²	32	66.2 Å²	66.2	15%	0.15	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	116.9	171.8	-167.4	176.5	-30.1	0	0	109.5	R226 L235 F236 L237 T238 L241	Q221-R226 HydrophobicContact CG-CB 4.22Å; Q221-R226 HydrophobicContact CG-CG 4.13Å; Q221-L235 HydrophobicContact CB-CD1 4.11Å; Q221-F236 PolarHBondContact N-O 3.28Å; Q221-L237 HydrophobicContact CB-CB 4.29Å; Q221-L237 WeakPolarHBondContact O-CA 3.15Å; Q221-L237 WeakPolarHBondContact O-CB 3.03Å; Q221-T238 PolarHBondContact O-N 3.45Å; Q221-L241 HydrophobicContact CB-CD1 4.39Å; Q221-L241 HydrophobicContact CG-CD1 3.95Å; Q221-L241 WeakPolarHBondContact O-CD1 3.35Å
222	V	87.3	Confident	83.9	Confident	6 Å²	6	62.3 Å²	62.3	4%	0.036	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	168.9	178.6	-58.4	0	0	0	0	108.3	R196 C199 I200 Y220 F224 E225 T238	R196-V222 HydrophobicContact CB-CB 4.41Å; R196-V222 HydrophobicContact CB-CG1 4.35Å; R196-V222 HydrophobicContact CG-CB 3.9Å; R196-V222 HydrophobicContact CG-CG1 4.01Å; R196-V222 HydrophobicContact CG-CG2 3.85Å; C199-V222 HydrophobicContact CB-CG1 3.78Å; C199-V222 VanDerWaalsContact SG-CG1 3.57Å; I200-V222 HydrophobicContact CD1-CG2 4.34Å; I200-V222 HydrophobicContact CG1-CG1 4.43Å; Y220-V222 HydrophobicContact CD2-CG1 4.32Å; Y220-V222 HydrophobicContact CD2-CG2 4.29Å; Y220-V222 HydrophobicContact CE2-CG2 4.27Å; V222-F224 PolarHBondContact O-N 3.25Å; V222-E225 HydrophobicContact CG2-CB 3.71Å; V222-E225 PolarHBondContact N-O 3.3Å; V222-E225 PolarHBondContact O-N 3.37Å; V222-E225 VanDerWaalsContact O-N 3.15Å; V222-T238 HydrophobicContact CB-CG2 4.41Å; V222-T238 HydrophobicContact CG1-CG2 4.08Å
223	R	76.2	Confident	84.5	Confident	105 Å²	105	65.3 Å²	65.3	40%	0.396	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	134.3	173.8	-161.6	-179.6	178.4	147.9	3.9	109.4	E225 P569	R223-E225 PolarHBondContact O-N 3.17Å; R223-E225 VanDerWaalsContact O-N 3.15Å; R223-P569 PolarHBondContact NH2-O 3.04Å
224	F	66.6	Low	85.7	Confident	54 Å²	54	61.2 Å²	61.2	24%	0.237	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-9.3	-177.3	-43.6	-73	0	0	0	117.2	V222 R691 L692	V222-F224 PolarHBondContact O-N 3.25Å; F224-R691 HydrophobicContact CD1-CB 4.13Å; F224-L692 HydrophobicContact CE1-CD2 3.52Å; F224-L692 HydrophobicContact CE1-CG 3.55Å; F224-L692 HydrophobicContact CZ-CD1 4.08Å; F224-L692 HydrophobicContact CZ-CD2 3.43Å; F224-L692 VanDerWaalsContact CZ-CD2 3.43Å; F224-L692 HydrophobicContact CZ-CG 3.53Å
225	E	71.8	Confident	87.2	Confident	50 Å²	50	52 Å²	52	23%	0.234	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133.5	-178.6	-67.7	-176.6	-146.2	0	0	113.5	R196 Y220 V222 R223	R196-E225 IonicContact CZ-OE1 3.27Å; R196-E225 IonicContact NH2-OE1 2.72Å; R196-E225 PolarHBondContact NH2-OE1 2.82Å; Y220-E225 HydrophobicContact CE2-CB 4.03Å; Y220-E225 PolarHBondContact OH-OE2 3.06Å; V222-E225 HydrophobicContact CG2-CB 3.71Å; V222-E225 PolarHBondContact N-O 3.3Å; V222-E225 PolarHBondContact O-N 3.37Å; V222-E225 VanDerWaalsContact O-N 3.15Å; R223-E225 PolarHBondContact O-N 3.17Å; R223-E225 VanDerWaalsContact O-N 3.15Å
226	R	83.2	Confident	88.3	Confident	140 Å²	140	50 Å²	50	53%	0.528	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138	174.6	178.8	178.1	163.9	163.7	7.6	110.1	Q221 R228	Q221-R226 HydrophobicContact CG-CB 4.22Å; Q221-R226 HydrophobicContact CG-CG 4.13Å; R226-R228 HydrophobicContact CG-CB 3.89Å; R226-R228 PolarHBondContact NE-O 3.45Å; R226-R228 VanDerWaalsContact NE-O 3.09Å
227	S	84.9	Confident	88.9	Confident	26 Å²	26	47.9 Å²	47.9	18%	0.182	22%	0.218	C	C	.	.			trans	-120.2	-1.9	165	63	0	0	0	0	113.2	Y220 T229	Y220-S227 WeakPolarHBondContact CD1-OG 3.1Å; Y220-S227 WeakPolarHBondContact CE1-OG 3.12Å; Y220-S227 PolarHBondContact N-OG 3.23Å; Y220-S227 PolarHBondContact O-N 3.42Å; Y220-S227 PolarHBondContact O-OG 2.95Å; S227-T229 PolarHBondContact O-N 3.31Å
228	R	87.8	Confident	89.1	Confident	63 Å²	63	45.1 Å²	45.1	24%	0.238	21%	0.208	C	C	.	.			trans	-57	125.3	172.7	-176.6	-174.7	179.8	-176.8	-7.2	111.7	R226 T232 L235 D254 Y255	R226-R228 HydrophobicContact CG-CB 3.89Å; R226-R228 PolarHBondContact NE-O 3.45Å; R226-R228 VanDerWaalsContact NE-O 3.09Å; R228-T232 HydrophobicContact CG-CG2 4.38Å; R228-L235 HydrophobicContact CB-CD1 3.72Å; R228-L235 HydrophobicContact CG-CD1 4.02Å; R228-L235 HydrophobicContact CG-CD2 4.46Å; R228-D254 IonicContact CZ-OD2 3.65Å; R228-D254 IonicContact NH1-OD2 3.68Å; R228-D254 IonicContact NH2-OD2 3.04Å; R228-D254 PolarHBondContact NH2-OD2 2.91Å; R228-Y255 PolarHBondContact NH1-OH 3.14Å
229	T	88.1	Confident	89.1	Confident	59 Å²	59	44.8 Å²	44.8	36%	0.362	21%	0.206	S	C	.	.			trans	-121.7	174.5	173	70.7	0	0	0	0	110.4	S216 S227 A231 T232	S216-T229 WeakPolarHBondContact CB-OG1 3.37Å; S216-T229 PolarHBondContact OG-OG1 3.04Å; S227-T229 PolarHBondContact O-N 3.31Å; T229-A231 PolarHBondContact O-N 3.4Å; T229-A231 PolarHBondContact OG1-N 3.47Å; T229-T232 PolarHBondContact N-OG1 2.95Å; T229-T232 VanDerWaalsContact O-CB 3.27Å; T229-T232 WeakPolarHBondContact O-CB 3.42Å; T229-T232 PolarHBondContact O-N 3.23Å; T229-T232 PolarHBondContact O-OG1 3.18Å; T229-T232 PolarHBondContact OG1-OG1 3.47Å
230	K	88.5	Confident	89	Confident	209 Å²	209	46.4 Å²	46.4	91%	0.909	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-24	173.6	-66.7	-171.5	176.6	-172.6	0	113.6	T232 R233	K230-T232 VanDerWaalsContact C-N 3.34Å; K230-R233 PolarHBondContact O-NH1 2.84Å; K230-R233 VanDerWaalsContact O-NH1 3.08Å
231	A	90.6	Very high	88.8	Confident	45 Å²	45	46.6 Å²	46.6	37%	0.372	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-4	177.8	0	0	0	0	0	113.2	S216 K217 T229	S216-A231 WeakPolarHBondContact OG-CB 3.41Å; K217-A231 WeakPolarHBondContact CA-O 3.35Å; T229-A231 PolarHBondContact O-N 3.4Å; T229-A231 PolarHBondContact OG1-N 3.47Å
232	T	94.2	Very high	88.9	Confident	11 Å²	11	45.1 Å²	45.1	7%	0.067	22%	0.218	C	C	.	.			trans	-70.1	135.7	177.4	-57.8	0	0	0	0	110.1	S216 R228 T229 K230 I234 L235	S216-T232 WeakPolarHBondContact O-CA 3.33Å; S216-T232 PolarHBondContact O-N 3.13Å; S216-T232 PolarHBondContact O-OG1 3.28Å; R228-T232 HydrophobicContact CG-CG2 4.38Å; T229-T232 PolarHBondContact N-OG1 2.95Å; T229-T232 VanDerWaalsContact O-CB 3.27Å; T229-T232 WeakPolarHBondContact O-CB 3.42Å; T229-T232 PolarHBondContact O-N 3.23Å; T229-T232 PolarHBondContact O-OG1 3.18Å; T229-T232 PolarHBondContact OG1-OG1 3.47Å; K230-T232 VanDerWaalsContact C-N 3.34Å; T232-I234 WeakPolarHBondContact CG2-O 3.5Å; T232-L235 HydrophobicContact CG2-CB 4.37Å; T232-L235 HydrophobicContact CG2-CD1 4.46Å
233	R	95.4	Very high	89.1	Confident	80 Å²	80	44.9 Å²	44.9	30%	0.302	22%	0.217	S	C	.	.			trans	-124.5	-36.6	-177.3	-63.2	-67.5	177.5	-102.6	4.9	111.2	Y171 Q187 I189 K217 K230	Y171-R233 HydrophobicContact CD2-CB 3.87Å; Y171-R233 HydrophobicContact CE2-CB 3.61Å; Y171-R233 HydrophobicContact CE2-CG 3.81Å; Q187-R233 CarbonylContact O-C 3.55Å; Q187-R233 WeakPolarHBondContact O-CA 3.06Å; Q187-R233 WeakPolarHBondContact O-CB 3.32Å; Q187-R233 WeakPolarHBondContact O-CD 3.4Å; Q187-R233 VanDerWaalsContact O-O 3.09Å; I189-R233 PolarHBondContact N-O 3.04Å; K217-R233 PolarHBondContact O-N 3.25Å; K230-R233 PolarHBondContact O-NH1 2.84Å; K230-R233 VanDerWaalsContact O-NH1 3.08Å
234	I	97.5	Very high	89.5	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	116.5	169.5	-54	175.5	0	0	0	108.1	P167 Y171 I189 V191 V206 M210 K217 V218 G219 T232 F236	P167-I234 HydrophobicContact CB-CD1 4.25Å; P167-I234 HydrophobicContact CB-CG2 3.96Å; P167-I234 WeakPolarHBondContact O-CD1 3.17Å; Y171-I234 HydrophobicContact CG-CD1 4.37Å; I189-I234 HydrophobicContact CD1-CG1 4.13Å; V191-I234 HydrophobicContact CG2-CG2 4.15Å; V206-I234 HydrophobicContact CG1-CD1 4.43Å; M210-I234 HydrophobicContact CE-CD1 4.16Å; M210-I234 HydrophobicContact SD-CD1 3.72Å; K217-I234 PolarHBondContact O-N 3.46Å; V218-I234 WeakPolarHBondContact CA-O 3.32Å; V218-I234 HydrophobicContact CG2-CB 4.45Å; V218-I234 HydrophobicContact CG2-CD1 4.43Å; G219-I234 PolarHBondContact N-O 2.91Å; T232-I234 WeakPolarHBondContact CG2-O 3.5Å; I234-F236 HydrophobicContact CG2-CD2 4.19Å; I234-F236 HydrophobicContact CG2-CE2 3.72Å; I234-F236 HydrophobicContact CG2-CZ 4.43Å
235	L	97.8	Very high	90.6	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.8	178.3	-179.5	65.8	0	0	0	110.2	I189 V191 Q221 R228 T232 L237 Y255	I189-L235 PolarHBondContact O-N 3.4Å; V191-L235 PolarHBondContact N-O 3.17Å; Q221-L235 HydrophobicContact CB-CD1 4.11Å; R228-L235 HydrophobicContact CB-CD1 3.72Å; R228-L235 HydrophobicContact CG-CD1 4.02Å; R228-L235 HydrophobicContact CG-CD2 4.46Å; T232-L235 HydrophobicContact CG2-CB 4.37Å; T232-L235 HydrophobicContact CG2-CD1 4.46Å; L235-L237 HydrophobicContact CD2-CD1 4.42Å; L235-L237 HydrophobicContact CD2-CD2 4.46Å; L235-L237 HydrophobicContact CG-CD2 4.35Å; L235-Y255 HydrophobicContact CD2-CE1 4.19Å; L235-Y255 WeakPolarHBondContact CD2-OH 3.27Å
236	F	97.6	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.1	164.7	-69.6	-96	0	0	0	109.3	P167 V191 Q193 C199 L202 A203 V206 V218 G219 Y220 Q221 I234	P167-F236 HydrophobicContact CG-CZ 4.18Å; V191-F236 HydrophobicContact CB-CD1 3.81Å; V191-F236 HydrophobicContact CB-CE1 3.9Å; V191-F236 HydrophobicContact CB-CG 4.3Å; V191-F236 HydrophobicContact CB-CZ 4.44Å; V191-F236 HydrophobicContact CG1-CD1 3.79Å; V191-F236 HydrophobicContact CG1-CE1 3.6Å; V191-F236 HydrophobicContact CG1-CZ 4.4Å; V191-F236 HydrophobicContact CG2-CE1 4.34Å; V191-F236 HydrophobicContact CG2-CZ 4.42Å; V191-F236 CarbonylContact O-C 3.53Å; V191-F236 VanDerWaalsContact O-CA 3.29Å; V191-F236 WeakPolarHBondContact O-CA 3.46Å; Q193-F236 HydrophobicContact CG-CD1 4.24Å; C199-F236 VanDerWaalsContact SG-CB 3.56Å; C199-F236 PolarHBondContact SG-O 2.95Å; C199-F236 VanDerWaalsContact SG-O 3.32Å; L202-F236 HydrophobicContact CB-CD1 4.05Å; L202-F236 HydrophobicContact CB-CE1 3.75Å; L202-F236 HydrophobicContact CB-CZ 4.27Å; L202-F236 HydrophobicContact CD1-CE1 4.45Å; A203-F236 HydrophobicContact CB-CB 4.13Å; A203-F236 HydrophobicContact CB-CD2 3.66Å; A203-F236 HydrophobicContact CB-CE2 4.37Å; A203-F236 HydrophobicContact CB-CG 4.04Å; V206-F236 HydrophobicContact CB-CE2 4.25Å; V206-F236 HydrophobicContact CB-CZ 4.4Å; V206-F236 HydrophobicContact CG2-CE2 4.25Å; V206-F236 HydrophobicContact CG2-CZ 3.9Å; V218-F236 HydrophobicContact CG1-CD2 4.19Å; V218-F236 HydrophobicContact CG1-CE2 4.03Å; G219-F236 PolarHBondContact O-N 3.23Å; Y220-F236 CarbonylContact C-O 3.57Å; Y220-F236 WeakPolarHBondContact CA-O 3.41Å; Q221-F236 PolarHBondContact N-O 3.28Å; I234-F236 HydrophobicContact CG2-CD2 4.19Å; I234-F236 HydrophobicContact CG2-CE2 3.72Å; I234-F236 HydrophobicContact CG2-CZ 4.43Å
237	L	96.9	Very high	91.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	157.8	176	69.5	170.4	0	0	0	112.5	A190 V191 T192 Q193 C199 Q221 L235 L241 L242	A190-L237 HydrophobicContact CB-CD2 4Å; V191-L237 PolarHBondContact O-N 3.04Å; T192-L237 CarbonylContact C-O 3.26Å; T192-L237 VanDerWaalsContact CA-O 3.23Å; T192-L237 WeakPolarHBondContact CA-O 3.25Å; T192-L237 HydrophobicContact CG2-CD2 4.45Å; Q193-L237 PolarHBondContact N-O 2.77Å; C199-L237 PolarHBondContact SG-N 3.14Å; Q221-L237 HydrophobicContact CB-CB 4.29Å; Q221-L237 WeakPolarHBondContact O-CA 3.15Å; Q221-L237 WeakPolarHBondContact O-CB 3.03Å; L235-L237 HydrophobicContact CD2-CD1 4.42Å; L235-L237 HydrophobicContact CD2-CD2 4.46Å; L235-L237 HydrophobicContact CG-CD2 4.35Å; L237-L241 HydrophobicContact CD1-CB 4.36Å; L237-L242 HydrophobicContact CD1-CB 4.01Å; L237-L242 HydrophobicContact CD1-CD1 4.22Å; L237-L242 HydrophobicContact CG-CB 4.48Å
238	T	94.5	Very high	91.3	Very high	25 Å²	25	41.3 Å²	41.3	15%	0.153	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	146.2	172.2	52.6	0	0	0	0	111.1	Q193 Q221 V222 G240 L241 L242	Q193-T238 WeakPolarHBondContact O-CA 3.44Å; Q221-T238 PolarHBondContact O-N 3.45Å; V222-T238 HydrophobicContact CB-CG2 4.41Å; V222-T238 HydrophobicContact CG1-CG2 4.08Å; T238-G240 VanDerWaalsContact C-N 3.32Å; T238-G240 PolarHBondContact O-N 3.04Å; T238-L241 WeakPolarHBondContact O-CB 3.36Å; T238-L241 PolarHBondContact O-N 3.34Å; T238-L241 WeakPolarHBondContact OG1-CD1 3.43Å; T238-L241 WeakPolarHBondContact OG1-CG 3.45Å; T238-L242 PolarHBondContact O-N 3.44Å
239	E	94.2	Very high	91.4	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.028	20%	0.198	C	C	.	.	H	α-helix	trans	-51.3	-46.3	-179.4	-66.7	156.8	-152.5	0	0	113.2	P194 L241 L242 L243 Q269 T270 L273	P194-E239 WeakPolarHBondContact CA-OE1 3.44Å; P194-E239 WeakPolarHBondContact CB-OE1 3.3Å; E239-L241 PolarHBondContact O-N 3.25Å; E239-L241 VanDerWaalsContact O-N 3.17Å; E239-L242 WeakPolarHBondContact O-CA 3.44Å; E239-L242 WeakPolarHBondContact O-CB 3.22Å; E239-L242 PolarHBondContact O-N 2.94Å; E239-L243 PolarHBondContact O-N 2.9Å; E239-Q269 HydrophobicContact CB-CB 3.72Å; E239-T270 PolarHBondContact OE1-OG1 3.42Å; E239-T270 PolarHBondContact OE2-N 3.09Å; E239-T270 PolarHBondContact OE2-OG1 2.87Å; E239-L273 HydrophobicContact CB-CD1 3.77Å; E239-L273 HydrophobicContact CG-CD1 4.08Å
240	G	89.6	Confident	91.4	Very high	35 Å²	35	40.8 Å²	40.8	36%	0.361	20%	0.202	S	C	.	.	H	α-helix	trans	-61.3	-25.5	177.7	0	0	0	0	0	114.4	T238 R244	T238-G240 VanDerWaalsContact C-N 3.32Å; T238-G240 PolarHBondContact O-N 3.04Å; G240-R244 WeakPolarHBondContact O-CB 3.22Å; G240-R244 PolarHBondContact O-N 3.03Å; G240-R244 VanDerWaalsContact O-N 3.15Å
241	L	90.7	Very high	91.5	Very high	28 Å²	28	35.8 Å²	35.8	15%	0.147	18%	0.181	C	C	.	.	H	α-helix	trans	-78.3	-28.2	173.3	-76.6	174.2	0	0	0	112.6	Q221 L237 T238 E239 Q245	Q221-L241 HydrophobicContact CB-CD1 4.39Å; Q221-L241 HydrophobicContact CG-CD1 3.95Å; Q221-L241 WeakPolarHBondContact O-CD1 3.35Å; L237-L241 HydrophobicContact CD1-CB 4.36Å; T238-L241 WeakPolarHBondContact O-CB 3.36Å; T238-L241 PolarHBondContact O-N 3.34Å; T238-L241 WeakPolarHBondContact OG1-CD1 3.43Å; T238-L241 WeakPolarHBondContact OG1-CG 3.45Å; E239-L241 PolarHBondContact O-N 3.25Å; E239-L241 VanDerWaalsContact O-N 3.17Å; L241-Q245 WeakPolarHBondContact O-CG 3.47Å; L241-Q245 PolarHBondContact O-N 2.85Å; L241-Q245 VanDerWaalsContact O-N 3.17Å; L241-Q245 PolarHBondContact O-NE2 2.88Å
242	L	94.1	Very high	91.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-73.3	-44.4	173	-172.2	62.6	0	0	0	110	T192 L237 T238 E239 R244 Q245 M246 L252 Y255 I258 L273	T192-L242 HydrophobicContact CG2-CB 4.22Å; T192-L242 HydrophobicContact CG2-CD2 3.47Å; T192-L242 VanDerWaalsContact CG2-CD2 3.47Å; T192-L242 HydrophobicContact CG2-CG 4.47Å; L237-L242 HydrophobicContact CD1-CB 4.01Å; L237-L242 HydrophobicContact CD1-CD1 4.22Å; L237-L242 HydrophobicContact CG-CB 4.48Å; T238-L242 PolarHBondContact O-N 3.44Å; E239-L242 WeakPolarHBondContact O-CA 3.44Å; E239-L242 WeakPolarHBondContact O-CB 3.22Å; E239-L242 PolarHBondContact O-N 2.94Å; L242-R244 VanDerWaalsContact C-N 3.29Å; L242-R244 PolarHBondContact O-N 3.14Å; L242-Q245 WeakPolarHBondContact O-CA 3.49Å; L242-Q245 WeakPolarHBondContact O-CB 3.34Å; L242-Q245 PolarHBondContact O-N 3.28Å; L242-M246 WeakPolarHBondContact O-CG 3.42Å; L242-M246 PolarHBondContact O-N 2.95Å; L242-L252 HydrophobicContact CD1-CD1 3.86Å; L242-L252 HydrophobicContact CD1-CD2 4.05Å; L242-L252 HydrophobicContact CG-CD1 4.27Å; L242-Y255 HydrophobicContact CD1-CD2 4.45Å; L242-Y255 HydrophobicContact CD1-CE2 3.98Å; L242-I258 HydrophobicContact CD2-CG2 4.04Å; L242-L273 HydrophobicContact CB-CD1 4.45Å; L242-L273 HydrophobicContact CB-CD2 4.37Å; L242-L273 HydrophobicContact CD2-CD1 4.32Å; L242-L273 HydrophobicContact CD2-CD2 4.09Å; L242-L273 HydrophobicContact CG-CD2 4.14Å
243	L	90.5	Very high	91.7	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-53.7	-45.2	172.5	-75.9	173.3	0	0	0	112.2	E239 Q245 M246 Q247 Q269 C272 L273 L276	E239-L243 PolarHBondContact O-N 2.9Å; L243-Q245 VanDerWaalsContact C-N 3.32Å; L243-Q245 PolarHBondContact O-N 3.28Å; L243-M246 WeakPolarHBondContact O-CB 3.32Å; L243-M246 PolarHBondContact O-N 3.02Å; L243-M246 VanDerWaalsContact O-N 3.13Å; L243-Q247 PolarHBondContact O-N 3.36Å; L243-Q247 VanDerWaalsContact O-N 3.17Å; L243-Q269 HydrophobicContact CD1-CB 3.67Å; L243-Q269 HydrophobicContact CD1-CG 3.85Å; L243-C272 HydrophobicContact CD2-CB 4.4Å; L243-L273 HydrophobicContact CD1-CG 4.45Å; L243-L273 HydrophobicContact CD2-CD2 3.48Å; L243-L273 VanDerWaalsContact CD2-CD2 3.48Å; L243-L273 HydrophobicContact CD2-CG 3.64Å; L243-L273 HydrophobicContact CG-CD1 4.34Å; L243-L273 HydrophobicContact CG-CD2 3.74Å; L243-L273 HydrophobicContact CG-CG 3.73Å; L243-L276 HydrophobicContact CD2-CD1 3.4Å; L243-L276 VanDerWaalsContact CD2-CD1 3.4Å
244	R	84.6	Confident	91.5	Very high	65 Å²	65	37.5 Å²	37.5	25%	0.245	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-33.1	176.5	-176.3	178.5	165.8	-175.6	-0.1	113.1	G240 L242 M246 Q247	G240-R244 WeakPolarHBondContact O-CB 3.22Å; G240-R244 PolarHBondContact O-N 3.03Å; G240-R244 VanDerWaalsContact O-N 3.15Å; L242-R244 VanDerWaalsContact C-N 3.29Å; L242-R244 PolarHBondContact O-N 3.14Å; R244-M246 VanDerWaalsContact C-N 3.32Å; R244-Q247 PolarHBondContact O-N 2.61Å
245	Q	89.6	Confident	91.5	Very high	35 Å²	35	38.1 Å²	38.1	16%	0.164	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-39.3	172.4	-76.4	170.9	54.1	0	0	110.6	L241 L242 L243 Q247 R248 D249 L252 Y255	L241-Q245 WeakPolarHBondContact O-CG 3.47Å; L241-Q245 PolarHBondContact O-N 2.85Å; L241-Q245 VanDerWaalsContact O-N 3.17Å; L241-Q245 PolarHBondContact O-NE2 2.88Å; L242-Q245 WeakPolarHBondContact O-CA 3.49Å; L242-Q245 WeakPolarHBondContact O-CB 3.34Å; L242-Q245 PolarHBondContact O-N 3.28Å; L243-Q245 VanDerWaalsContact C-N 3.32Å; L243-Q245 PolarHBondContact O-N 3.28Å; Q245-Q247 VanDerWaalsContact C-N 3.29Å; Q245-Q247 PolarHBondContact O-N 2.93Å; Q245-R248 PolarHBondContact O-N 2.86Å; Q245-R248 VanDerWaalsContact O-N 3.11Å; Q245-D249 PolarHBondContact O-N 3.49Å; Q245-L252 HydrophobicContact CB-CD2 3.9Å; Q245-Y255 PolarHBondContact OE1-OH 3Å
246	M	89.1	Confident	91.5	Very high	7 Å²	7	40.7 Å²	40.7	3%	0.034	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-32.6	175.8	-63.5	-170.2	71.5	0	0	113.4	L242 L243 R244 R248 D249 P250 L252 L273 L276 L280 M517	L242-M246 WeakPolarHBondContact O-CG 3.42Å; L242-M246 PolarHBondContact O-N 2.95Å; L243-M246 WeakPolarHBondContact O-CB 3.32Å; L243-M246 PolarHBondContact O-N 3.02Å; L243-M246 VanDerWaalsContact O-N 3.13Å; R244-M246 VanDerWaalsContact C-N 3.32Å; M246-R248 PolarHBondContact O-N 3.44Å; M246-D249 WeakPolarHBondContact CA-O 3.09Å; M246-D249 CarbonylContact O-C 3.29Å; M246-D249 VanDerWaalsContact O-C 3.3Å; M246-P250 WeakPolarHBondContact O-CA 3.35Å; M246-L252 HydrophobicContact CB-CD2 4.46Å; M246-L252 HydrophobicContact CE-CD1 4.3Å; M246-L252 HydrophobicContact CG-CD1 3.54Å; M246-L252 HydrophobicContact CG-CD2 3.61Å; M246-L252 HydrophobicContact CG-CG 3.59Å; M246-L252 HydrophobicContact SD-CD1 3.85Å; M246-L252 HydrophobicContact SD-CG 4.45Å; M246-L273 HydrophobicContact SD-CD2 3.84Å; M246-L276 HydrophobicContact CE-CB 3.73Å; M246-L276 HydrophobicContact CE-CD1 4.32Å; M246-L276 HydrophobicContact CE-CG 4.49Å; M246-L276 HydrophobicContact SD-CB 4.09Å; M246-L276 HydrophobicContact SD-CD1 4Å; M246-L280 HydrophobicContact CE-CD2 4.28Å; M246-M517 HydrophobicContact CB-SD 4.38Å
247	Q	83.3	Confident	91.5	Very high	35 Å²	35	40.7 Å²	40.7	16%	0.164	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-31.7	175.8	-69.8	164.8	-2.3	0	0	113	L243 R244 Q245 M517	L243-Q247 PolarHBondContact O-N 3.36Å; L243-Q247 VanDerWaalsContact O-N 3.17Å; R244-Q247 PolarHBondContact O-N 2.61Å; Q245-Q247 VanDerWaalsContact C-N 3.29Å; Q245-Q247 PolarHBondContact O-N 2.93Å; Q247-M517 HydrophobicContact CG-CG 3.94Å; Q247-M517 HydrophobicContact CG-SD 4.06Å
248	R	82.9	Confident	91.6	Very high	157 Å²	157	40.7 Å²	40.7	59%	0.592	21%	0.206	S	C	*	.	H	α-helix	trans	-94.8	-35.7	-178.7	-66.3	179	176.2	179.5	-7.9	112.4	Q245 M246	Q245-R248 PolarHBondContact O-N 2.86Å; Q245-R248 VanDerWaalsContact O-N 3.11Å; M246-R248 PolarHBondContact O-N 3.44Å
249	D	89.9	Confident	91.7	Very high	40 Å²	40	39.5 Å²	39.5	21%	0.214	20%	0.198	C	C	.	.			trans	-128.7	84.6	176.1	177.1	16.7	0	0	0	108.5	Q245 M246 F251 L252 N253	Q245-D249 PolarHBondContact O-N 3.49Å; M246-D249 WeakPolarHBondContact CA-O 3.09Å; M246-D249 CarbonylContact O-C 3.29Å; M246-D249 VanDerWaalsContact O-C 3.3Å; D249-F251 PolarHBondContact O-N 3.04Å; D249-F251 PolarHBondContact OD1-N 3.09Å; D249-L252 PolarHBondContact O-N 3.28Å; D249-L252 PolarHBondContact OD1-N 3.24Å; D249-L252 VanDerWaalsContact OD2-CA 3.32Å; D249-L252 WeakPolarHBondContact OD2-CA 3.23Å; D249-N253 PolarHBondContact OD1-ND2 3.08Å; D249-N253 PolarHBondContact OD2-N 3.02Å
250	P	87.7	Confident	91.9	Very high	71 Å²	71	39.2 Å²	39.2	46%	0.461	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-23	-177.3	-27.6	36	0	0	0	114.2	M246	M246-P250 WeakPolarHBondContact O-CA 3.35Å
251	F	92	Very high	92.1	Very high	104 Å²	104	37.6 Å²	37.6	46%	0.456	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-4.6	-178.2	-61.2	-72.5	0	0	0	113.9	D249 N253 L280 V283 R284	D249-F251 PolarHBondContact O-N 3.04Å; D249-F251 PolarHBondContact OD1-N 3.09Å; F251-N253 PolarHBondContact O-N 2.95Å; F251-L280 HydrophobicContact CD1-CD1 4.35Å; F251-V283 HydrophobicContact CD1-CG2 3.95Å; F251-V283 HydrophobicContact CE1-CB 4.33Å; F251-V283 HydrophobicContact CE1-CG2 3.92Å; F251-R284 VanDerWaalsContact O-CD 3.27Å; F251-R284 WeakPolarHBondContact O-CD 3.34Å
252	L	94.3	Very high	92.2	Very high	3 Å²	3	37 Å²	37	2%	0.016	18%	0.177	C	C	.	.			trans	46.3	48.6	-178	-68.3	-179.5	0	0	0	112.7	L242 Q245 M246 D249 D254 Y255 I258 L280	L242-L252 HydrophobicContact CD1-CD1 3.86Å; L242-L252 HydrophobicContact CD1-CD2 4.05Å; L242-L252 HydrophobicContact CG-CD1 4.27Å; Q245-L252 HydrophobicContact CB-CD2 3.9Å; M246-L252 HydrophobicContact CB-CD2 4.46Å; M246-L252 HydrophobicContact CE-CD1 4.3Å; M246-L252 HydrophobicContact CG-CD1 3.54Å; M246-L252 HydrophobicContact CG-CD2 3.61Å; M246-L252 HydrophobicContact CG-CG 3.59Å; M246-L252 HydrophobicContact SD-CD1 3.85Å; M246-L252 HydrophobicContact SD-CG 4.45Å; D249-L252 PolarHBondContact O-N 3.28Å; D249-L252 PolarHBondContact OD1-N 3.24Å; D249-L252 VanDerWaalsContact OD2-CA 3.32Å; D249-L252 WeakPolarHBondContact OD2-CA 3.23Å; L252-D254 PolarHBondContact O-N 3.06Å; L252-Y255 HydrophobicContact CB-CD2 4.2Å; L252-Y255 HydrophobicContact CD2-CD2 4.5Å; L252-Y255 HydrophobicContact CD2-CE2 4.44Å; L252-Y255 PolarHBondContact O-N 3.02Å; L252-I258 HydrophobicContact CD1-CD1 3.61Å; L252-L280 HydrophobicContact CB-CD2 4.36Å; L252-L280 HydrophobicContact CD1-CD2 4.09Å; L252-L280 HydrophobicContact CG-CD2 4.45Å
253	N	93.5	Very high	92.1	Very high	89 Å²	89	37 Å²	37	48%	0.476	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-22.8	-172.2	-69	-57.6	0	0	0	113.7	D249 F251 Y255 R284	D249-N253 PolarHBondContact OD1-ND2 3.08Å; D249-N253 PolarHBondContact OD2-N 3.02Å; F251-N253 PolarHBondContact O-N 2.95Å; N253-Y255 PolarHBondContact O-N 3.41Å; N253-R284 PolarHBondContact OD1-NH1 3.34Å
254	D	92	Very high	92.1	Very high	81 Å²	81	38.4 Å²	38.4	43%	0.433	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.6	177	-95.2	6.6	0	0	0	114.2	N188 R228 L252	N188-D254 WeakPolarHBondContact CB-O 3.44Å; N188-D254 PolarHBondContact ND2-O 3.12Å; R228-D254 IonicContact CZ-OD2 3.65Å; R228-D254 IonicContact NH1-OD2 3.68Å; R228-D254 IonicContact NH2-OD2 3.04Å; R228-D254 PolarHBondContact NH2-OD2 2.91Å; L252-D254 PolarHBondContact O-N 3.06Å
255	Y	97.2	Very high	92.2	Very high	13 Å²	13	37 Å²	37	5%	0.051	18%	0.179	C	C	.	.			trans	-119.6	133.1	-171.6	-56.2	-67.3	0	0	0	113.5	A190 R228 L235 L242 Q245 L252 N253	A190-Y255 HydrophobicContact CB-CD1 3.6Å; A190-Y255 HydrophobicContact CB-CD2 4.27Å; A190-Y255 HydrophobicContact CB-CE1 3.72Å; A190-Y255 HydrophobicContact CB-CE2 4.38Å; A190-Y255 HydrophobicContact CB-CG 3.89Å; R228-Y255 PolarHBondContact NH1-OH 3.14Å; L235-Y255 HydrophobicContact CD2-CE1 4.19Å; L235-Y255 WeakPolarHBondContact CD2-OH 3.27Å; L242-Y255 HydrophobicContact CD1-CD2 4.45Å; L242-Y255 HydrophobicContact CD1-CE2 3.98Å; Q245-Y255 PolarHBondContact OE1-OH 3Å; L252-Y255 HydrophobicContact CB-CD2 4.2Å; L252-Y255 HydrophobicContact CD2-CD2 4.5Å; L252-Y255 HydrophobicContact CD2-CE2 4.44Å; L252-Y255 PolarHBondContact O-N 3.02Å; N253-Y255 PolarHBondContact O-N 3.41Å
256	D	96.6	Very high	92.2	Very high	58 Å²	58	36.3 Å²	36.3	31%	0.31	18%	0.175	S	C	.	.	S	Bend	trans	-85.6	-33.4	172.1	-49.8	-47.7	0	0	0	111	Y186 Q187 N188 R288	Y186-D256 HydrophobicContact CD1-CB 3.92Å; Q187-D256 PolarHBondContact N-OD2 3.11Å; N188-D256 PolarHBondContact N-OD2 3.29Å; N188-D256 PolarHBondContact O-N 2.8Å; D256-R288 PolarHBondContact O-N 3.37Å; D256-R288 VanDerWaalsContact O-N 3.11Å
257	V	98.1	Very high	92.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.7	-178.8	-167.4	0	0	0	0	110.9	L170 Y186 N188 I189 A190 V259 R288 V290	L170-V257 HydrophobicContact CD1-CG1 3.98Å; Y186-V257 HydrophobicContact CD1-CG2 3.2Å; Y186-V257 HydrophobicContact CD2-CG2 3.53Å; Y186-V257 HydrophobicContact CE1-CG2 3.67Å; Y186-V257 HydrophobicContact CE2-CG2 3.99Å; Y186-V257 HydrophobicContact CG-CG2 3.11Å; N188-V257 PolarHBondContact O-N 3.12Å; I189-V257 HydrophobicContact CG1-CB 4.43Å; A190-V257 PolarHBondContact N-O 3.19Å; V257-V259 HydrophobicContact CG1-CG2 4.29Å; V257-R288 CarbonylContact C-O 3.3Å; V257-R288 VanDerWaalsContact CA-O 3.27Å; V257-R288 WeakPolarHBondContact CA-O 3.2Å; V257-R288 HydrophobicContact CG1-CB 4.17Å; V257-R288 HydrophobicContact CG2-CB 4.13Å; V257-V290 HydrophobicContact CG1-CG2 4.43Å
258	I	98.3	Very high	92.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.5	169.8	-61.2	170.5	0	0	0	108.6	A190 L242 L252 L260 L280 L287 R288 V289 V290	A190-I258 HydrophobicContact CB-CG1 4.47Å; L242-I258 HydrophobicContact CD2-CG2 4.04Å; L252-I258 HydrophobicContact CD1-CD1 3.61Å; I258-L260 HydrophobicContact CG2-CD2 3.79Å; I258-L260 HydrophobicContact CG2-CG 4.18Å; I258-L280 HydrophobicContact CD1-CD2 4.41Å; I258-L287 HydrophobicContact CD1-CD1 4.23Å; I258-L287 HydrophobicContact CD1-CD2 4.16Å; I258-L287 HydrophobicContact CG1-CD1 4.21Å; I258-R288 PolarHBondContact N-O 2.9Å; I258-V289 CarbonylContact O-C 3.55Å; I258-V289 VanDerWaalsContact O-CA 3.28Å; I258-V289 WeakPolarHBondContact O-CA 3.28Å; I258-V290 PolarHBondContact O-N 3.07Å
259	V	98.4	Very high	93.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.1	173.6	-175.5	0	0	0	0	107.9	L170 I189 A190 V191 T192 V257 V290 M292	L170-V259 HydrophobicContact CD1-CG2 3.53Å; I189-V259 HydrophobicContact CG2-CG2 4.14Å; A190-V259 PolarHBondContact O-N 3.17Å; V191-V259 CarbonylContact C-O 3.54Å; V191-V259 WeakPolarHBondContact CA-O 3.3Å; V191-V259 HydrophobicContact CB-CB 4.37Å; V191-V259 HydrophobicContact CG1-CB 4.17Å; V191-V259 HydrophobicContact CG1-CG1 4.19Å; V191-V259 HydrophobicContact CG2-CB 4.14Å; V191-V259 HydrophobicContact CG2-CG2 4.29Å; T192-V259 PolarHBondContact N-O 3.1Å; T192-V259 PolarHBondContact OG1-O 2.98Å; V257-V259 HydrophobicContact CG1-CG2 4.29Å; V259-V290 CarbonylContact C-O 3.57Å; V259-V290 VanDerWaalsContact CA-O 3.31Å; V259-V290 WeakPolarHBondContact CA-O 3.41Å; V259-V290 HydrophobicContact CG1-CB 4.36Å; V259-V290 HydrophobicContact CG2-CB 4.26Å; V259-M292 HydrophobicContact CG1-CE 3.38Å; V259-M292 HydrophobicContact CG1-CG 4.15Å; V259-M292 HydrophobicContact CG1-SD 4Å
260	L	96.9	Very high	93.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	99.4	170.5	-56	-178.7	0	0	0	107.9	T192 I258 V263 L273 L274 V290 L291 M292	T192-L260 HydrophobicContact CG2-CD2 3.79Å; T192-L260 WeakPolarHBondContact OG1-CA 3.3Å; T192-L260 VanDerWaalsContact OG1-CD2 3.28Å; T192-L260 WeakPolarHBondContact OG1-CD2 3.49Å; I258-L260 HydrophobicContact CG2-CD2 3.79Å; I258-L260 HydrophobicContact CG2-CG 4.18Å; L260-V263 HydrophobicContact CB-CG1 3.77Å; L260-V263 WeakPolarHBondContact O-CG1 3.42Å; L260-L273 HydrophobicContact CD2-CD1 4.37Å; L260-L274 HydrophobicContact CD1-CD2 3.66Å; L260-L274 HydrophobicContact CD1-CG 4.29Å; L260-V290 PolarHBondContact N-O 3.05Å; L260-L291 HydrophobicContact CB-CD2 3.81Å; L260-L291 HydrophobicContact CD1-CD2 3.76Å; L260-L291 HydrophobicContact CG-CD2 4.07Å; L260-L291 WeakPolarHBondContact O-CA 3.21Å; L260-M292 PolarHBondContact O-N 3.47Å
261	D	95.2	Very high	93.7	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.131	C	C	.	.			trans	-85.1	156.6	178.4	-160.2	6.8	0	0	0	111.5	S163 T192 Q193 V263 M292	S163-D261 WeakPolarHBondContact CB-OD2 3.47Å; S163-D261 PolarHBondContact OG-OD2 2.72Å; T192-D261 WeakPolarHBondContact O-CB 3.34Å; Q193-D261 PolarHBondContact NE2-OD2 2.97Å; D261-V263 PolarHBondContact O-N 2.78Å; D261-M292 HydrophobicContact CB-CE 3.61Å; D261-M292 VanDerWaalsContact OD1-CB 3.3Å; D261-M292 WeakPolarHBondContact OD1-CB 3.36Å; D261-M292 WeakPolarHBondContact OD1-CE 3.44Å; D261-M292 WeakPolarHBondContact OD2-CE 3.31Å
262	E	91.7	Very high	93.7	Very high	16 Å²	16	22.5 Å²	22.5	8%	0.075	11%	0.109	C	C	.	.			trans	56.1	32.7	173.9	-49.7	-85.6	177.9	0	0	113.6	P194 H264 E265 M292 S428	P194-E262 HydrophobicContact CG-CB 4.48Å; E262-H264 PolarHBondContact O-N 2.78Å; E262-H264 IonicContact OE2-CE1 2.68Å; E262-H264 PolarHBondContact OE2-CE1 3.28Å; E262-H264 IonicContact OE2-NE2 3.5Å; E262-H264 PolarHBondContact OE2-NE2 3.35Å; E262-E265 HydrophobicContact CB-CG 4.2Å; E262-E265 WeakPolarHBondContact O-CB 3.49Å; E262-E265 PolarHBondContact O-N 3.01Å; E262-M292 PolarHBondContact N-O 2.91Å; E262-S428 VanDerWaalsContact CG-OG 3.26Å; E262-S428 WeakPolarHBondContact CG-OG 3.41Å; E262-S428 WeakPolarHBondContact OE1-CA 3.43Å; E262-S428 PolarHBondContact OE1-N 3.18Å; E262-S428 PolarHBondContact OE1-OG 2.83Å
263	V	93	Very high	93.7	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.006	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-58.3	-16.6	-176.7	-61.6	0	0	0	0	114	L260 D261 E265 R266 T270 L291 M292 F301	L260-V263 HydrophobicContact CB-CG1 3.77Å; L260-V263 WeakPolarHBondContact O-CG1 3.42Å; D261-V263 PolarHBondContact O-N 2.78Å; V263-E265 VanDerWaalsContact C-N 3.27Å; V263-E265 PolarHBondContact O-N 2.85Å; V263-R266 WeakPolarHBondContact O-CD 3.18Å; V263-R266 PolarHBondContact O-N 2.71Å; V263-T270 HydrophobicContact CB-CG2 4.34Å; V263-T270 HydrophobicContact CG1-CG2 4.15Å; V263-L291 HydrophobicContact CG1-CB 4.47Å; V263-L291 HydrophobicContact CG1-CD2 4.47Å; V263-M292 PolarHBondContact N-O 3.4Å; V263-F301 HydrophobicContact CB-CE1 3.87Å; V263-F301 HydrophobicContact CB-CZ 3.99Å; V263-F301 HydrophobicContact CG2-CD1 4.2Å; V263-F301 HydrophobicContact CG2-CD2 4.35Å; V263-F301 HydrophobicContact CG2-CE1 3.87Å; V263-F301 HydrophobicContact CG2-CE2 4.03Å; V263-F301 HydrophobicContact CG2-CG 4.43Å; V263-F301 HydrophobicContact CG2-CZ 3.78Å; V263-F301 WeakPolarHBondContact O-CZ 3.22Å
264	H	89	Confident	93.8	Very high	31 Å²	31	18.1 Å²	18.1	14%	0.144	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-74.2	-12.3	175.2	61.7	-88.8	0	0	0	113.9	E262 R266 A294 Q469	E262-H264 PolarHBondContact O-N 2.78Å; E262-H264 IonicContact OE2-CE1 2.68Å; E262-H264 PolarHBondContact OE2-CE1 3.28Å; E262-H264 IonicContact OE2-NE2 3.5Å; E262-H264 PolarHBondContact OE2-NE2 3.35Å; H264-R266 PolarHBondContact O-N 3.31Å; H264-A294 PolarHBondContact ND1-N 3.19Å; H264-Q469 PolarHBondContact CD2-NE2 2.9Å; H264-Q469 PolarHBondContact NE2-NE2 3.11Å
265	E	86.7	Confident	94	Very high	35 Å²	35	14.2 Å²	14.2	16%	0.164	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-68.3	-20.3	171.5	-74.1	-82.3	127.4	0	0	112	R195 E262 V263 H267 T427	R195-E265 IonicContact CZ-OE2 3.37Å; R195-E265 IonicContact NH1-OE2 2.79Å; R195-E265 IonicContact NH2-OE2 3.86Å; R195-E265 PolarHBondContact NH2-OE2 3.1Å; E262-E265 HydrophobicContact CB-CG 4.2Å; E262-E265 WeakPolarHBondContact O-CB 3.49Å; E262-E265 PolarHBondContact O-N 3.01Å; V263-E265 VanDerWaalsContact C-N 3.27Å; V263-E265 PolarHBondContact O-N 2.85Å; E265-H267 VanDerWaalsContact C-N 3.25Å; E265-H267 PolarHBondContact O-N 2.91Å; E265-H267 IonicContact OE2-NE2 3.56Å; E265-T427 HydrophobicContact CG-CG2 4.35Å; E265-T427 WeakPolarHBondContact OE1-CB 3.37Å; E265-T427 WeakPolarHBondContact OE1-CG2 3.42Å; E265-T427 PolarHBondContact OE1-OG1 3.18Å; E265-T427 PolarHBondContact OE2-OG1 3.15Å
266	R	91.2	Very high	93.8	Very high	21 Å²	21	14.2 Å²	14.2	8%	0.079	7%	0.066	C	C	.	.			trans	53.7	41.8	177.6	-57.5	-54.8	-56	-77.4	-9.2	113.3	V263 H264 D271 P500 E501 D529	V263-R266 WeakPolarHBondContact O-CD 3.18Å; V263-R266 PolarHBondContact O-N 2.71Å; H264-R266 PolarHBondContact O-N 3.31Å; R266-D271 IonicContact CZ-OD1 3.53Å; R266-D271 IonicContact CZ-OD2 2.84Å; R266-D271 IonicContact NE-OD1 3.07Å; R266-D271 PolarHBondContact NE-OD1 2.84Å; R266-D271 IonicContact NE-OD2 2.67Å; R266-D271 PolarHBondContact NE-OD2 3.41Å; R266-D271 IonicContact NH2-OD1 3.73Å; R266-D271 IonicContact NH2-OD2 3.76Å; R266-D271 PolarHBondContact NH2-OD2 3.16Å; R266-P500 HydrophobicContact CB-CB 4.08Å; R266-P500 HydrophobicContact CB-CG 4.46Å; R266-E501 WeakPolarHBondContact O-CB 3.42Å; R266-E501 PolarHBondContact O-N 2.84Å; R266-D529 IonicContact CZ-OD2 3.36Å; R266-D529 IonicContact NH1-OD2 2.65Å; R266-D529 PolarHBondContact NH1-OD2 2.79Å; R266-D529 IonicContact NH2-OD2 2.75Å; R266-D529 PolarHBondContact NH2-OD2 2.93Å
267	H	92	Very high	93.7	Very high	34 Å²	34	11.5 Å²	11.5	16%	0.157	5%	0.051	C	C	.	.			trans	-63.6	141.8	170	-84.9	-71.1	0	0	0	110.9	P194 E265 Q269 T270 D271 E501	P194-H267 WeakPolarHBondContact CB-CD2 3.38Å; P194-H267 WeakPolarHBondContact CB-NE2 3.44Å; E265-H267 VanDerWaalsContact C-N 3.25Å; E265-H267 PolarHBondContact O-N 2.91Å; E265-H267 IonicContact OE2-NE2 3.56Å; H267-Q269 VanDerWaalsContact C-N 3.28Å; H267-Q269 PolarHBondContact O-N 2.78Å; H267-T270 WeakPolarHBondContact O-CB 3.42Å; H267-T270 PolarHBondContact O-N 3.11Å; H267-T270 VanDerWaalsContact O-N 3.11Å; H267-D271 PolarHBondContact O-N 3.03Å; H267-E501 VanDerWaalsContact CA-OE2 3.28Å; H267-E501 WeakPolarHBondContact CA-OE2 3.38Å; H267-E501 IonicContact CE1-OE2 3.3Å; H267-E501 IonicContact CG-OE2 3.91Å; H267-E501 IonicContact ND1-OE2 3.03Å; H267-E501 PolarHBondContact ND1-OE2 3.47Å
268	W	92.1	Very high	93.5	Very high	41 Å²	41	14.1 Å²	14.1	16%	0.155	6%	0.063	C	C	.	.	H	α-helix	trans	-66.3	-32.7	-173.4	74.2	-96.2	0	0	0	112.3	D271 C272 E501 I502 V505 L510	W268-D271 PolarHBondContact O-N 3.09Å; W268-C272 WeakPolarHBondContact O-CB 3.49Å; W268-C272 PolarHBondContact O-N 3.38Å; W268-E501 HydrophobicContact CB-CB 4.35Å; W268-E501 HydrophobicContact CB-CG 4.39Å; W268-E501 PolarHBondContact N-OE2 2.89Å; W268-I502 HydrophobicContact CB-CB 3.94Å; W268-I502 HydrophobicContact CB-CG1 4.35Å; W268-V505 HydrophobicContact CB-CG2 4.12Å; W268-V505 HydrophobicContact CG-CG2 3.94Å; W268-L510 HydrophobicContact CE3-CB 4.25Å; W268-L510 HydrophobicContact CE3-CD1 4.28Å; W268-L510 HydrophobicContact CE3-CD2 4.11Å; W268-L510 HydrophobicContact CE3-CG 4.44Å; W268-L510 HydrophobicContact CH2-CB 4.47Å; W268-L510 HydrophobicContact CZ3-CB 3.79Å; W268-L510 HydrophobicContact CZ3-CD1 3.86Å; W268-L510 HydrophobicContact CZ3-CD2 4.38Å; W268-L510 HydrophobicContact CZ3-CG 4.2Å
269	Q	93	Very high	93.3	Very high	45 Å²	45	16.9 Å²	16.9	21%	0.21	8%	0.082	C	C	.	.	H	α-helix	trans	-67.1	-40.4	174.1	-64	93.7	-18.2	0	0	111.5	E239 L243 H267 C272 L273	E239-Q269 HydrophobicContact CB-CB 3.72Å; L243-Q269 HydrophobicContact CD1-CB 3.67Å; L243-Q269 HydrophobicContact CD1-CG 3.85Å; H267-Q269 VanDerWaalsContact C-N 3.28Å; H267-Q269 PolarHBondContact O-N 2.78Å; Q269-C272 PolarHBondContact O-N 3.09Å; Q269-L273 WeakPolarHBondContact O-CB 3.46Å; Q269-L273 WeakPolarHBondContact O-CG 3.41Å; Q269-L273 PolarHBondContact O-N 3.36Å
270	T	93.5	Very high	93.1	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.012	8%	0.083	C	C	.	.	H	α-helix	trans	-58.9	-49.3	171.4	-72.3	0	0	0	0	111	E239 V263 H267 C272 L273 L274	E239-T270 PolarHBondContact OE1-OG1 3.42Å; E239-T270 PolarHBondContact OE2-N 3.09Å; E239-T270 PolarHBondContact OE2-OG1 2.87Å; V263-T270 HydrophobicContact CB-CG2 4.34Å; V263-T270 HydrophobicContact CG1-CG2 4.15Å; H267-T270 WeakPolarHBondContact O-CB 3.42Å; H267-T270 PolarHBondContact O-N 3.11Å; H267-T270 VanDerWaalsContact O-N 3.11Å; T270-C272 VanDerWaalsContact C-N 3.3Å; T270-C272 PolarHBondContact O-N 2.97Å; T270-L273 CarbonylContact O-C 3.57Å; T270-L273 WeakPolarHBondContact O-CA 3.47Å; T270-L273 WeakPolarHBondContact O-CB 3.29Å; T270-L273 PolarHBondContact O-N 2.98Å; T270-L273 VanDerWaalsContact O-N 3.09Å; T270-L274 HydrophobicContact CG2-CD1 3.97Å; T270-L274 HydrophobicContact CG2-CG 4.2Å; T270-L274 VanDerWaalsContact O-CG 3.3Å; T270-L274 WeakPolarHBondContact O-CG 3.18Å; T270-L274 PolarHBondContact O-N 2.74Å
271	D	93.2	Very high	93	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-61.4	-38.8	-179.1	-81.7	16.2	0	0	0	111.8	R266 H267 W268 L274 G275 I502 I528	R266-D271 IonicContact CZ-OD1 3.53Å; R266-D271 IonicContact CZ-OD2 2.84Å; R266-D271 IonicContact NE-OD1 3.07Å; R266-D271 PolarHBondContact NE-OD1 2.84Å; R266-D271 IonicContact NE-OD2 2.67Å; R266-D271 PolarHBondContact NE-OD2 3.41Å; R266-D271 IonicContact NH2-OD1 3.73Å; R266-D271 IonicContact NH2-OD2 3.76Å; R266-D271 PolarHBondContact NH2-OD2 3.16Å; H267-D271 PolarHBondContact O-N 3.03Å; W268-D271 PolarHBondContact O-N 3.09Å; D271-L274 PolarHBondContact O-N 3.39Å; D271-G275 PolarHBondContact O-N 2.75Å; D271-I502 HydrophobicContact CB-CD1 4.49Å; D271-I528 HydrophobicContact CB-CG2 4.2Å
272	C	92.8	Very high	92.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.7	-47.7	170.9	179.2	0	0	0	0	111.9	L243 W268 Q269 T270 L274 G275 L276 L510	L243-C272 HydrophobicContact CD2-CB 4.4Å; W268-C272 WeakPolarHBondContact O-CB 3.49Å; W268-C272 PolarHBondContact O-N 3.38Å; Q269-C272 PolarHBondContact O-N 3.09Å; T270-C272 VanDerWaalsContact C-N 3.3Å; T270-C272 PolarHBondContact O-N 2.97Å; C272-L274 VanDerWaalsContact C-N 3.29Å; C272-L274 PolarHBondContact O-N 3.31Å; C272-G275 PolarHBondContact O-N 2.99Å; C272-L276 WeakPolarHBondContact O-CG 3.4Å; C272-L276 PolarHBondContact O-N 3.16Å; C272-L510 HydrophobicContact CB-CD1 3.82Å; C272-L510 WeakPolarHBondContact SG-CD1 3.37Å
273	L	94.4	Very high	93	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.4	-39.1	176.5	-79.1	170.2	0	0	0	111.9	T192 E239 L242 L243 M246 L260 Q269 T270 G275 L276 V277	T192-L273 HydrophobicContact CG2-CD1 4.5Å; E239-L273 HydrophobicContact CB-CD1 3.77Å; E239-L273 HydrophobicContact CG-CD1 4.08Å; L242-L273 HydrophobicContact CB-CD1 4.45Å; L242-L273 HydrophobicContact CB-CD2 4.37Å; L242-L273 HydrophobicContact CD2-CD1 4.32Å; L242-L273 HydrophobicContact CD2-CD2 4.09Å; L242-L273 HydrophobicContact CG-CD2 4.14Å; L243-L273 HydrophobicContact CD1-CG 4.45Å; L243-L273 HydrophobicContact CD2-CD2 3.48Å; L243-L273 VanDerWaalsContact CD2-CD2 3.48Å; L243-L273 HydrophobicContact CD2-CG 3.64Å; L243-L273 HydrophobicContact CG-CD1 4.34Å; L243-L273 HydrophobicContact CG-CD2 3.74Å; L243-L273 HydrophobicContact CG-CG 3.73Å; M246-L273 HydrophobicContact SD-CD2 3.84Å; L260-L273 HydrophobicContact CD2-CD1 4.37Å; Q269-L273 WeakPolarHBondContact O-CB 3.46Å; Q269-L273 WeakPolarHBondContact O-CG 3.41Å; Q269-L273 PolarHBondContact O-N 3.36Å; T270-L273 CarbonylContact O-C 3.57Å; T270-L273 WeakPolarHBondContact O-CA 3.47Å; T270-L273 WeakPolarHBondContact O-CB 3.29Å; T270-L273 PolarHBondContact O-N 2.98Å; T270-L273 VanDerWaalsContact O-N 3.09Å; L273-G275 PolarHBondContact O-N 2.9Å; L273-L276 PolarHBondContact O-N 2.96Å; L273-V277 WeakPolarHBondContact O-CB 3.47Å; L273-V277 WeakPolarHBondContact O-CG2 3.5Å; L273-V277 PolarHBondContact O-N 3.44Å
274	L	95.7	Very high	93.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.9	-46	177.7	-70.4	167.8	0	0	0	111	L260 T270 D271 C272 K278 L291 F301 F304 F305 I528	L260-L274 HydrophobicContact CD1-CD2 3.66Å; L260-L274 HydrophobicContact CD1-CG 4.29Å; T270-L274 HydrophobicContact CG2-CD1 3.97Å; T270-L274 HydrophobicContact CG2-CG 4.2Å; T270-L274 VanDerWaalsContact O-CG 3.3Å; T270-L274 WeakPolarHBondContact O-CG 3.18Å; T270-L274 PolarHBondContact O-N 2.74Å; D271-L274 PolarHBondContact O-N 3.39Å; C272-L274 VanDerWaalsContact C-N 3.29Å; C272-L274 PolarHBondContact O-N 3.31Å; L274-K278 WeakPolarHBondContact O-CB 3.38Å; L274-K278 PolarHBondContact O-N 3.29Å; L274-L291 HydrophobicContact CD2-CD1 4.23Å; L274-L291 HydrophobicContact CD2-CD2 3.85Å; L274-F301 HydrophobicContact CD1-CD1 4.1Å; L274-F301 HydrophobicContact CD1-CE1 3.71Å; L274-F304 HydrophobicContact CB-CE1 4.1Å; L274-F305 HydrophobicContact CD2-CE2 3.81Å; L274-F305 HydrophobicContact CD2-CZ 4.14Å; L274-I528 HydrophobicContact CD1-CD1 4.32Å; L274-I528 HydrophobicContact CD1-CG2 4.22Å
275	G	94.6	Very high	93.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-43.5	175.7	0	0	0	0	0	113.1	D271 C272 L273 K278 C279 F525 P526	D271-G275 PolarHBondContact O-N 2.75Å; C272-G275 PolarHBondContact O-N 2.99Å; L273-G275 PolarHBondContact O-N 2.9Å; G275-K278 WeakPolarHBondContact O-CB 3.19Å; G275-K278 PolarHBondContact O-N 3.47Å; G275-C279 PolarHBondContact O-N 3.42Å; G275-C279 PolarHBondContact O-SG 2.91Å; G275-F525 VanDerWaalsContact C-CZ 3.49Å; G275-P526 WeakPolarHBondContact CA-O 3.45Å
276	L	93.3	Very high	93.8	Very high	13 Å²	13	39.6 Å²	39.6	7%	0.068	20%	0.204	C	C	.	.	H	α-helix	trans	-66	-42.6	177.9	-69.6	170.1	0	0	0	111.9	L243 M246 C272 L273 K278 C279 L280 M517 L519 F525	L243-L276 HydrophobicContact CD2-CD1 3.4Å; L243-L276 VanDerWaalsContact CD2-CD1 3.4Å; M246-L276 HydrophobicContact CE-CB 3.73Å; M246-L276 HydrophobicContact CE-CD1 4.32Å; M246-L276 HydrophobicContact CE-CG 4.49Å; M246-L276 HydrophobicContact SD-CB 4.09Å; M246-L276 HydrophobicContact SD-CD1 4Å; C272-L276 WeakPolarHBondContact O-CG 3.4Å; C272-L276 PolarHBondContact O-N 3.16Å; L273-L276 PolarHBondContact O-N 2.96Å; L276-K278 VanDerWaalsContact C-N 3.31Å; L276-K278 PolarHBondContact O-N 2.89Å; L276-C279 WeakPolarHBondContact O-CB 3.49Å; L276-C279 PolarHBondContact O-N 2.62Å; L276-L280 WeakPolarHBondContact O-CB 3.48Å; L276-L280 PolarHBondContact O-N 3.45Å; L276-M517 HydrophobicContact CD1-CE 3.88Å; L276-M517 HydrophobicContact CD1-SD 4.19Å; L276-M517 HydrophobicContact CD2-CE 3.94Å; L276-M517 HydrophobicContact CD2-SD 4.29Å; L276-L519 HydrophobicContact CD2-CD1 3.64Å; L276-F525 HydrophobicContact CD2-CE2 3.93Å; L276-F525 HydrophobicContact CD2-CZ 4.2Å; L276-F525 HydrophobicContact CG-CE2 4.27Å; L276-F525 HydrophobicContact CG-CZ 4.02Å
277	V	94.9	Very high	94.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-37.3	176.9	169.6	0	0	0	0	110.5	L273 C279 L280 I281 V289 F305	L273-V277 WeakPolarHBondContact O-CB 3.47Å; L273-V277 WeakPolarHBondContact O-CG2 3.5Å; L273-V277 PolarHBondContact O-N 3.44Å; V277-C279 VanDerWaalsContact C-N 3.28Å; V277-C279 PolarHBondContact O-N 3.32Å; V277-L280 PolarHBondContact O-N 2.96Å; V277-L280 VanDerWaalsContact O-N 3.08Å; V277-I281 HydrophobicContact CG1-CG2 4.12Å; V277-I281 WeakPolarHBondContact O-CG1 3.47Å; V277-I281 WeakPolarHBondContact O-CG2 3.45Å; V277-I281 PolarHBondContact O-N 3.32Å; V277-V289 HydrophobicContact CG1-CB 4.43Å; V277-V289 HydrophobicContact CG1-CG1 3.99Å; V277-V289 HydrophobicContact CG1-CG2 3.63Å; V277-F305 HydrophobicContact CG1-CE1 4.35Å; V277-F305 HydrophobicContact CG1-CZ 4.45Å
278	K	94.9	Very high	94.4	Very high	56 Å²	56	39.3 Å²	39.3	24%	0.243	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-38	173	-177.9	170.4	177.1	169.8	0	112.3	L274 G275 L276 I281 F304 F305 P526	L274-K278 WeakPolarHBondContact O-CB 3.38Å; L274-K278 PolarHBondContact O-N 3.29Å; G275-K278 WeakPolarHBondContact O-CB 3.19Å; G275-K278 PolarHBondContact O-N 3.47Å; L276-K278 VanDerWaalsContact C-N 3.31Å; L276-K278 PolarHBondContact O-N 2.89Å; K278-I281 VanDerWaalsContact O-CG1 3.3Å; K278-I281 WeakPolarHBondContact O-CG1 3.26Å; K278-F304 HydrophobicContact CB-CE1 3.98Å; K278-F304 HydrophobicContact CB-CZ 4.21Å; K278-F304 HydrophobicContact CD-CD1 4.16Å; K278-F304 HydrophobicContact CD-CD2 4.45Å; K278-F304 HydrophobicContact CD-CE1 3.62Å; K278-F304 HydrophobicContact CD-CE2 3.94Å; K278-F304 HydrophobicContact CD-CZ 3.5Å; K278-F304 VanDerWaalsContact CD-CZ 3.5Å; K278-F304 WeakPolarHBondContact CD-O 3.32Å; K278-F304 VanDerWaalsContact CE-O 3.25Å; K278-F304 WeakPolarHBondContact CE-O 3.42Å; K278-F304 HydrophobicContact CG-CE1 4.4Å; K278-F304 PolarHBondContact NZ-O 2.92Å; K278-F305 HydrophobicContact CB-CD1 4.41Å; K278-F305 HydrophobicContact CB-CE1 3.8Å; K278-F305 HydrophobicContact CB-CZ 4.38Å; K278-F305 HydrophobicContact CG-CE1 4.43Å; K278-P526 HydrophobicContact CD-CB 4.24Å
279	C	92.5	Very high	94.6	Very high	58 Å²	58	37.3 Å²	37.3	39%	0.392	19%	0.194	S	C	.	.	H	α-helix	trans	-70.8	-42.2	170.9	-61.5	0	0	0	0	111.8	G275 L276 V277 I281 V282	G275-C279 PolarHBondContact O-N 3.42Å; G275-C279 PolarHBondContact O-SG 2.91Å; L276-C279 WeakPolarHBondContact O-CB 3.49Å; L276-C279 PolarHBondContact O-N 2.62Å; V277-C279 VanDerWaalsContact C-N 3.28Å; V277-C279 PolarHBondContact O-N 3.32Å; C279-I281 PolarHBondContact O-N 3.09Å; C279-V282 WeakPolarHBondContact O-CB 3.25Å; C279-V282 PolarHBondContact O-N 3.06Å
280	L	94	Very high	94.9	Very high	7 Å²	7	35.2 Å²	35.2	4%	0.037	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-39.6	-175.1	-175.9	61.5	0	0	0	113.4	M246 F251 L252 I258 L276 V277 V282 V283 R284 L287	M246-L280 HydrophobicContact CE-CD2 4.28Å; F251-L280 HydrophobicContact CD1-CD1 4.35Å; L252-L280 HydrophobicContact CB-CD2 4.36Å; L252-L280 HydrophobicContact CD1-CD2 4.09Å; L252-L280 HydrophobicContact CG-CD2 4.45Å; I258-L280 HydrophobicContact CD1-CD2 4.41Å; L276-L280 WeakPolarHBondContact O-CB 3.48Å; L276-L280 PolarHBondContact O-N 3.45Å; V277-L280 PolarHBondContact O-N 2.96Å; V277-L280 VanDerWaalsContact O-N 3.08Å; L280-V282 PolarHBondContact O-N 3.03Å; L280-V283 HydrophobicContact CD1-CG2 4.05Å; L280-V283 WeakPolarHBondContact O-CG2 3.32Å; L280-V283 PolarHBondContact O-N 3.5Å; L280-V283 VanDerWaalsContact O-N 3.14Å; L280-R284 HydrophobicContact CD1-CG 3.85Å; L280-R284 HydrophobicContact CG-CG 4.4Å; L280-R284 WeakPolarHBondContact O-CB 3.31Å; L280-R284 PolarHBondContact O-N 3.4Å; L280-L287 HydrophobicContact CD2-CD2 3.57Å; L280-L287 HydrophobicContact CG-CD2 3.8Å
281	I	95.5	Very high	95.1	Very high	21 Å²	21	35.1 Å²	35.1	11%	0.108	18%	0.184	C	C	.	.	H	α-helix	trans	-63.7	-26.5	-178.2	58.9	174.7	0	0	0	112.9	Q150 V151 V277 K278 C279 R284 V289 F305	Q150-I281 PolarHBondContact NE2-O 3.37Å; V151-I281 HydrophobicContact CG2-CD1 3.75Å; V151-I281 HydrophobicContact CG2-CG2 4.3Å; V277-I281 HydrophobicContact CG1-CG2 4.12Å; V277-I281 WeakPolarHBondContact O-CG1 3.47Å; V277-I281 WeakPolarHBondContact O-CG2 3.45Å; V277-I281 PolarHBondContact O-N 3.32Å; K278-I281 VanDerWaalsContact O-CG1 3.3Å; K278-I281 WeakPolarHBondContact O-CG1 3.26Å; C279-I281 PolarHBondContact O-N 3.09Å; I281-R284 CarbonylContact O-C 3.54Å; I281-V289 HydrophobicContact CG2-CG2 3.75Å; I281-F305 HydrophobicContact CD1-CD1 3.89Å; I281-F305 HydrophobicContact CD1-CE1 4.18Å
282	V	93.4	Very high	95.2	Very high	120 Å²	120	35.1 Å²	35.1	73%	0.727	18%	0.184	S	C	*	.	H	α-helix	trans	-67.1	-41.4	176.4	179.5	0	0	0	0	110.5	C279 L280	C279-V282 WeakPolarHBondContact O-CB 3.25Å; C279-V282 PolarHBondContact O-N 3.06Å; L280-V282 PolarHBondContact O-N 3.03Å
283	V	94	Very high	95.1	Very high	86 Å²	86	35.1 Å²	35.1	52%	0.521	18%	0.184	S	C	.	.	H	α-helix	trans	-88.8	-17.7	-178.5	-63.2	0	0	0	0	113.2	F251 L280 P285	F251-V283 HydrophobicContact CD1-CG2 3.95Å; F251-V283 HydrophobicContact CE1-CB 4.33Å; F251-V283 HydrophobicContact CE1-CG2 3.92Å; L280-V283 HydrophobicContact CD1-CG2 4.05Å; L280-V283 WeakPolarHBondContact O-CG2 3.32Å; L280-V283 PolarHBondContact O-N 3.5Å; L280-V283 VanDerWaalsContact O-N 3.14Å; V283-P285 WeakPolarHBondContact O-CD 3.28Å
284	R	96.6	Very high	94.4	Very high	69 Å²	69	35.4 Å²	35.4	26%	0.26	19%	0.186	S	C	.	.			trans	-118.9	75.2	-179.9	-69.9	-121.5	56.6	156.9	-6.8	111.8	Q150 F251 N253 L280 I281 K286 L287	Q150-R284 PolarHBondContact NE2-O 2.65Å; Q150-R284 VanDerWaalsContact NE2-O 3.09Å; F251-R284 VanDerWaalsContact O-CD 3.27Å; F251-R284 WeakPolarHBondContact O-CD 3.34Å; N253-R284 PolarHBondContact OD1-NH1 3.34Å; L280-R284 HydrophobicContact CD1-CG 3.85Å; L280-R284 HydrophobicContact CG-CG 4.4Å; L280-R284 WeakPolarHBondContact O-CB 3.31Å; L280-R284 PolarHBondContact O-N 3.4Å; I281-R284 CarbonylContact O-C 3.54Å; R284-K286 PolarHBondContact O-N 2.91Å; R284-L287 HydrophobicContact CB-CB 3.77Å; R284-L287 HydrophobicContact CB-CD2 4.34Å; R284-L287 VanDerWaalsContact O-CB 3.31Å; R284-L287 WeakPolarHBondContact O-CB 3.41Å; R284-L287 PolarHBondContact O-N 3.23Å
285	P	94.2	Very high	92.9	Very high	88 Å²	88	37.4 Å²	37.4	57%	0.571	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-22.8	-176.2	23.2	-34.5	0	0	0	114.6	Q150 V283 R288	Q150-P285 VanDerWaalsContact NE2-CA 3.32Å; Q150-P285 PolarHBondContact NE2-O 3.42Å; V283-P285 WeakPolarHBondContact O-CD 3.28Å; P285-R288 PolarHBondContact O-NH1 2.92Å
286	K	94.2	Very high	91.4	Very high	169 Å²	169	39.7 Å²	39.7	74%	0.735	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-19.1	176.5	-63.8	-173.1	-179.5	-179.8	0	113.8	R284 R288	R284-K286 PolarHBondContact O-N 2.91Å; K286-R288 PolarHBondContact O-NH1 3.02Å
287	L	97	Very high	90.5	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	22%	0.221	C	C	.	.			trans	-65.9	140.3	177.9	-179.2	66.9	0	0	0	109.2	I258 L280 R284 V289	I258-L287 HydrophobicContact CD1-CD1 4.23Å; I258-L287 HydrophobicContact CD1-CD2 4.16Å; I258-L287 HydrophobicContact CG1-CD1 4.21Å; L280-L287 HydrophobicContact CD2-CD2 3.57Å; L280-L287 HydrophobicContact CG-CD2 3.8Å; R284-L287 HydrophobicContact CB-CB 3.77Å; R284-L287 HydrophobicContact CB-CD2 4.34Å; R284-L287 VanDerWaalsContact O-CB 3.31Å; R284-L287 WeakPolarHBondContact O-CB 3.41Å; R284-L287 PolarHBondContact O-N 3.23Å; L287-V289 HydrophobicContact CG-CG2 4.49Å
288	R	97.9	Very high	90.2	Very high	45 Å²	45	42.2 Å²	42.2	17%	0.17	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.3	172.9	-61	-62.4	-176.5	-100.3	6.3	110.7	L146 Q150 Y186 D256 V257 I258 P285 K286	L146-R288 HydrophobicContact CD1-CB 3.95Å; L146-R288 HydrophobicContact CD1-CG 4.46Å; L146-R288 HydrophobicContact CD2-CB 4.22Å; L146-R288 HydrophobicContact CG-CB 4.02Å; L146-R288 HydrophobicContact CG-CG 4.19Å; L146-R288 VanDerWaalsContact O-CD 3.26Å; L146-R288 WeakPolarHBondContact O-CD 3.43Å; L146-R288 PolarHBondContact O-NE 3.18Å; Q150-R288 CarbonylContact O-C 3.57Å; Q150-R288 WeakPolarHBondContact O-CA 3.45Å; Y186-R288 HydrophobicContact CE1-CB 4.46Å; Y186-R288 HydrophobicContact CE1-CG 3.9Å; D256-R288 PolarHBondContact O-N 3.37Å; D256-R288 VanDerWaalsContact O-N 3.11Å; V257-R288 CarbonylContact C-O 3.3Å; V257-R288 VanDerWaalsContact CA-O 3.27Å; V257-R288 WeakPolarHBondContact CA-O 3.2Å; V257-R288 HydrophobicContact CG1-CB 4.17Å; V257-R288 HydrophobicContact CG2-CB 4.13Å; I258-R288 PolarHBondContact N-O 2.9Å; P285-R288 PolarHBondContact O-NH1 2.92Å; K286-R288 PolarHBondContact O-NH1 3.02Å
289	V	98.3	Very high	90	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	128.9	-176.7	-177.2	0	0	0	0	109	Q150 V151 V152 I258 V277 I281 L287 L291	Q150-V289 PolarHBondContact O-N 3.3Å; V151-V289 WeakPolarHBondContact CA-O 3.41Å; V151-V289 HydrophobicContact CG1-CB 4.29Å; V151-V289 HydrophobicContact CG1-CG1 4.34Å; V151-V289 HydrophobicContact CG2-CB 4.17Å; V152-V289 PolarHBondContact N-O 3.29Å; I258-V289 CarbonylContact O-C 3.55Å; I258-V289 VanDerWaalsContact O-CA 3.28Å; I258-V289 WeakPolarHBondContact O-CA 3.28Å; V277-V289 HydrophobicContact CG1-CB 4.43Å; V277-V289 HydrophobicContact CG1-CG1 3.99Å; V277-V289 HydrophobicContact CG1-CG2 3.63Å; I281-V289 HydrophobicContact CG2-CG2 3.75Å; L287-V289 HydrophobicContact CG-CG2 4.49Å; V289-L291 HydrophobicContact CG1-CD2 3.86Å
290	V	98.2	Very high	89.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.4	173.2	-177.1	0	0	0	0	108.6	L146 V152 V154 V166 L170 V257 I258 V259 L260 M292	L146-V290 HydrophobicContact CD1-CG2 3.91Å; L146-V290 HydrophobicContact CD2-CG2 3.84Å; V152-V290 WeakPolarHBondContact O-CA 3.43Å; V154-V290 HydrophobicContact CG2-CG1 3.85Å; V166-V290 HydrophobicContact CG1-CG1 4.25Å; L170-V290 HydrophobicContact CD1-CG2 4.43Å; L170-V290 HydrophobicContact CD2-CG2 4.46Å; V257-V290 HydrophobicContact CG1-CG2 4.43Å; I258-V290 PolarHBondContact O-N 3.07Å; V259-V290 CarbonylContact C-O 3.57Å; V259-V290 VanDerWaalsContact CA-O 3.31Å; V259-V290 WeakPolarHBondContact CA-O 3.41Å; V259-V290 HydrophobicContact CG1-CB 4.36Å; V259-V290 HydrophobicContact CG2-CB 4.26Å; L260-V290 PolarHBondContact N-O 3.05Å; V290-M292 HydrophobicContact CG1-CG 3.98Å
291	L	97.2	Very high	89.8	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.9	173	-50.4	-178.7	0	0	0	108.4	V151 V152 I153 V154 L260 V263 L274 V289 F301 F305	V151-L291 HydrophobicContact CG1-CD1 4.4Å; V151-L291 HydrophobicContact CG1-CG 4.41Å; V152-L291 PolarHBondContact O-N 3.05Å; I153-L291 CarbonylContact C-O 3.54Å; I153-L291 WeakPolarHBondContact CA-O 3.4Å; I153-L291 HydrophobicContact CG1-CB 4.05Å; I153-L291 HydrophobicContact CG1-CD1 4.01Å; I153-L291 HydrophobicContact CG1-CG 4.38Å; V154-L291 PolarHBondContact N-O 3.19Å; L260-L291 HydrophobicContact CB-CD2 3.81Å; L260-L291 HydrophobicContact CD1-CD2 3.76Å; L260-L291 HydrophobicContact CG-CD2 4.07Å; L260-L291 WeakPolarHBondContact O-CA 3.21Å; V263-L291 HydrophobicContact CG1-CB 4.47Å; V263-L291 HydrophobicContact CG1-CD2 4.47Å; L274-L291 HydrophobicContact CD2-CD1 4.23Å; L274-L291 HydrophobicContact CD2-CD2 3.85Å; V289-L291 HydrophobicContact CG1-CD2 3.86Å; L291-F301 HydrophobicContact CD1-CB 4.3Å; L291-F305 HydrophobicContact CD1-CD2 3.67Å; L291-F305 HydrophobicContact CD1-CE2 3.55Å
292	M	95.2	Very high	89.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.2	179.1	-57.5	-169.3	-61.5	0	0	111	V154 K162 V166 V259 L260 D261 E262 V263 V290	V154-M292 HydrophobicContact CB-CG 4.32Å; V154-M292 WeakPolarHBondContact O-CA 3.4Å; K162-M292 HydrophobicContact CB-SD 3.92Å; V166-M292 HydrophobicContact CB-SD 3.67Å; V166-M292 HydrophobicContact CG1-SD 3.77Å; V166-M292 HydrophobicContact CG2-SD 3.79Å; V259-M292 HydrophobicContact CG1-CE 3.38Å; V259-M292 HydrophobicContact CG1-CG 4.15Å; V259-M292 HydrophobicContact CG1-SD 4Å; L260-M292 PolarHBondContact O-N 3.47Å; D261-M292 HydrophobicContact CB-CE 3.61Å; D261-M292 VanDerWaalsContact OD1-CB 3.3Å; D261-M292 WeakPolarHBondContact OD1-CB 3.36Å; D261-M292 WeakPolarHBondContact OD1-CE 3.44Å; D261-M292 WeakPolarHBondContact OD2-CE 3.31Å; E262-M292 PolarHBondContact N-O 2.91Å; V263-M292 PolarHBondContact N-O 3.4Å; V290-M292 HydrophobicContact CG1-CG 3.98Å
293	S	90.8	Very high	89.9	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.007	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.6	-178.3	-179.6	0	0	0	0	111.9	V154 A155 G156 K162 T295	V154-S293 PolarHBondContact O-N 2.85Å; A155-S293 WeakPolarHBondContact CA-O 3.32Å; G156-S293 PolarHBondContact N-O 3.03Å; K162-S293 VanDerWaalsContact CE-O 3.27Å; K162-S293 WeakPolarHBondContact CE-O 3.32Å; S293-T295 VanDerWaalsContact C-N 3.31Å; S293-T295 PolarHBondContact O-N 3.47Å
294	A	80.6	Confident	89.9	Confident	6 Å²	6	40.8 Å²	40.8	5%	0.05	20%	0.203	C	C	.	.	S	Bend	trans	-78.7	-10	-177.4	0	0	0	0	0	114.7	G156 H264	G156-A294 CarbonylContact C-O 3.57Å; G156-A294 VanDerWaalsContact C-O 3.32Å; G156-A294 CarbonylContact O-C 3.52Å; G156-A294 VanDerWaalsContact O-C 3.26Å; G156-A294 WeakPolarHBondContact O-CA 3.33Å; H264-A294 PolarHBondContact ND1-N 3.19Å
295	T	63.1	Low	89.9	Confident	41 Å²	41	38 Å²	38	25%	0.252	19%	0.193	S	C	.	.	S	Bend	trans	145.1	-15.9	161.6	47.2	0	0	0	0	113.3	S293	S293-T295 VanDerWaalsContact C-N 3.31Å; S293-T295 PolarHBondContact O-N 3.47Å
296	I	63	Low	89.8	Confident	49 Å²	49	40.2 Å²	40.2	25%	0.251	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	131.7	-163.5	-31.9	-179.7	0	0	0	111.1	V298 A465 F497	I296-V298 PolarHBondContact O-N 3.37Å; I296-A465 VanDerWaalsContact CD1-CA 3.42Å; I296-A465 HydrophobicContact CD1-CB 3.48Å; I296-A465 VanDerWaalsContact CD1-CB 3.48Å; I296-F497 HydrophobicContact CB-CE1 3.68Å; I296-F497 HydrophobicContact CB-CZ 4.44Å; I296-F497 HydrophobicContact CG2-CD1 4.09Å; I296-F497 HydrophobicContact CG2-CE1 3.05Å; I296-F497 HydrophobicContact CG2-CZ 3.42Å; I296-F497 VanDerWaalsContact CG2-CZ 3.42Å
297	N	75.8	Confident	89.8	Confident	53 Å²	53	37.9 Å²	37.9	28%	0.283	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	28.4	-176	-153.5	10.5	0	0	0	117.2	N299 T300 F301 F497	N297-N299 PolarHBondContact O-N 3.4Å; N297-N299 VanDerWaalsContact O-N 3.16Å; N297-T300 PolarHBondContact ND2-OG1 2.92Å; N297-T300 VanDerWaalsContact ND2-OG1 3.15Å; N297-T300 PolarHBondContact O-N 3.32Å; N297-T300 VanDerWaalsContact OD1-CB 3.23Å; N297-T300 WeakPolarHBondContact OD1-CB 3.03Å; N297-T300 PolarHBondContact OD1-OG1 3.34Å; N297-F301 WeakPolarHBondContact O-CD2 3.39Å; N297-F497 HydrophobicContact CB-CD1 4.42Å; N297-F497 HydrophobicContact CB-CE1 3.59Å; N297-F497 HydrophobicContact CB-CZ 3.69Å
298	V	87.3	Confident	89.8	Confident	13 Å²	13	38.3 Å²	38.3	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-56.8	-31.3	178.5	-65.7	0	0	0	0	113.3	I153 A155 I296 T300 F301 A302 I310	I153-V298 HydrophobicContact CG2-CB 4.4Å; I153-V298 HydrophobicContact CG2-CG1 4.35Å; A155-V298 HydrophobicContact CB-CB 4.47Å; A155-V298 HydrophobicContact CB-CG1 3.54Å; I296-V298 PolarHBondContact O-N 3.37Å; V298-T300 VanDerWaalsContact C-N 3.31Å; V298-T300 PolarHBondContact O-N 3.46Å; V298-F301 PolarHBondContact O-N 2.84Å; V298-A302 PolarHBondContact O-N 3.21Å; V298-I310 HydrophobicContact CB-CD1 4.36Å; V298-I310 HydrophobicContact CB-CG2 4.48Å; V298-I310 HydrophobicContact CG2-CD1 4.12Å; V298-I310 HydrophobicContact CG2-CG2 4.39Å
299	N	90.6	Very high	89.7	Confident	102 Å²	102	37.8 Å²	37.8	55%	0.545	20%	0.201	S	C	.	.	H	α-helix	trans	-65.3	-32.1	178.4	-66.7	-23	0	0	0	112.9	N297 A302 K303	N297-N299 PolarHBondContact O-N 3.4Å; N297-N299 VanDerWaalsContact O-N 3.16Å; N299-A302 PolarHBondContact O-N 3.19Å; N299-K303 WeakPolarHBondContact O-CB 3.29Å; N299-K303 VanDerWaalsContact O-CG 3.26Å; N299-K303 WeakPolarHBondContact O-CG 3.38Å; N299-K303 PolarHBondContact O-N 3.49Å
300	T	90.6	Very high	89.6	Confident	44 Å²	44	40.5 Å²	40.5	27%	0.27	22%	0.215	S	C	.	.	H	α-helix	trans	-67.5	-41.7	176	-64.9	0	0	0	0	110.5	N297 V298 F304 I528	N297-T300 PolarHBondContact ND2-OG1 2.92Å; N297-T300 VanDerWaalsContact ND2-OG1 3.15Å; N297-T300 PolarHBondContact O-N 3.32Å; N297-T300 VanDerWaalsContact OD1-CB 3.23Å; N297-T300 WeakPolarHBondContact OD1-CB 3.03Å; N297-T300 PolarHBondContact OD1-OG1 3.34Å; V298-T300 VanDerWaalsContact C-N 3.31Å; V298-T300 PolarHBondContact O-N 3.46Å; T300-F304 VanDerWaalsContact O-CB 3.26Å; T300-F304 WeakPolarHBondContact O-CB 3.5Å; T300-F304 PolarHBondContact O-N 3.01Å; T300-I528 HydrophobicContact CG2-CD1 4.13Å; T300-I528 HydrophobicContact CG2-CG1 4.05Å
301	F	93.2	Very high	89.4	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.013	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-40.5	173.8	-62.9	-80.1	0	0	0	112.1	I153 V263 L274 L291 N297 V298 F304 F305 I528	I153-F301 HydrophobicContact CD1-CB 3.73Å; V263-F301 HydrophobicContact CB-CE1 3.87Å; V263-F301 HydrophobicContact CB-CZ 3.99Å; V263-F301 HydrophobicContact CG2-CD1 4.2Å; V263-F301 HydrophobicContact CG2-CD2 4.35Å; V263-F301 HydrophobicContact CG2-CE1 3.87Å; V263-F301 HydrophobicContact CG2-CE2 4.03Å; V263-F301 HydrophobicContact CG2-CG 4.43Å; V263-F301 HydrophobicContact CG2-CZ 3.78Å; V263-F301 WeakPolarHBondContact O-CZ 3.22Å; L274-F301 HydrophobicContact CD1-CD1 4.1Å; L274-F301 HydrophobicContact CD1-CE1 3.71Å; L291-F301 HydrophobicContact CD1-CB 4.3Å; N297-F301 WeakPolarHBondContact O-CD2 3.39Å; V298-F301 PolarHBondContact O-N 2.84Å; F301-F304 PolarHBondContact O-N 3.34Å; F301-F305 PolarHBondContact O-N 3.12Å; F301-F305 VanDerWaalsContact O-N 3.13Å; F301-I528 HydrophobicContact CD1-CD1 3.35Å; F301-I528 HydrophobicContact CE1-CD1 3.41Å; F301-I528 VanDerWaalsContact CE1-CD1 3.41Å; F301-I528 HydrophobicContact CG-CD1 4.07Å; F301-I528 HydrophobicContact CZ-CD1 4.17Å
302	A	94.7	Very high	89.2	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-52.7	178.6	0	0	0	0	0	110.9	I153 V298 N299 F304 F305 N306 D307 C308 I310	I153-A302 VanDerWaalsContact CD1-CA 3.47Å; I153-A302 HydrophobicContact CD1-CB 3.74Å; I153-A302 VanDerWaalsContact CD1-N 3.27Å; V298-A302 PolarHBondContact O-N 3.21Å; N299-A302 PolarHBondContact O-N 3.19Å; A302-F304 VanDerWaalsContact C-N 3.27Å; A302-F304 PolarHBondContact O-N 3.48Å; A302-F305 CarbonylContact O-C 3.6Å; A302-F305 VanDerWaalsContact O-C 3.29Å; A302-F305 PolarHBondContact O-N 3.12Å; A302-N306 PolarHBondContact O-N 3.39Å; A302-D307 VanDerWaalsContact O-CA 3.27Å; A302-D307 WeakPolarHBondContact O-CA 3.3Å; A302-D307 PolarHBondContact O-N 3.25Å; A302-C308 PolarHBondContact O-N 3.48Å; A302-I310 HydrophobicContact CB-CD1 3.74Å; A302-I310 HydrophobicContact CB-CG1 3.95Å
303	K	95.2	Very high	88.9	Confident	142 Å²	142	44.8 Å²	44.8	62%	0.617	24%	0.235	S	C	*	.	H	α-helix	trans	-56	-41.7	174.9	-74	175.9	180	-174.1	0	112.1	N299 F305 N306 D307	N299-K303 WeakPolarHBondContact O-CB 3.29Å; N299-K303 VanDerWaalsContact O-CG 3.26Å; N299-K303 WeakPolarHBondContact O-CG 3.38Å; N299-K303 PolarHBondContact O-N 3.49Å; K303-F305 PolarHBondContact O-N 3.41Å; K303-N306 PolarHBondContact O-N 3.43Å; K303-N306 VanDerWaalsContact O-N 3.14Å; K303-D307 WeakPolarHBondContact CG-OD1 3.5Å
304	F	95	Very high	88.5	Confident	21 Å²	21	48.9 Å²	48.9	9%	0.092	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-33.6	178.9	-178.8	-98.6	0	0	0	112.6	L274 K278 T300 F301 A302 P526 I528	L274-F304 HydrophobicContact CB-CE1 4.1Å; K278-F304 HydrophobicContact CB-CE1 3.98Å; K278-F304 HydrophobicContact CB-CZ 4.21Å; K278-F304 HydrophobicContact CD-CD1 4.16Å; K278-F304 HydrophobicContact CD-CD2 4.45Å; K278-F304 HydrophobicContact CD-CE1 3.62Å; K278-F304 HydrophobicContact CD-CE2 3.94Å; K278-F304 HydrophobicContact CD-CZ 3.5Å; K278-F304 VanDerWaalsContact CD-CZ 3.5Å; K278-F304 WeakPolarHBondContact CD-O 3.32Å; K278-F304 VanDerWaalsContact CE-O 3.25Å; K278-F304 WeakPolarHBondContact CE-O 3.42Å; K278-F304 HydrophobicContact CG-CE1 4.4Å; K278-F304 PolarHBondContact NZ-O 2.92Å; T300-F304 VanDerWaalsContact O-CB 3.26Å; T300-F304 WeakPolarHBondContact O-CB 3.5Å; T300-F304 PolarHBondContact O-N 3.01Å; F301-F304 PolarHBondContact O-N 3.34Å; A302-F304 VanDerWaalsContact C-N 3.27Å; A302-F304 PolarHBondContact O-N 3.48Å; F304-P526 HydrophobicContact CE2-CB 4.36Å; F304-P526 VanDerWaalsContact CE2-O 3.31Å; F304-P526 WeakPolarHBondContact CE2-O 3.37Å; F304-P526 HydrophobicContact CZ-CB 4.43Å; F304-P526 WeakPolarHBondContact CZ-O 3.48Å; F304-I528 HydrophobicContact CB-CD1 4.44Å; F304-I528 HydrophobicContact CB-CG1 4.39Å; F304-I528 HydrophobicContact CD2-CB 4.01Å; F304-I528 HydrophobicContact CD2-CG1 4.22Å; F304-I528 HydrophobicContact CE2-CB 4.12Å; F304-I528 HydrophobicContact CG-CB 4.3Å; F304-I528 HydrophobicContact CG-CG1 4.25Å; F304-I528 HydrophobicContact CZ-CB 4.49Å
305	F	95.8	Very high	87.9	Confident	12 Å²	12	50.6 Å²	50.6	5%	0.053	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	38.4	174	-73.3	-78.8	0	0	0	113.2	V151 L274 V277 K278 I281 L291 F301 A302 K303 C308	V151-F305 HydrophobicContact CB-CB 4.46Å; V151-F305 HydrophobicContact CG1-CB 4.11Å; V151-F305 HydrophobicContact CG1-CD1 4.18Å; V151-F305 HydrophobicContact CG1-CD2 4.25Å; V151-F305 HydrophobicContact CG1-CG 3.94Å; V151-F305 HydrophobicContact CG2-CD1 3.95Å; V151-F305 HydrophobicContact CG2-CE1 4.49Å; V151-F305 HydrophobicContact CG2-CG 4.43Å; L274-F305 HydrophobicContact CD2-CE2 3.81Å; L274-F305 HydrophobicContact CD2-CZ 4.14Å; V277-F305 HydrophobicContact CG1-CE1 4.35Å; V277-F305 HydrophobicContact CG1-CZ 4.45Å; K278-F305 HydrophobicContact CB-CD1 4.41Å; K278-F305 HydrophobicContact CB-CE1 3.8Å; K278-F305 HydrophobicContact CB-CZ 4.38Å; K278-F305 HydrophobicContact CG-CE1 4.43Å; I281-F305 HydrophobicContact CD1-CD1 3.89Å; I281-F305 HydrophobicContact CD1-CE1 4.18Å; L291-F305 HydrophobicContact CD1-CD2 3.67Å; L291-F305 HydrophobicContact CD1-CE2 3.55Å; F301-F305 PolarHBondContact O-N 3.12Å; F301-F305 VanDerWaalsContact O-N 3.13Å; A302-F305 CarbonylContact O-C 3.6Å; A302-F305 VanDerWaalsContact O-C 3.29Å; A302-F305 PolarHBondContact O-N 3.12Å; K303-F305 PolarHBondContact O-N 3.41Å; F305-C308 HydrophobicContact CB-CB 4.1Å
306	N	93.2	Very high	88.3	Confident	134 Å²	134	52.1 Å²	52.1	72%	0.717	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	51.3	175.5	-52.4	-24.3	0	0	0	113.2	A302 K303 C308	A302-N306 PolarHBondContact O-N 3.39Å; K303-N306 PolarHBondContact O-N 3.43Å; K303-N306 VanDerWaalsContact O-N 3.14Å; N306-C308 VanDerWaalsContact C-N 3.3Å; N306-C308 PolarHBondContact O-N 3.04Å
307	D	94.1	Very high	88.6	Confident	120 Å²	120	52.2 Å²	52.2	64%	0.642	28%	0.282	S	S	*	.	S	Bend	trans	54.1	44.5	-179.8	-61.9	-57.9	0	0	0	113	A302 K303	A302-D307 VanDerWaalsContact O-CA 3.27Å; A302-D307 WeakPolarHBondContact O-CA 3.3Å; A302-D307 PolarHBondContact O-N 3.25Å; K303-D307 WeakPolarHBondContact CG-OD1 3.5Å
308	C	95.4	Very high	88.8	Confident	13 Å²	13	54.3 Å²	54.3	9%	0.088	29%	0.286	C	S	.	.			trans	-60.5	151.9	178.5	74.3	0	0	0	0	111.8	V151 I153 A302 F305 N306	V151-C308 HydrophobicContact CB-CB 4.18Å; V151-C308 HydrophobicContact CG1-CB 4.39Å; I153-C308 VanDerWaalsContact CD1-SG 3.56Å; A302-C308 PolarHBondContact O-N 3.48Å; F305-C308 HydrophobicContact CB-CB 4.1Å; N306-C308 VanDerWaalsContact C-N 3.3Å; N306-C308 PolarHBondContact O-N 3.04Å
309	P	97.1	Very high	88.7	Confident	33 Å²	33	58.2 Å²	58.2	21%	0.214	31%	0.312	C	S	.	.			trans	-63.9	139.7	-174.6	26.1	-36.6	0	0	0	112.5	T145 H149 V152 I153	T145-P309 HydrophobicContact CG2-CB 3.74Å; T145-P309 HydrophobicContact CG2-CG 3.48Å; T145-P309 VanDerWaalsContact CG2-CG 3.48Å; H149-P309 HydrophobicContact CB-CG 3.96Å; V152-P309 HydrophobicContact CG2-CG 4.12Å; I153-P309 PolarHBondContact N-O 3.34Å
310	I	95.6	Very high	88.7	Confident	57 Å²	57	54.7 Å²	54.7	29%	0.292	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.8	177.5	-52.1	173.3	0	0	0	108.7	I153 A155 V298 A302	I153-I310 HydrophobicContact CB-CG1 4.33Å; I153-I310 HydrophobicContact CB-CG2 4.46Å; I153-I310 HydrophobicContact CD1-CG1 4.27Å; I153-I310 HydrophobicContact CG2-CG2 4.27Å; A155-I310 HydrophobicContact CB-CG2 4.24Å; V298-I310 HydrophobicContact CB-CD1 4.36Å; V298-I310 HydrophobicContact CB-CG2 4.48Å; V298-I310 HydrophobicContact CG2-CD1 4.12Å; V298-I310 HydrophobicContact CG2-CG2 4.39Å; A302-I310 HydrophobicContact CB-CD1 3.74Å; A302-I310 HydrophobicContact CB-CG1 3.95Å
311	I	95	Very high	88.9	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.015	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	103.8	168.9	-60.6	171.2	0	0	0	107.6	F138 E141 L142 V152 I153 A155 V313	F138-I311 HydrophobicContact CB-CG2 4.14Å; F138-I311 HydrophobicContact CD1-CG2 3.72Å; F138-I311 HydrophobicContact CG-CG2 4.2Å; E141-I311 HydrophobicContact CG-CD1 4.29Å; E141-I311 HydrophobicContact CG-CG1 4.45Å; L142-I311 VanDerWaalsContact CA-CD1 3.46Å; L142-I311 HydrophobicContact CB-CD1 4.02Å; L142-I311 HydrophobicContact CD1-CD1 3.94Å; V152-I311 HydrophobicContact CG1-CD1 3.77Å; V152-I311 HydrophobicContact CG1-CG1 4.12Å; I153-I311 PolarHBondContact O-N 3.35Å; A155-I311 PolarHBondContact N-O 3.14Å; I311-V313 HydrophobicContact CG2-CG2 4.31Å
312	Q	92	Very high	89.1	Confident	88 Å²	88	59.2 Å²	59.2	41%	0.411	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	111.9	178.5	-169	75.1	23.9	0	0	109.4	A155 P314	A155-Q312 CarbonylContact O-C 3.5Å; A155-Q312 WeakPolarHBondContact O-CA 3.22Å; Q312-P314 VanDerWaalsContact O-CD 3.26Å; Q312-P314 WeakPolarHBondContact O-CD 3.1Å
313	V	89.4	Confident	89.2	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	105.6	177.9	-177	0	0	0	0	108	P134 I135 F138 V154 A155 G156 C160 I311	P134-V313 HydrophobicContact CB-CG1 3.73Å; I135-V313 HydrophobicContact CD1-CG2 3.54Å; F138-V313 HydrophobicContact CB-CG2 4.38Å; F138-V313 HydrophobicContact CD2-CB 4.37Å; F138-V313 HydrophobicContact CD2-CG1 3.98Å; F138-V313 HydrophobicContact CD2-CG2 4.01Å; F138-V313 HydrophobicContact CE2-CB 4.46Å; F138-V313 HydrophobicContact CE2-CG1 4.09Å; F138-V313 HydrophobicContact CG-CG2 4.08Å; V154-V313 HydrophobicContact CG1-CG2 4.28Å; A155-V313 PolarHBondContact O-N 3.28Å; G156-V313 WeakPolarHBondContact CA-O 3.46Å; C160-V313 HydrophobicContact CB-CG1 4.22Å; I311-V313 HydrophobicContact CG2-CG2 4.31Å
314	P	81.3	Confident	89.2	Confident	86 Å²	86	57.8 Å²	57.8	56%	0.558	31%	0.308	S	S	*	.			trans	-74.3	151.8	-176.7	31.2	-34.8	0	0	0	111.6	F138 Q312	F138-P314 VanDerWaalsContact CZ-CD 3.49Å; F138-P314 HydrophobicContact CZ-CG 4.34Å; Q312-P314 VanDerWaalsContact O-CD 3.26Å; Q312-P314 WeakPolarHBondContact O-CD 3.1Å
315	G	67.9	Low	89.2	Confident	42 Å²	42	59 Å²	59	43%	0.433	32%	0.315	S	S	.	.			trans	80.3	-178.6	161.7	0	0	0	0	0	116
316	R	72.5	Confident	88.9	Confident	73 Å²	73	61.7 Å²	61.7	28%	0.275	33%	0.333	S	S	.	.			trans	-130.6	163.1	-177	-47.8	-178.8	177.8	-150.4	-14.3	107.3	D157 Y318	D157-R316 HydrophobicContact CB-CG 4.18Å; D157-R316 IonicContact OD2-CZ 3.22Å; D157-R316 VanDerWaalsContact OD2-CZ 3.25Å; D157-R316 IonicContact OD2-NE 2.87Å; D157-R316 PolarHBondContact OD2-NE 3.36Å; D157-R316 IonicContact OD2-NH2 3.16Å; D157-R316 PolarHBondContact OD2-NH2 2.92Å; R316-Y318 VanDerWaalsContact C-N 3.29Å
317	L	68.3	Low	88.5	Confident	51 Å²	51	57.3 Å²	57.3	27%	0.267	31%	0.309	S	S	.	.	S	Bend	trans	-65.3	-36.2	171.4	-73.2	168.9	0	0	0	111.8	V132 L133 R476	V132-L317 HydrophobicContact CG1-CD2 3.84Å; V132-L317 WeakPolarHBondContact O-CD2 3.25Å; L133-L317 HydrophobicContact CD2-CD1 3.88Å; L133-L317 HydrophobicContact CD2-CG 4.5Å; L317-R476 VanDerWaalsContact CD1-O 3.27Å; L317-R476 WeakPolarHBondContact CD1-O 3.47Å
318	Y	80.4	Confident	88.1	Confident	97 Å²	97	53.7 Å²	53.7	38%	0.38	29%	0.294	S	S	.	.	S	Bend	trans	-143	152.3	-176.6	-57.9	-83	0	0	0	112.6	R316 G475 G478 P479	R316-Y318 VanDerWaalsContact C-N 3.29Å; Y318-G475 WeakPolarHBondContact CB-O 3.17Å; Y318-G475 PolarHBondContact N-O 3Å; Y318-G478 VanDerWaalsContact CB-C 3.41Å; Y318-G478 WeakPolarHBondContact CB-O 3.25Å; Y318-G478 VanDerWaalsContact CD2-CA 3.5Å; Y318-G478 VanDerWaalsContact CG-C 3.41Å; Y318-P479 HydrophobicContact CD1-CG 4.44Å
319	P	85.6	Confident	87.1	Confident	95 Å²	95	58.2 Å²	58.2	62%	0.617	32%	0.323	S	S	*	.			trans	-70.4	159.6	176.8	30.5	-35.8	0	0	0	111.9	G480	P319-G480 PolarHBondContact O-N 2.97Å
320	I	90.9	Very high	86.2	Confident	29 Å²	29	61.3 Å²	61.3	15%	0.149	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.4	176.2	-51.2	-176.2	0	0	0	108.2	K471 A474 G480 C482	I320-K471 HydrophobicContact CD1-CG 4.33Å; I320-K471 WeakPolarHBondContact CD1-O 3.42Å; I320-K471 HydrophobicContact CG2-CG 4Å; I320-A474 HydrophobicContact CD1-CB 4.17Å; I320-A474 WeakPolarHBondContact CD1-O 3.39Å; I320-A474 HydrophobicContact CG2-CB 4.39Å; I320-G480 WeakPolarHBondContact CA-O 3.46Å; I320-C482 HydrophobicContact CG2-CB 3.95Å
321	D	94.8	Very high	85.4	Confident	86 Å²	86	59.1 Å²	59.1	46%	0.46	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.5	173.5	-171	15.8	0	0	0	109.8	H323 G480 V481 C482	D321-H323 IonicContact OD1-CD2 3.98Å; D321-H323 IonicContact OD1-NE2 3.43Å; D321-H323 PolarHBondContact OD1-NE2 3.42Å; D321-H323 IonicContact OD2-CD2 3.66Å; D321-H323 IonicContact OD2-CE1 3.67Å; D321-H323 IonicContact OD2-NE2 2.72Å; D321-H323 PolarHBondContact OD2-NE2 3.3Å; D321-G480 PolarHBondContact N-O 2.93Å; D321-V481 HydrophobicContact CB-CG1 4.32Å; D321-V481 HydrophobicContact CB-CG2 4.36Å; D321-V481 CarbonylContact O-C 3.53Å; D321-V481 VanDerWaalsContact O-CA 3.3Å; D321-V481 WeakPolarHBondContact O-CA 3.49Å; D321-C482 PolarHBondContact O-N 3.41Å
322	L	96.3	Very high	84.5	Confident	55 Å²	55	63.4 Å²	63.4	29%	0.288	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.6	-170.7	-177.4	65.5	0	0	0	110.3	Y324 K471 C482 R484	L322-Y324 HydrophobicContact CD2-CE2 3.93Å; L322-Y324 HydrophobicContact CG-CE2 4.22Å; L322-K471 HydrophobicContact CD1-CD 4.07Å; L322-K471 HydrophobicContact CD2-CD 4.48Å; L322-C482 HydrophobicContact CD1-CB 3.82Å; L322-R484 HydrophobicContact CD1-CG 4.11Å
323	H	96.9	Very high	83.3	Confident	58 Å²	58	62.2 Å²	62.2	27%	0.269	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.6	180	-68.2	-92.5	0	0	0	110.1	D321 I325 C482 Y483 R484	D321-H323 IonicContact OD1-CD2 3.98Å; D321-H323 IonicContact OD1-NE2 3.43Å; D321-H323 PolarHBondContact OD1-NE2 3.42Å; D321-H323 IonicContact OD2-CD2 3.66Å; D321-H323 IonicContact OD2-CE1 3.67Å; D321-H323 IonicContact OD2-NE2 2.72Å; D321-H323 PolarHBondContact OD2-NE2 3.3Å; H323-I325 HydrophobicContact CB-CG1 4.37Å; H323-C482 PolarHBondContact N-O 2.79Å; H323-Y483 HydrophobicContact CB-CD1 3.73Å; H323-Y483 HydrophobicContact CB-CE1 4.1Å; H323-Y483 CarbonylContact O-C 3.52Å; H323-Y483 WeakPolarHBondContact O-CA 3.45Å; H323-R484 PolarHBondContact O-N 2.81Å
324	Y	96.4	Very high	82.1	Confident	60 Å²	60	66.7 Å²	66.7	24%	0.235	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.5	167.7	-65.1	-87.8	0	0	0	108.6	L322 R484 Y486 Q488	L322-Y324 HydrophobicContact CD2-CE2 3.93Å; L322-Y324 HydrophobicContact CG-CE2 4.22Å; Y324-R484 HydrophobicContact CD1-CB 3.77Å; Y324-R484 HydrophobicContact CD1-CG 4.43Å; Y324-R484 HydrophobicContact CE1-CB 4.14Å; Y324-R484 HydrophobicContact CE1-CG 4.35Å; Y324-R484 PolarHBondContact OH-NH1 3.44Å; Y324-Y486 WeakPolarHBondContact CD1-O 3.45Å; Y324-Y486 HydrophobicContact CE1-CD2 4.41Å; Y324-Y486 HydrophobicContact CE1-CE2 4.26Å; Y324-Q488 HydrophobicContact CD1-CB 4.33Å; Y324-Q488 HydrophobicContact CD2-CB 4.12Å; Y324-Q488 HydrophobicContact CE1-CB 4.17Å; Y324-Q488 HydrophobicContact CE2-CB 3.96Å; Y324-Q488 HydrophobicContact CE2-CG 4.11Å; Y324-Q488 HydrophobicContact CG-CB 4.3Å
325	I	93.7	Very high	81.1	Confident	47 Å²	47	65.3 Å²	65.3	24%	0.241	37%	0.37	C	S	.	.			trans	-125.9	76.5	179.7	-51.5	-178.9	0	0	0	106.8	H323 Y483 R484 F485	H323-I325 HydrophobicContact CB-CG1 4.37Å; I325-Y483 HydrophobicContact CD1-CD1 3.49Å; I325-Y483 VanDerWaalsContact CD1-CD1 3.49Å; I325-Y483 HydrophobicContact CD1-CE1 4.14Å; I325-Y483 HydrophobicContact CD1-CG 4.33Å; I325-Y483 HydrophobicContact CG1-CD1 4.4Å; I325-R484 CarbonylContact C-O 3.6Å; I325-R484 PolarHBondContact N-O 3.26Å; I325-F485 WeakPolarHBondContact O-CA 3.36Å; I325-F485 WeakPolarHBondContact O-CD1 3.35Å
326	P	89.4	Confident	80.7	Confident	68 Å²	68	69.1 Å²	69.1	44%	0.442	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-61	148.3	-178.2	27.6	-35.1	0	0	0	111	T487	P326-T487 HydrophobicContact CB-CG2 3.67Å; P326-T487 HydrophobicContact CG-CG2 4.11Å
327	L	86.5	Confident	80.2	Confident	41 Å²	41	73.1 Å²	73.1	22%	0.215	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-65.2	140.8	173.3	-58.6	-178	0	0	0	109.9	E331 I332 P343 F485	L327-E331 HydrophobicContact CB-CB 4.21Å; L327-I332 HydrophobicContact CB-CD1 4.39Å; L327-I332 HydrophobicContact CB-CG1 3.83Å; L327-P343 HydrophobicContact CD2-CB 3.62Å; L327-P343 HydrophobicContact CD2-CG 3.48Å; L327-P343 VanDerWaalsContact CD2-CG 3.48Å; L327-F485 HydrophobicContact CD2-CB 4.21Å; L327-F485 HydrophobicContact CD2-CD1 4.06Å; L327-F485 HydrophobicContact CD2-CG 4.33Å; L327-F485 HydrophobicContact CG-CB 4.4Å
328	S	84.1	Confident	80.4	Confident	45 Å²	45	80.4 Å²	80.4	32%	0.315	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-65.6	154.5	174	65	0	0	0	0	110.9	V330 E331 I332	S328-V330 PolarHBondContact O-N 3.01Å; S328-V330 VanDerWaalsContact O-N 3.1Å; S328-E331 WeakPolarHBondContact CB-OE2 3.19Å; S328-E331 PolarHBondContact N-OE2 3.26Å; S328-E331 WeakPolarHBondContact O-CB 3.16Å; S328-E331 PolarHBondContact O-N 3.37Å; S328-E331 WeakPolarHBondContact OG-CG 3.46Å; S328-E331 PolarHBondContact OG-N 3.44Å; S328-E331 PolarHBondContact OG-OE2 2.88Å; S328-I332 WeakPolarHBondContact O-CG1 3.47Å; S328-I332 PolarHBondContact O-N 3.4Å
329	P	75.6	Confident	80.5	Confident	108 Å²	108	77.2 Å²	77.2	70%	0.701	43%	0.426	S	S	*	.	H	α-helix	trans	-54.8	-32.6	178.8	-27.6	35.1	0	0	0	114	I332 A333	P329-I332 PolarHBondContact O-N 3.3Å; P329-A333 WeakPolarHBondContact O-CB 3.34Å; P329-A333 PolarHBondContact O-N 2.85Å
330	V	77.8	Confident	80.6	Confident	98 Å²	98	74.1 Å²	74.1	59%	0.594	40%	0.404	S	S	*	.	H	α-helix	trans	-68.8	-44	176.3	-179.2	0	0	0	0	111.2	S328 I332 A333 N334	S328-V330 PolarHBondContact O-N 3.01Å; S328-V330 VanDerWaalsContact O-N 3.1Å; V330-I332 VanDerWaalsContact C-N 3.31Å; V330-I332 PolarHBondContact O-N 3.49Å; V330-A333 PolarHBondContact O-N 2.82Å; V330-N334 VanDerWaalsContact O-CG 3.27Å; V330-N334 PolarHBondContact O-N 2.6Å; V330-N334 PolarHBondContact O-ND2 3.09Å
331	E	78.8	Confident	80.6	Confident	10 Å²	10	74.5 Å²	74.5	5%	0.047	41%	0.408	C	S	.	.	H	α-helix	trans	-62.3	-41.5	175.8	-71.1	158.9	165.8	0	0	110.1	L327 S328 N334 T335 P343 R346	L327-E331 HydrophobicContact CB-CB 4.21Å; S328-E331 WeakPolarHBondContact CB-OE2 3.19Å; S328-E331 PolarHBondContact N-OE2 3.26Å; S328-E331 WeakPolarHBondContact O-CB 3.16Å; S328-E331 PolarHBondContact O-N 3.37Å; S328-E331 WeakPolarHBondContact OG-CG 3.46Å; S328-E331 PolarHBondContact OG-N 3.44Å; S328-E331 PolarHBondContact OG-OE2 2.88Å; E331-N334 PolarHBondContact O-N 3.43Å; E331-T335 WeakPolarHBondContact O-CG2 3.45Å; E331-T335 PolarHBondContact O-N 3.3Å; E331-P343 HydrophobicContact CG-CG 4.15Å; E331-R346 IonicContact OE1-CZ 2.7Å; E331-R346 IonicContact OE1-NH1 2.89Å; E331-R346 PolarHBondContact OE1-NH1 2.94Å; E331-R346 IonicContact OE1-NH2 2.96Å; E331-R346 PolarHBondContact OE1-NH2 3.36Å; E331-R346 IonicContact OE2-NH1 3.07Å
332	I	75.2	Confident	80.5	Confident	94 Å²	94	72.3 Å²	72.3	48%	0.482	40%	0.402	S	S	.	.	H	α-helix	trans	-63.9	-44.7	175.1	-60.2	168.2	0	0	0	111	L327 S328 P329 V330 N334 T335	L327-I332 HydrophobicContact CB-CD1 4.39Å; L327-I332 HydrophobicContact CB-CG1 3.83Å; S328-I332 WeakPolarHBondContact O-CG1 3.47Å; S328-I332 PolarHBondContact O-N 3.4Å; P329-I332 PolarHBondContact O-N 3.3Å; V330-I332 VanDerWaalsContact C-N 3.31Å; V330-I332 PolarHBondContact O-N 3.49Å; I332-N334 VanDerWaalsContact C-N 3.26Å; I332-N334 PolarHBondContact O-N 2.87Å; I332-T335 PolarHBondContact O-N 3.47Å; I332-T335 PolarHBondContact O-OG1 2.86Å
333	A	66.9	Low	80.3	Confident	62 Å²	62	70 Å²	70	51%	0.512	39%	0.39	S	S	.	.	H	α-helix	trans	-62.5	-33.8	179	0	0	0	0	0	112.8	P329 V330 T335	P329-A333 WeakPolarHBondContact O-CB 3.34Å; P329-A333 PolarHBondContact O-N 2.85Å; V330-A333 PolarHBondContact O-N 2.82Å; A333-T335 PolarHBondContact O-N 3.46Å
334	N	64	Low	80.2	Confident	95 Å²	95	67.4 Å²	67.4	51%	0.508	38%	0.378	S	S	.	.	H	α-helix	trans	-72.3	-13.1	175.9	-69.9	-17.3	0	0	0	113.4	V330 E331 I332 T336	V330-N334 VanDerWaalsContact O-CG 3.27Å; V330-N334 PolarHBondContact O-N 2.6Å; V330-N334 PolarHBondContact O-ND2 3.09Å; E331-N334 PolarHBondContact O-N 3.43Å; I332-N334 VanDerWaalsContact C-N 3.26Å; I332-N334 PolarHBondContact O-N 2.87Å; N334-T336 VanDerWaalsContact C-N 3.28Å; N334-T336 PolarHBondContact O-N 3.06Å
335	T	61.4	Low	80.2	Confident	57 Å²	57	66.2 Å²	66.2	35%	0.35	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	3.9	-178.6	59	0	0	0	0	115.9	E331 I332 A333 D337 R338	E331-T335 WeakPolarHBondContact O-CG2 3.45Å; E331-T335 PolarHBondContact O-N 3.3Å; I332-T335 PolarHBondContact O-N 3.47Å; I332-T335 PolarHBondContact O-OG1 2.86Å; A333-T335 PolarHBondContact O-N 3.46Å; T335-D337 PolarHBondContact O-N 2.96Å; T335-D337 VanDerWaalsContact O-N 3.09Å; T335-R338 WeakPolarHBondContact CA-O 3.49Å
336	T	59.2	Low	80.3	Confident	122 Å²	122	70.6 Å²	70.6	75%	0.748	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-36.5	-172.6	40.5	0	0	0	0	114	N334	N334-T336 VanDerWaalsContact C-N 3.28Å; N334-T336 PolarHBondContact O-N 3.06Å
337	D	62.4	Low	80.6	Confident	158 Å²	158	67.6 Å²	67.6	85%	0.845	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.5	-23.8	174.5	-77.2	-33.1	0	0	0	115.1	T335	T335-D337 PolarHBondContact O-N 2.96Å; T335-D337 VanDerWaalsContact O-N 3.09Å
338	R	71.5	Confident	81.1	Confident	203 Å²	203	65.8 Å²	65.8	77%	0.766	36%	0.36	S	S	*	.	S	Bend	trans	-142.4	140.8	-177	-68.5	-173.1	-178.5	-179.8	0.5	111.4	T335 D340	T335-R338 WeakPolarHBondContact CA-O 3.49Å; R338-D340 PolarHBondContact O-N 3.31Å
339	I	84	Confident	81.6	Confident	30 Å²	30	71.6 Å²	71.6	15%	0.154	38%	0.375	C	S	.	.			trans	-61	132.9	175.3	-163.4	162.5	0	0	0	111	P341 Y344 L367 D372 A375 I376	I339-P341 WeakPolarHBondContact O-CD 3.26Å; I339-Y344 HydrophobicContact CD1-CE2 3.88Å; I339-Y344 WeakPolarHBondContact CD1-OH 3.44Å; I339-Y344 HydrophobicContact CG1-CE2 4.09Å; I339-L367 HydrophobicContact CD1-CD2 4.11Å; I339-D372 HydrophobicContact CB-CB 4.41Å; I339-D372 HydrophobicContact CD1-CB 4.22Å; I339-D372 HydrophobicContact CG2-CB 3.81Å; I339-A375 HydrophobicContact CG2-CB 3.73Å; I339-I376 HydrophobicContact CD1-CD1 4.1Å; I339-I376 HydrophobicContact CG2-CD1 4.1Å; I339-I376 HydrophobicContact CG2-CG1 4.13Å
340	D	86.3	Confident	82.6	Confident	30 Å²	30	72.2 Å²	72.2	16%	0.16	36%	0.363	C	S	.	.			trans	-71.3	121.8	173.7	-173	-14	0	0	0	109.3	R338 A342 P343	R338-D340 PolarHBondContact O-N 3.31Å; D340-A342 VanDerWaalsContact C-N 3.33Å; D340-A342 VanDerWaalsContact OD1-CB 3.23Å; D340-A342 WeakPolarHBondContact OD1-CB 3.37Å; D340-A342 PolarHBondContact OD1-N 2.92Å; D340-P343 VanDerWaalsContact O-CD 3.3Å; D340-P343 WeakPolarHBondContact O-CD 3.49Å
341	P	91.3	Very high	83.4	Confident	37 Å²	37	67.5 Å²	67.5	24%	0.24	34%	0.335	C	S	.	.	S	Bend	trans	-74.1	-20.8	178	30.1	-35.7	0	0	0	113.7	I339 P343 Y344 I345 I376 P379	I339-P341 WeakPolarHBondContact O-CD 3.26Å; P341-P343 VanDerWaalsContact C-CD 3.44Å; P341-Y344 PolarHBondContact O-N 3.12Å; P341-Y344 VanDerWaalsContact O-N 3.11Å; P341-I345 PolarHBondContact O-N 2.87Å; P341-I376 HydrophobicContact CB-CG1 4.35Å; P341-P379 HydrophobicContact CB-CB 4.24Å; P341-P379 HydrophobicContact CB-CG 3.86Å; P341-P379 HydrophobicContact CG-CG 3.96Å
342	A	92.2	Very high	84.2	Confident	40 Å²	40	68 Å²	68	33%	0.331	34%	0.338	S	S	.	.	H	α-helix	trans	-55.7	-41.5	-171.5	0	0	0	0	0	115.2	D340 Y344 I345 R346	D340-A342 VanDerWaalsContact C-N 3.33Å; D340-A342 VanDerWaalsContact OD1-CB 3.23Å; D340-A342 WeakPolarHBondContact OD1-CB 3.37Å; D340-A342 PolarHBondContact OD1-N 2.92Å; A342-Y344 VanDerWaalsContact C-N 3.29Å; A342-Y344 PolarHBondContact O-N 2.95Å; A342-I345 PolarHBondContact O-N 3.3Å; A342-R346 WeakPolarHBondContact O-CB 3.18Å; A342-R346 PolarHBondContact O-N 3.39Å
343	P	92.8	Very high	85.1	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.039	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-37.2	177.3	-21.9	32.5	0	0	0	113.1	L327 E331 D340 P341 L347 F485	L327-P343 HydrophobicContact CD2-CB 3.62Å; L327-P343 HydrophobicContact CD2-CG 3.48Å; L327-P343 VanDerWaalsContact CD2-CG 3.48Å; E331-P343 HydrophobicContact CG-CG 4.15Å; D340-P343 VanDerWaalsContact O-CD 3.3Å; D340-P343 WeakPolarHBondContact O-CD 3.49Å; P341-P343 VanDerWaalsContact C-CD 3.44Å; P343-L347 PolarHBondContact O-N 3.47Å; P343-F485 HydrophobicContact CB-CE1 4.14Å; P343-F485 HydrophobicContact CB-CZ 4.47Å
344	Y	95.2	Very high	86.4	Confident	4 Å²	4	70 Å²	70	2%	0.016	35%	0.347	C	S	.	.	H	α-helix	trans	-73.6	-40	-178.7	-59.4	-86.2	0	0	0	111.5	I339 P341 A342 L347 L348 I365 L367 I376 F485	I339-Y344 HydrophobicContact CD1-CE2 3.88Å; I339-Y344 WeakPolarHBondContact CD1-OH 3.44Å; I339-Y344 HydrophobicContact CG1-CE2 4.09Å; P341-Y344 PolarHBondContact O-N 3.12Å; P341-Y344 VanDerWaalsContact O-N 3.11Å; A342-Y344 VanDerWaalsContact C-N 3.29Å; A342-Y344 PolarHBondContact O-N 2.95Å; Y344-L347 WeakPolarHBondContact O-CB 3.16Å; Y344-L347 PolarHBondContact O-N 2.99Å; Y344-L348 PolarHBondContact O-N 2.69Å; Y344-I365 HydrophobicContact CD1-CD1 4.04Å; Y344-I365 HydrophobicContact CD1-CG2 3.65Å; Y344-I365 HydrophobicContact CE1-CG2 3.54Å; Y344-L367 HydrophobicContact CE1-CD2 3.7Å; Y344-L367 WeakPolarHBondContact OH-CD2 3.45Å; Y344-I376 HydrophobicContact CD1-CD1 4.12Å; Y344-I376 HydrophobicContact CD2-CD1 3.45Å; Y344-I376 VanDerWaalsContact CD2-CD1 3.45Å; Y344-I376 HydrophobicContact CD2-CG1 3.82Å; Y344-I376 HydrophobicContact CE1-CD1 4.08Å; Y344-I376 HydrophobicContact CE2-CD1 3.43Å; Y344-I376 VanDerWaalsContact CE2-CD1 3.43Å; Y344-I376 HydrophobicContact CE2-CG1 4.2Å; Y344-I376 HydrophobicContact CG-CD1 3.82Å; Y344-I376 HydrophobicContact CG-CG1 4.24Å; Y344-I376 HydrophobicContact CG-CG2 4.17Å; Y344-F485 HydrophobicContact CD1-CD2 4.39Å; Y344-F485 AromaticContact CD1-CE2 3.6Å; Y344-F485 HydrophobicContact CD1-CE2 3.6Å; Y344-F485 HydrophobicContact CD1-CZ 4.24Å; Y344-F485 AromaticContact CE1-CD2 3.73Å; Y344-F485 HydrophobicContact CE1-CD2 3.73Å; Y344-F485 AromaticContact CE1-CE2 3.39Å; Y344-F485 HydrophobicContact CE1-CE2 3.39Å; Y344-F485 HydrophobicContact CE1-CZ 4.38Å; Y344-F485 HydrophobicContact CG-CE2 4.43Å
345	I	95.8	Very high	87.7	Confident	35 Å²	35	67.3 Å²	67.3	18%	0.179	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-40.1	174.3	-53.4	-50.7	0	0	0	110.8	P341 A342 L347 L348 R349 P379 A380 Y383	P341-I345 PolarHBondContact O-N 2.87Å; A342-I345 PolarHBondContact O-N 3.3Å; I345-L347 PolarHBondContact O-N 3.19Å; I345-L348 HydrophobicContact CD1-CD1 4.26Å; I345-L348 PolarHBondContact O-N 3.32Å; I345-R349 PolarHBondContact O-N 2.6Å; I345-P379 HydrophobicContact CD1-CB 4.07Å; I345-P379 HydrophobicContact CG1-CB 4.15Å; I345-A380 HydrophobicContact CD1-CB 3.83Å; I345-Y383 HydrophobicContact CG2-CD2 4.21Å; I345-Y383 HydrophobicContact CG2-CG 4.23Å
346	R	95.1	Very high	89.1	Confident	139 Å²	139	68 Å²	68	53%	0.525	34%	0.336	S	S	.	.	H	α-helix	trans	-58.5	-38.5	172.9	-170.7	-173.3	-59.7	143.4	8.3	111.3	E331 A342 R349 R350	E331-R346 IonicContact OE1-CZ 2.7Å; E331-R346 IonicContact OE1-NH1 2.89Å; E331-R346 PolarHBondContact OE1-NH1 2.94Å; E331-R346 IonicContact OE1-NH2 2.96Å; E331-R346 PolarHBondContact OE1-NH2 3.36Å; E331-R346 IonicContact OE2-NH1 3.07Å; A342-R346 WeakPolarHBondContact O-CB 3.18Å; A342-R346 PolarHBondContact O-N 3.39Å; R346-R349 PolarHBondContact O-N 3.46Å; R346-R350 WeakPolarHBondContact O-CB 3.37Å; R346-R350 PolarHBondContact O-N 2.82Å
347	L	96.3	Very high	90.4	Very high	5 Å²	5	63.3 Å²	63.3	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-66.1	-44.6	175.6	179.4	61.7	0	0	0	112.5	P343 Y344 I345 R349 R350 I351 L363 A438 Y483 F485	P343-L347 PolarHBondContact O-N 3.47Å; Y344-L347 WeakPolarHBondContact O-CB 3.16Å; Y344-L347 PolarHBondContact O-N 2.99Å; I345-L347 PolarHBondContact O-N 3.19Å; L347-R349 VanDerWaalsContact C-N 3.3Å; L347-R349 PolarHBondContact O-N 3.15Å; L347-R350 WeakPolarHBondContact O-CB 3.43Å; L347-R350 PolarHBondContact O-N 2.87Å; L347-R350 VanDerWaalsContact O-N 3.17Å; L347-I351 HydrophobicContact CD1-CD1 4.21Å; L347-I351 HydrophobicContact CD1-CG1 4.32Å; L347-I351 HydrophobicContact CG-CD1 4.11Å; L347-I351 WeakPolarHBondContact O-CG1 3.45Å; L347-I351 PolarHBondContact O-N 3.24Å; L347-L363 HydrophobicContact CD2-CD1 4.39Å; L347-L363 HydrophobicContact CD2-CD2 4.41Å; L347-A438 HydrophobicContact CD2-CB 3.54Å; L347-Y483 HydrophobicContact CD1-CD1 4.12Å; L347-Y483 HydrophobicContact CD1-CD2 3.61Å; L347-Y483 HydrophobicContact CD1-CE1 4.27Å; L347-Y483 HydrophobicContact CD1-CE2 3.76Å; L347-Y483 HydrophobicContact CD1-CG 3.78Å; L347-Y483 HydrophobicContact CD2-CD2 4.13Å; L347-Y483 HydrophobicContact CD2-CG 4.41Å; L347-Y483 HydrophobicContact CG-CD2 4.47Å; L347-F485 HydrophobicContact CB-CZ 4.25Å; L347-F485 HydrophobicContact CD2-CE2 4.36Å; L347-F485 HydrophobicContact CD2-CZ 3.92Å
348	L	96.6	Very high	91.5	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-55.9	-48.1	174.5	-67.1	177.5	0	0	0	111	Y344 I345 R350 I351 D352 L363 A380 Y383 W390 C418	Y344-L348 PolarHBondContact O-N 2.69Å; I345-L348 HydrophobicContact CD1-CD1 4.26Å; I345-L348 PolarHBondContact O-N 3.32Å; L348-R350 VanDerWaalsContact C-N 3.34Å; L348-R350 PolarHBondContact O-N 2.89Å; L348-I351 PolarHBondContact O-N 3.3Å; L348-D352 PolarHBondContact O-N 2.88Å; L348-L363 HydrophobicContact CD2-CD2 3.58Å; L348-A380 HydrophobicContact CD1-CB 4.26Å; L348-Y383 HydrophobicContact CB-CD1 4.01Å; L348-Y383 HydrophobicContact CB-CE1 3.74Å; L348-Y383 HydrophobicContact CD1-CD1 3.94Å; L348-Y383 HydrophobicContact CD1-CE1 4.5Å; L348-W390 HydrophobicContact CD2-CD2 3.88Å; L348-W390 HydrophobicContact CD2-CE3 4.02Å; L348-W390 HydrophobicContact CD2-CG 4.5Å; L348-W390 HydrophobicContact CD2-CH2 4.03Å; L348-W390 HydrophobicContact CD2-CZ2 3.91Å; L348-W390 HydrophobicContact CD2-CZ3 4.09Å; L348-C418 HydrophobicContact CD2-CB 4.35Å
349	R	96.2	Very high	92.3	Very high	167 Å²	167	54.4 Å²	54.4	63%	0.63	28%	0.28	S	S	*	.	H	α-helix	trans	-61	-41.4	176.7	-171.4	176.3	-176.7	174.7	2.1	112.4	I345 R346 L347 D352 V353 Y383	I345-R349 PolarHBondContact O-N 2.6Å; R346-R349 PolarHBondContact O-N 3.46Å; L347-R349 VanDerWaalsContact C-N 3.3Å; L347-R349 PolarHBondContact O-N 3.15Å; R349-D352 PolarHBondContact O-N 2.95Å; R349-V353 WeakPolarHBondContact O-CG2 3.43Å; R349-V353 PolarHBondContact O-N 2.98Å; R349-Y383 WeakPolarHBondContact CA-OH 3.26Å
350	R	95.4	Very high	92.4	Very high	121 Å²	121	60.3 Å²	60.3	46%	0.457	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-46.6	175.8	-178.6	172.3	-178.6	145.2	-2.8	111	R346 L347 L348 D352 V353 T354	R346-R350 WeakPolarHBondContact O-CB 3.37Å; R346-R350 PolarHBondContact O-N 2.82Å; L347-R350 WeakPolarHBondContact O-CB 3.43Å; L347-R350 PolarHBondContact O-N 2.87Å; L347-R350 VanDerWaalsContact O-N 3.17Å; L348-R350 VanDerWaalsContact C-N 3.34Å; L348-R350 PolarHBondContact O-N 2.89Å; R350-D352 VanDerWaalsContact C-N 3.33Å; R350-D352 PolarHBondContact O-N 2.7Å; R350-V353 PolarHBondContact O-N 3Å; R350-T354 WeakPolarHBondContact O-CB 3.36Å; R350-T354 PolarHBondContact O-N 2.95Å; R350-T354 PolarHBondContact O-OG1 3.24Å
351	I	95.7	Very high	92.6	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-41.2	178.9	-67.7	166.3	0	0	0	111	L347 L348 V353 T354 Y355 L363 W390 F436	L347-I351 HydrophobicContact CD1-CD1 4.21Å; L347-I351 HydrophobicContact CD1-CG1 4.32Å; L347-I351 HydrophobicContact CG-CD1 4.11Å; L347-I351 WeakPolarHBondContact O-CG1 3.45Å; L347-I351 PolarHBondContact O-N 3.24Å; L348-I351 PolarHBondContact O-N 3.3Å; I351-V353 VanDerWaalsContact C-N 3.34Å; I351-V353 PolarHBondContact O-N 3.43Å; I351-T354 PolarHBondContact O-N 2.93Å; I351-Y355 HydrophobicContact CG2-CD2 4.15Å; I351-Y355 PolarHBondContact O-N 2.89Å; I351-L363 HydrophobicContact CD1-CD1 4.24Å; I351-L363 HydrophobicContact CD1-CD2 3.98Å; I351-W390 HydrophobicContact CB-CH2 4.39Å; I351-W390 HydrophobicContact CB-CZ2 4.12Å; I351-W390 HydrophobicContact CD1-CH2 4.25Å; I351-W390 HydrophobicContact CG2-CH2 3.87Å; I351-W390 HydrophobicContact CG2-CZ2 3.81Å; I351-F436 HydrophobicContact CD1-CB 4.09Å; I351-F436 HydrophobicContact CD1-CD1 4.48Å; I351-F436 HydrophobicContact CD1-CD2 4.08Å; I351-F436 HydrophobicContact CD1-CG 3.96Å; I351-F436 HydrophobicContact CG1-CG 4.47Å; I351-F436 HydrophobicContact CG2-CD2 4.01Å; I351-F436 HydrophobicContact CG2-CE2 3.58Å; I351-F436 HydrophobicContact CG2-CZ 3.88Å
352	D	94.4	Very high	92.8	Very high	21 Å²	21	58 Å²	58	11%	0.112	29%	0.287	C	S	.	.	H	α-helix	trans	-66.6	-33.5	178.4	-84.4	-29.7	0	0	0	114.1	L348 R349 R350 R389 W390 R416	L348-D352 PolarHBondContact O-N 2.88Å; R349-D352 PolarHBondContact O-N 2.95Å; R350-D352 VanDerWaalsContact C-N 3.33Å; R350-D352 PolarHBondContact O-N 2.7Å; D352-R389 WeakPolarHBondContact OD1-CD 3.41Å; D352-R389 IonicContact OD1-NH1 3.88Å; D352-R389 PolarHBondContact OD1-NH1 2.74Å; D352-W390 PolarHBondContact OD2-NE1 3.48Å; D352-R416 IonicContact OD1-NH1 2.72Å; D352-R416 PolarHBondContact OD1-NH1 3.39Å; D352-R416 VanDerWaalsContact OD1-NH1 3.16Å
353	V	94.2	Very high	93.1	Very high	119 Å²	119	56.1 Å²	56.1	72%	0.721	27%	0.271	S	S	*	.	H	α-helix	trans	-77.4	-41	175.9	172.8	0	0	0	0	111.5	R349 R350 I351	R349-V353 WeakPolarHBondContact O-CG2 3.43Å; R349-V353 PolarHBondContact O-N 2.98Å; R350-V353 PolarHBondContact O-N 3Å; I351-V353 VanDerWaalsContact C-N 3.34Å; I351-V353 PolarHBondContact O-N 3.43Å
354	T	93.9	Very high	93.3	Very high	77 Å²	77	56 Å²	56	47%	0.472	27%	0.269	S	S	.	.	H	α-helix	trans	-76	-35.9	-176.6	-56.2	0	0	0	0	112.8	R350 I351	R350-T354 WeakPolarHBondContact O-CB 3.36Å; R350-T354 PolarHBondContact O-N 2.95Å; R350-T354 PolarHBondContact O-OG1 3.24Å; I351-T354 PolarHBondContact O-N 2.93Å
355	Y	92.9	Very high	93.4	Very high	39 Å²	39	55.9 Å²	55.9	15%	0.153	27%	0.269	C	S	.	.	S	Bend	trans	-121.6	124.9	-172.7	-58.5	-82.8	0	0	0	112.2	I351 R416 F436	I351-Y355 HydrophobicContact CG2-CD2 4.15Å; I351-Y355 PolarHBondContact O-N 2.89Å; Y355-R416 VanDerWaalsContact CB-NH2 3.35Å; Y355-R416 PolarHBondContact O-NH1 2.98Å; Y355-R416 PolarHBondContact O-NH2 3.38Å; Y355-F436 HydrophobicContact CD1-CZ 4.44Å; Y355-F436 AromaticContact CD2-CE1 3.81Å; Y355-F436 HydrophobicContact CD2-CE1 3.81Å; Y355-F436 AromaticContact CD2-CZ 3.63Å; Y355-F436 HydrophobicContact CD2-CZ 3.63Å; Y355-F436 HydrophobicContact CE1-CE1 4.43Å; Y355-F436 HydrophobicContact CE2-CD1 4.5Å; Y355-F436 AromaticContact CE2-CE1 3.47Å; Y355-F436 HydrophobicContact CE2-CE1 3.47Å; Y355-F436 VanDerWaalsContact CE2-CE1 3.47Å; Y355-F436 AromaticContact CE2-CZ 3.82Å; Y355-F436 HydrophobicContact CE2-CZ 3.82Å; Y355-F436 HydrophobicContact CG-CE1 4.42Å; Y355-F436 AromaticContact CG-CZ 3.97Å; Y355-F436 HydrophobicContact CG-CZ 3.97Å; Y355-F436 AromaticContact CZ-CE1 3.82Å
356	P	90.8	Very high	93.5	Very high	73 Å²	73	54.2 Å²	54.2	47%	0.474	26%	0.261	S	S	.	.			trans	-61.8	149.5	179.7	27.6	-34.4	0	0	0	111.4	T358 E359 R416	P356-T358 PolarHBondContact O-N 3.49Å; P356-T358 VanDerWaalsContact O-N 3.15Å; P356-E359 HydrophobicContact CG-CB 4.2Å; P356-E359 WeakPolarHBondContact O-CB 3.5Å; P356-E359 PolarHBondContact O-N 3.24Å; P356-R416 PolarHBondContact O-NH2 3.36Å
357	A	85.5	Confident	93.6	Very high	22 Å²	22	47.6 Å²	47.6	18%	0.182	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.7	-177.5	0	0	0	0	0	113.2	E359 C414	A357-E359 PolarHBondContact O-N 3.12Å; A357-C414 HydrophobicContact CB-CB 4.12Å; A357-C414 WeakPolarHBondContact O-CA 3.46Å
358	T	86	Confident	93.3	Very high	113 Å²	113	47.9 Å²	47.9	69%	0.693	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.2	177.3	50.7	0	0	0	0	112.7	P356	P356-T358 PolarHBondContact O-N 3.49Å; P356-T358 VanDerWaalsContact O-N 3.15Å
359	E	87.8	Confident	92.9	Very high	62 Å²	62	48.1 Å²	48.1	29%	0.29	24%	0.241	S	C	.	.	S	Bend	trans	-84.4	116.3	175.4	-169.1	175.4	-177.4	0	0	110.7	P356 A357 R416 R435	P356-E359 HydrophobicContact CG-CB 4.2Å; P356-E359 WeakPolarHBondContact O-CB 3.5Å; P356-E359 PolarHBondContact O-N 3.24Å; A357-E359 PolarHBondContact O-N 3.12Å; E359-R416 PolarHBondContact O-NH2 2.97Å; E359-R435 IonicContact OE1-CZ 3.92Å; E359-R435 IonicContact OE1-NE 2.86Å; E359-R435 IonicContact OE1-NH1 2.63Å; E359-R435 PolarHBondContact OE1-NH1 3.07Å; E359-R435 IonicContact OE1-NH2 3.7Å; E359-R435 PolarHBondContact OE1-NH2 3.23Å
360	R	85.3	Confident	92.3	Very high	154 Å²	154	44.3 Å²	44.3	58%	0.581	23%	0.232	S	C	*	.			trans	-68.2	141.3	178.1	-70.2	-171.5	171.7	-146.7	0.4	111.4	D413	R360-D413 IonicContact CZ-OD1 2.73Å; R360-D413 IonicContact NE-OD1 3.4Å; R360-D413 IonicContact NH2-OD1 3.69Å; R360-D413 PolarHBondContact NH2-OD1 3.24Å
361	G	91.4	Very high	91.8	Very high	4 Å²	4	41.7 Å²	41.7	4%	0.041	24%	0.236	C	C	.	.			trans	174.5	112.7	172.5	0	0	0	0	0	111.5	R416 R435	G361-R416 WeakPolarHBondContact O-CD 3.16Å; G361-R416 VanDerWaalsContact O-CG 3.24Å; G361-R416 WeakPolarHBondContact O-CG 3.38Å; G361-R435 VanDerWaalsContact CA-CB 3.49Å
362	D	95.6	Very high	91.5	Very high	15 Å²	15	42.6 Å²	42.6	8%	0.08	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	151.3	175.3	-64.4	-25.7	0	0	0	110.1	K417 G433 I434 R435 F436	D362-K417 CarbonylContact C-O 3.51Å; D362-K417 VanDerWaalsContact CA-O 3.31Å; D362-K417 WeakPolarHBondContact CA-O 3.42Å; D362-K417 HydrophobicContact CB-CB 4.38Å; D362-K417 WeakPolarHBondContact CB-O 3.41Å; D362-K417 PolarHBondContact OD1-N 3.41Å; D362-K417 WeakPolarHBondContact OD2-CE 3.15Å; D362-K417 IonicContact OD2-NZ 2.68Å; D362-K417 PolarHBondContact OD2-NZ 3.21Å; D362-G433 PolarHBondContact N-O 2.93Å; D362-I434 HydrophobicContact CB-CD1 3.9Å; D362-R435 PolarHBondContact O-N 3.44Å; D362-F436 PolarHBondContact O-N 2.91Å
363	L	97.4	Very high	91.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.3	176.7	174.9	62.7	0	0	0	110	L347 L348 I351 I365 W390 K417 C418 I419 F436 A438	L347-L363 HydrophobicContact CD2-CD1 4.39Å; L347-L363 HydrophobicContact CD2-CD2 4.41Å; L348-L363 HydrophobicContact CD2-CD2 3.58Å; I351-L363 HydrophobicContact CD1-CD1 4.24Å; I351-L363 HydrophobicContact CD1-CD2 3.98Å; L363-I365 HydrophobicContact CD1-CG1 4.26Å; L363-I365 HydrophobicContact CD2-CD1 3.79Å; L363-I365 HydrophobicContact CD2-CG1 3.95Å; L363-I365 HydrophobicContact CG-CD1 4.23Å; L363-I365 HydrophobicContact CG-CG1 3.8Å; L363-W390 HydrophobicContact CB-CH2 4.16Å; L363-W390 HydrophobicContact CB-CZ3 3.82Å; L363-K417 PolarHBondContact N-O 2.76Å; L363-C418 CarbonylContact O-C 3.46Å; L363-C418 WeakPolarHBondContact O-CA 3.16Å; L363-I419 PolarHBondContact O-N 3.22Å; L363-F436 CarbonylContact C-O 3.6Å; L363-F436 WeakPolarHBondContact CA-O 3.4Å; L363-F436 HydrophobicContact CB-CB 4.2Å; L363-F436 HydrophobicContact CD1-CB 3.53Å; L363-F436 HydrophobicContact CG-CB 4.45Å; L363-A438 HydrophobicContact CD1-CB 4.22Å
364	L	97.6	Very high	91.1	Very high	2 Å²	2	40 Å²	40	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.8	169.7	174.1	64.1	0	0	0	109.2	F366 I419 A425 I434 F436 V437 A438 R473	L364-F366 HydrophobicContact CD2-CE2 3.71Å; L364-F366 HydrophobicContact CD2-CZ 3.63Å; L364-F366 HydrophobicContact CG-CE2 4Å; L364-F366 HydrophobicContact CG-CZ 4.19Å; L364-I419 HydrophobicContact CD1-CB 3.83Å; L364-I419 HydrophobicContact CD1-CG2 3.71Å; L364-A425 HydrophobicContact CD1-CB 3.95Å; L364-A425 HydrophobicContact CD2-CB 3.97Å; L364-I434 HydrophobicContact CB-CD1 4.03Å; L364-I434 HydrophobicContact CB-CG2 3.99Å; L364-F436 PolarHBondContact N-O 3.42Å; L364-V437 CarbonylContact O-C 3.55Å; L364-V437 VanDerWaalsContact O-CA 3.29Å; L364-V437 WeakPolarHBondContact O-CA 3.47Å; L364-A438 PolarHBondContact O-N 3.44Å; L364-R473 HydrophobicContact CD2-CB 3.96Å; L364-R473 HydrophobicContact CD2-CG 4.02Å
365	I	98.1	Very high	90.9	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.5	179.9	-47.9	-166.6	0	0	0	108.7	Y344 L363 L367 I419 L420 S421 A438	Y344-I365 HydrophobicContact CD1-CD1 4.04Å; Y344-I365 HydrophobicContact CD1-CG2 3.65Å; Y344-I365 HydrophobicContact CE1-CG2 3.54Å; L363-I365 HydrophobicContact CD1-CG1 4.26Å; L363-I365 HydrophobicContact CD2-CD1 3.79Å; L363-I365 HydrophobicContact CD2-CG1 3.95Å; L363-I365 HydrophobicContact CG-CD1 4.23Å; L363-I365 HydrophobicContact CG-CG1 3.8Å; I365-L367 HydrophobicContact CG2-CD1 4.47Å; I365-L367 HydrophobicContact CG2-CD2 3.98Å; I365-L367 HydrophobicContact CG2-CG 4.01Å; I365-I419 PolarHBondContact N-O 3.1Å; I365-L420 HydrophobicContact CB-CD2 3.96Å; I365-L420 HydrophobicContact CD1-CD2 3.65Å; I365-L420 HydrophobicContact CG1-CD2 3.99Å; I365-S421 PolarHBondContact O-N 3.48Å; I365-A438 CarbonylContact C-O 3.55Å; I365-A438 WeakPolarHBondContact CA-O 3.35Å; I365-A438 HydrophobicContact CB-CB 4.3Å; I365-A438 HydrophobicContact CG1-CB 4.05Å; I365-A438 HydrophobicContact CG2-CB 4.03Å
366	F	97.8	Very high	90.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.2	172.2	-71.7	-79.4	0	0	0	110.6	L364 S421 T422 A425 E426 V437 A438 S440 R470 R473	L364-F366 HydrophobicContact CD2-CE2 3.71Å; L364-F366 HydrophobicContact CD2-CZ 3.63Å; L364-F366 HydrophobicContact CG-CE2 4Å; L364-F366 HydrophobicContact CG-CZ 4.19Å; F366-S421 CarbonylContact C-O 3.36Å; F366-S421 WeakPolarHBondContact CA-O 3.42Å; F366-T422 WeakPolarHBondContact CD1-O 3.4Å; F366-A425 HydrophobicContact CE1-CB 3.97Å; F366-A425 HydrophobicContact CZ-CB 4.18Å; F366-E426 HydrophobicContact CE1-CB 3.97Å; F366-E426 HydrophobicContact CZ-CB 4.46Å; F366-V437 HydrophobicContact CD2-CG1 4.09Å; F366-V437 HydrophobicContact CE2-CG1 4.11Å; F366-A438 PolarHBondContact N-O 2.95Å; F366-S440 VanDerWaalsContact O-CB 3.3Å; F366-S440 WeakPolarHBondContact O-CB 3.47Å; F366-S440 PolarHBondContact O-N 3.04Å; F366-S440 PolarHBondContact O-OG 3.49Å; F366-S440 VanDerWaalsContact O-OG 3.08Å; F366-R470 HydrophobicContact CD1-CG 4.08Å; F366-R470 HydrophobicContact CD2-CB 3.69Å; F366-R470 HydrophobicContact CD2-CG 3.63Å; F366-R470 HydrophobicContact CE1-CG 4.11Å; F366-R470 HydrophobicContact CE2-CB 3.6Å; F366-R470 HydrophobicContact CE2-CG 3.66Å; F366-R470 HydrophobicContact CG-CB 4.39Å; F366-R470 HydrophobicContact CG-CG 3.84Å; F366-R470 HydrophobicContact CZ-CB 4.25Å; F366-R470 HydrophobicContact CZ-CG 3.9Å; F366-R473 HydrophobicContact CE2-CG 4.19Å; F366-R473 HydrophobicContact CZ-CG 3.98Å
367	L	95.8	Very high	90.9	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	18%	0.182	C	C	.	.			trans	-126.9	159.8	-178	-62.8	172	0	0	0	110.3	I339 Y344 I365 D372 I373 I376 L420 S421 T422	I339-L367 HydrophobicContact CD1-CD2 4.11Å; Y344-L367 HydrophobicContact CE1-CD2 3.7Å; Y344-L367 WeakPolarHBondContact OH-CD2 3.45Å; I365-L367 HydrophobicContact CG2-CD1 4.47Å; I365-L367 HydrophobicContact CG2-CD2 3.98Å; I365-L367 HydrophobicContact CG2-CG 4.01Å; L367-D372 HydrophobicContact CB-CB 4.23Å; L367-I373 HydrophobicContact CB-CG1 4.18Å; L367-I373 HydrophobicContact CD1-CB 4.37Å; L367-I373 HydrophobicContact CD1-CG1 3.73Å; L367-I376 HydrophobicContact CD1-CD1 3.61Å; L367-I376 HydrophobicContact CD2-CD1 3.4Å; L367-I376 HydrophobicContact CG-CD1 4.16Å; L367-L420 HydrophobicContact CD1-CB 4.23Å; L367-L420 HydrophobicContact CD1-CD2 4.46Å; L367-S421 PolarHBondContact N-O 3.48Å; L367-T422 WeakPolarHBondContact O-CA 3.43Å
368	S	91.3	Very high	91.1	Very high	10 Å²	10	39.1 Å²	39.1	7%	0.07	21%	0.207	C	C	.	.	S	Bend	trans	-74.2	-41.5	-171	-156	0	0	0	0	112.3	D372 K444 E459	S368-D372 WeakPolarHBondContact CB-OD2 3.43Å; S368-D372 PolarHBondContact N-OD2 2.82Å; S368-K444 VanDerWaalsContact OG-CG 3.31Å; S368-K444 WeakPolarHBondContact OG-CG 3.36Å; S368-K444 PolarHBondContact OG-N 3.02Å; S368-E459 WeakPolarHBondContact CB-OE1 3.3Å; S368-E459 WeakPolarHBondContact OG-CG 3.37Å; S368-E459 PolarHBondContact OG-OE1 2.89Å
369	G	88	Confident	91.4	Very high	8 Å²	8	36 Å²	36	8%	0.082	19%	0.189	C	C	.	.	S	Bend	trans	-157.6	-173.3	178.3	0	0	0	0	0	115.6	A371 D372 I373	G369-A371 PolarHBondContact O-N 3.38Å; G369-D372 PolarHBondContact N-OD2 3.2Å; G369-D372 PolarHBondContact O-N 3.24Å; G369-I373 WeakPolarHBondContact O-CG1 3.41Å; G369-I373 PolarHBondContact O-N 2.96Å; G369-I373 VanDerWaalsContact O-N 3.15Å
370	M	84.5	Confident	91.7	Very high	87 Å²	87	33.1 Å²	33.1	43%	0.429	18%	0.176	S	C	.	.	H	α-helix	trans	-63.4	-38.4	-177.8	-63.8	-174.3	-66.6	0	0	113.1	D372 I373 Q374 H396 A398	M370-D372 VanDerWaalsContact C-N 3.28Å; M370-D372 PolarHBondContact O-N 2.63Å; M370-I373 WeakPolarHBondContact O-CB 3.45Å; M370-I373 PolarHBondContact O-N 2.94Å; M370-Q374 WeakPolarHBondContact O-CG 3.45Å; M370-Q374 PolarHBondContact O-N 3.36Å; M370-H396 HydrophobicContact CG-CB 4Å; M370-H396 PolarHBondContact SD-ND1 3.25Å; M370-A398 HydrophobicContact SD-CB 3.59Å; M370-A398 VanDerWaalsContact SD-CB 3.59Å
371	A	84.4	Confident	92.1	Very high	67 Å²	67	27.9 Å²	27.9	55%	0.554	16%	0.157	S	C	*	.	H	α-helix	trans	-59.7	-40.7	178.1	0	0	0	0	0	111.6	G369 Q374 A375	G369-A371 PolarHBondContact O-N 3.38Å; A371-Q374 PolarHBondContact O-N 2.87Å; A371-A375 WeakPolarHBondContact O-CB 3.16Å; A371-A375 PolarHBondContact O-N 2.81Å
372	D	89.7	Confident	92.2	Very high	18 Å²	18	30.4 Å²	30.4	10%	0.096	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-40.7	178.7	-48.9	-35.5	0	0	0	111.5	I339 L367 S368 G369 M370 Q374 A375 I376	I339-D372 HydrophobicContact CB-CB 4.41Å; I339-D372 HydrophobicContact CD1-CB 4.22Å; I339-D372 HydrophobicContact CG2-CB 3.81Å; L367-D372 HydrophobicContact CB-CB 4.23Å; S368-D372 WeakPolarHBondContact CB-OD2 3.43Å; S368-D372 PolarHBondContact N-OD2 2.82Å; G369-D372 PolarHBondContact N-OD2 3.2Å; G369-D372 PolarHBondContact O-N 3.24Å; M370-D372 VanDerWaalsContact C-N 3.28Å; M370-D372 PolarHBondContact O-N 2.63Å; D372-Q374 VanDerWaalsContact C-N 3.31Å; D372-Q374 PolarHBondContact O-N 3.28Å; D372-A375 PolarHBondContact O-N 2.67Å; D372-I376 WeakPolarHBondContact O-CG1 3.48Å; D372-I376 PolarHBondContact O-N 3.41Å; D372-I376 VanDerWaalsContact O-N 3.11Å
373	I	91.7	Very high	92.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56	-49.5	172.9	-71.1	168.5	0	0	0	109.6	L367 G369 M370 I376 M377 P394 H396 L420 T422	L367-I373 HydrophobicContact CB-CG1 4.18Å; L367-I373 HydrophobicContact CD1-CB 4.37Å; L367-I373 HydrophobicContact CD1-CG1 3.73Å; G369-I373 WeakPolarHBondContact O-CG1 3.41Å; G369-I373 PolarHBondContact O-N 2.96Å; G369-I373 VanDerWaalsContact O-N 3.15Å; M370-I373 WeakPolarHBondContact O-CB 3.45Å; M370-I373 PolarHBondContact O-N 2.94Å; I373-I376 PolarHBondContact O-N 3.47Å; I373-M377 WeakPolarHBondContact O-CB 3.32Å; I373-M377 PolarHBondContact O-N 3.47Å; I373-P394 HydrophobicContact CG2-CB 3.81Å; I373-H396 HydrophobicContact CD1-CB 4.08Å; I373-L420 HydrophobicContact CG1-CB 4.33Å; I373-L420 HydrophobicContact CG2-CB 3.99Å; I373-T422 HydrophobicContact CD1-CG2 3.82Å
374	Q	88.3	Confident	92	Very high	85 Å²	85	31.3 Å²	31.3	40%	0.397	18%	0.181	S	C	.	.	H	α-helix	trans	-64.7	-43.7	-179	-69.6	-63.4	-18.7	0	0	112.2	M370 A371 D372 I376 M377	M370-Q374 WeakPolarHBondContact O-CG 3.45Å; M370-Q374 PolarHBondContact O-N 3.36Å; A371-Q374 PolarHBondContact O-N 2.87Å; D372-Q374 VanDerWaalsContact C-N 3.31Å; D372-Q374 PolarHBondContact O-N 3.28Å; Q374-I376 VanDerWaalsContact C-N 3.26Å; Q374-I376 PolarHBondContact O-N 3.16Å; Q374-M377 PolarHBondContact O-N 3.48Å
375	A	88.7	Confident	91.7	Very high	31 Å²	31	37.7 Å²	37.7	26%	0.256	21%	0.21	S	C	.	.	H	α-helix	trans	-59.2	-35	178.2	0	0	0	0	0	113.1	I339 A371 D372 P379	I339-A375 HydrophobicContact CG2-CB 3.73Å; A371-A375 WeakPolarHBondContact O-CB 3.16Å; A371-A375 PolarHBondContact O-N 2.81Å; D372-A375 PolarHBondContact O-N 2.67Å; A375-P379 VanDerWaalsContact O-CD 3.25Å; A375-P379 WeakPolarHBondContact O-CD 3.06Å
376	I	92.6	Very high	91.4	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-86.7	-33.5	178.5	-66.1	161.9	0	0	0	111.8	I339 P341 Y344 L367 D372 I373 Q374 E378 P379 A380 L420	I339-I376 HydrophobicContact CD1-CD1 4.1Å; I339-I376 HydrophobicContact CG2-CD1 4.1Å; I339-I376 HydrophobicContact CG2-CG1 4.13Å; P341-I376 HydrophobicContact CB-CG1 4.35Å; Y344-I376 HydrophobicContact CD1-CD1 4.12Å; Y344-I376 HydrophobicContact CD2-CD1 3.45Å; Y344-I376 VanDerWaalsContact CD2-CD1 3.45Å; Y344-I376 HydrophobicContact CD2-CG1 3.82Å; Y344-I376 HydrophobicContact CE1-CD1 4.08Å; Y344-I376 HydrophobicContact CE2-CD1 3.43Å; Y344-I376 VanDerWaalsContact CE2-CD1 3.43Å; Y344-I376 HydrophobicContact CE2-CG1 4.2Å; Y344-I376 HydrophobicContact CG-CD1 3.82Å; Y344-I376 HydrophobicContact CG-CG1 4.24Å; Y344-I376 HydrophobicContact CG-CG2 4.17Å; L367-I376 HydrophobicContact CD1-CD1 3.61Å; L367-I376 HydrophobicContact CD2-CD1 3.4Å; L367-I376 HydrophobicContact CG-CD1 4.16Å; D372-I376 WeakPolarHBondContact O-CG1 3.48Å; D372-I376 PolarHBondContact O-N 3.41Å; D372-I376 VanDerWaalsContact O-N 3.11Å; I373-I376 PolarHBondContact O-N 3.47Å; Q374-I376 VanDerWaalsContact C-N 3.26Å; Q374-I376 PolarHBondContact O-N 3.16Å; I376-E378 PolarHBondContact O-N 3.12Å; I376-P379 WeakPolarHBondContact O-CD 3.36Å; I376-A380 WeakPolarHBondContact O-CB 3.29Å; I376-A380 PolarHBondContact O-N 3.38Å; I376-L420 HydrophobicContact CB-CD1 4.46Å; I376-L420 HydrophobicContact CG2-CD1 4.15Å; I376-L420 HydrophobicContact CG2-CD2 4.1Å
377	M	92.3	Very high	91.1	Very high	9 Å²	9	47 Å²	47	4%	0.044	26%	0.257	C	S	.	.	H	α-helix	trans	-61	-43.1	-173.3	-175.5	177.5	74.9	0	0	112.4	I373 Q374 A380 K381 I392 P394 L420	I373-M377 WeakPolarHBondContact O-CB 3.32Å; I373-M377 PolarHBondContact O-N 3.47Å; Q374-M377 PolarHBondContact O-N 3.48Å; M377-A380 PolarHBondContact O-N 2.79Å; M377-K381 HydrophobicContact CG-CD 4.13Å; M377-K381 HydrophobicContact CG-CG 4.29Å; M377-K381 WeakPolarHBondContact O-CB 3.29Å; M377-K381 WeakPolarHBondContact O-CG 3.43Å; M377-K381 PolarHBondContact O-N 2.5Å; M377-I392 HydrophobicContact CG-CG2 4.13Å; M377-P394 HydrophobicContact SD-CB 4.26Å; M377-P394 HydrophobicContact SD-CG 4.1Å; M377-L420 HydrophobicContact CB-CD1 3.79Å; M377-L420 HydrophobicContact CG-CD1 4.32Å
378	E	88.2	Confident	90.9	Very high	152 Å²	152	53.9 Å²	53.9	71%	0.71	29%	0.287	S	S	*	.	H	α-helix	trans	-67.6	-50.2	-175.1	-177.1	157.2	-167.1	0	0	112.7	I376 A380 K381 A382	I376-E378 PolarHBondContact O-N 3.12Å; E378-A380 VanDerWaalsContact C-N 3.3Å; E378-A380 PolarHBondContact O-N 3.18Å; E378-K381 PolarHBondContact O-N 3.33Å; E378-A382 PolarHBondContact O-N 2.86Å; E378-A382 VanDerWaalsContact O-N 3.08Å
379	P	92.7	Very high	90.9	Very high	48 Å²	48	57.2 Å²	57.2	31%	0.312	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-36	170.2	-24.7	34.6	0	0	0	113.6	P341 I345 A375 I376 A382 Y383	P341-P379 HydrophobicContact CB-CB 4.24Å; P341-P379 HydrophobicContact CB-CG 3.86Å; P341-P379 HydrophobicContact CG-CG 3.96Å; I345-P379 HydrophobicContact CD1-CB 4.07Å; I345-P379 HydrophobicContact CG1-CB 4.15Å; A375-P379 VanDerWaalsContact O-CD 3.25Å; A375-P379 WeakPolarHBondContact O-CD 3.06Å; I376-P379 WeakPolarHBondContact O-CD 3.36Å; P379-A382 PolarHBondContact O-N 3.2Å; P379-Y383 PolarHBondContact O-N 2.88Å
380	A	95	Very high	91.3	Very high	2 Å²	2	56.8 Å²	56.8	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-68.4	-37.2	178.2	0	0	0	0	0	112.2	I345 L348 I376 M377 E378 Y383 A384 I392	I345-A380 HydrophobicContact CD1-CB 3.83Å; L348-A380 HydrophobicContact CD1-CB 4.26Å; I376-A380 WeakPolarHBondContact O-CB 3.29Å; I376-A380 PolarHBondContact O-N 3.38Å; M377-A380 PolarHBondContact O-N 2.79Å; E378-A380 VanDerWaalsContact C-N 3.3Å; E378-A380 PolarHBondContact O-N 3.18Å; A380-Y383 PolarHBondContact O-N 2.74Å; A380-A384 VanDerWaalsContact O-CB 3.29Å; A380-A384 WeakPolarHBondContact O-CB 2.91Å; A380-A384 PolarHBondContact O-N 3.42Å; A380-I392 HydrophobicContact CB-CD1 4.08Å; A380-I392 HydrophobicContact CB-CG1 4.13Å; A380-I392 HydrophobicContact CB-CG2 4.18Å
381	K	93.3	Very high	91.8	Very high	43 Å²	43	52.7 Å²	52.7	19%	0.187	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-42.8	173.5	-79.4	-177.8	-179.4	-178.3	0	110.9	M377 E378 Y383 A384 E385 I392 E751	M377-K381 HydrophobicContact CG-CD 4.13Å; M377-K381 HydrophobicContact CG-CG 4.29Å; M377-K381 WeakPolarHBondContact O-CB 3.29Å; M377-K381 WeakPolarHBondContact O-CG 3.43Å; M377-K381 PolarHBondContact O-N 2.5Å; E378-K381 PolarHBondContact O-N 3.33Å; K381-Y383 PolarHBondContact O-N 2.81Å; K381-A384 WeakPolarHBondContact O-CB 3.39Å; K381-A384 PolarHBondContact O-N 3.19Å; K381-E385 WeakPolarHBondContact O-CB 3.43Å; K381-E385 PolarHBondContact O-N 3.02Å; K381-I392 HydrophobicContact CG-CB 4.08Å; K381-I392 HydrophobicContact CG-CG1 4.26Å; K381-I392 HydrophobicContact CG-CG2 4.47Å; K381-E751 IonicContact NZ-OE2 3.81Å; K381-E751 PolarHBondContact NZ-OE2 2.85Å
382	A	92.8	Very high	92.4	Very high	57 Å²	57	49.6 Å²	49.6	47%	0.471	25%	0.247	S	C	.	.	H	α-helix	trans	-59.8	-45.5	175.4	0	0	0	0	0	111.9	E378 P379 A384 E385 E386	E378-A382 PolarHBondContact O-N 2.86Å; E378-A382 VanDerWaalsContact O-N 3.08Å; P379-A382 PolarHBondContact O-N 3.2Å; A382-A384 VanDerWaalsContact C-N 3.33Å; A382-A384 PolarHBondContact O-N 3.28Å; A382-E385 PolarHBondContact O-N 3.31Å; A382-E386 PolarHBondContact O-N 3.14Å; A382-E386 VanDerWaalsContact O-N 3.08Å
383	Y	95	Very high	92.6	Very high	34 Å²	34	49.1 Å²	49.1	13%	0.133	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-39.1	174.5	-176.5	-103.6	0	0	0	112.8	I345 L348 R349 P379 A380 K381 E385 E386 T387	I345-Y383 HydrophobicContact CG2-CD2 4.21Å; I345-Y383 HydrophobicContact CG2-CG 4.23Å; L348-Y383 HydrophobicContact CB-CD1 4.01Å; L348-Y383 HydrophobicContact CB-CE1 3.74Å; L348-Y383 HydrophobicContact CD1-CD1 3.94Å; L348-Y383 HydrophobicContact CD1-CE1 4.5Å; R349-Y383 WeakPolarHBondContact CA-OH 3.26Å; P379-Y383 PolarHBondContact O-N 2.88Å; A380-Y383 PolarHBondContact O-N 2.74Å; K381-Y383 PolarHBondContact O-N 2.81Å; Y383-E385 VanDerWaalsContact C-N 3.35Å; Y383-E386 PolarHBondContact O-N 3.19Å; Y383-T387 HydrophobicContact CD1-CG2 4.34Å; Y383-T387 HydrophobicContact CD2-CG2 4.16Å; Y383-T387 HydrophobicContact CE1-CG2 3.89Å; Y383-T387 HydrophobicContact CE2-CG2 3.68Å; Y383-T387 HydrophobicContact CG-CG2 4.48Å; Y383-T387 WeakPolarHBondContact O-CB 3.5Å; Y383-T387 WeakPolarHBondContact O-CG2 3.3Å; Y383-T387 PolarHBondContact O-N 3.06Å; Y383-T387 PolarHBondContact O-OG1 2.83Å
384	A	93.7	Very high	92.7	Very high	1 Å²	1	50 Å²	50	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-66.8	-35.3	176.8	0	0	0	0	0	112.6	A380 K381 A382 K388 W390 I392	A380-A384 VanDerWaalsContact O-CB 3.29Å; A380-A384 WeakPolarHBondContact O-CB 2.91Å; A380-A384 PolarHBondContact O-N 3.42Å; K381-A384 WeakPolarHBondContact O-CB 3.39Å; K381-A384 PolarHBondContact O-N 3.19Å; A382-A384 VanDerWaalsContact C-N 3.33Å; A382-A384 PolarHBondContact O-N 3.28Å; A384-K388 WeakPolarHBondContact O-CA 3.01Å; A384-K388 PolarHBondContact O-N 3.2Å; A384-W390 HydrophobicContact CB-CB 3.9Å; A384-W390 WeakPolarHBondContact CB-O 3.32Å; A384-I392 HydrophobicContact CB-CD1 4.21Å; A384-I392 HydrophobicContact CB-CG1 3.91Å
385	E	91.6	Very high	92.9	Very high	135 Å²	135	45.9 Å²	45.9	63%	0.631	23%	0.231	S	C	*	.	H	α-helix	trans	-68.4	-42.1	175.8	-174.6	170.3	-167.3	0	0	111.9	K381 A382 Y383	K381-E385 WeakPolarHBondContact O-CB 3.43Å; K381-E385 PolarHBondContact O-N 3.02Å; A382-E385 PolarHBondContact O-N 3.31Å; Y383-E385 VanDerWaalsContact C-N 3.35Å
386	E	92.1	Very high	92.9	Very high	159 Å²	159	45 Å²	45	74%	0.743	22%	0.222	S	C	*	.	H	α-helix	trans	-64.4	-50	175.9	-174	-174.6	174.1	0	0	111.7	A382 Y383	A382-E386 PolarHBondContact O-N 3.14Å; A382-E386 VanDerWaalsContact O-N 3.08Å; Y383-E386 PolarHBondContact O-N 3.19Å
387	T	91.7	Very high	92.3	Very high	40 Å²	40	48.7 Å²	48.7	25%	0.245	25%	0.248	C	C	.	.	H	α-helix	trans	-84.9	-24.3	-173.3	59.4	0	0	0	0	114.3	Y383 R389	Y383-T387 HydrophobicContact CD1-CG2 4.34Å; Y383-T387 HydrophobicContact CD2-CG2 4.16Å; Y383-T387 HydrophobicContact CE1-CG2 3.89Å; Y383-T387 HydrophobicContact CE2-CG2 3.68Å; Y383-T387 HydrophobicContact CG-CG2 4.48Å; Y383-T387 WeakPolarHBondContact O-CB 3.5Å; Y383-T387 WeakPolarHBondContact O-CG2 3.3Å; Y383-T387 PolarHBondContact O-N 3.06Å; Y383-T387 PolarHBondContact O-OG1 2.83Å; T387-R389 WeakPolarHBondContact O-CG 3.46Å; T387-R389 PolarHBondContact O-N 2.97Å; T387-R389 VanDerWaalsContact O-N 3.15Å
388	K	91.3	Very high	91.6	Very high	144 Å²	144	48.8 Å²	48.8	63%	0.626	25%	0.25	S	S	*	.	S	Bend	trans	53.8	26	-172.1	-58.4	-179	-178.9	175.3	0	114	A384 L745	A384-K388 WeakPolarHBondContact O-CA 3.01Å; A384-K388 PolarHBondContact O-N 3.2Å; K388-L745 HydrophobicContact CB-CD1 4.09Å
389	R	92.1	Very high	91.1	Very high	80 Å²	80	42.4 Å²	42.4	30%	0.302	22%	0.221	S	C	.	.			trans	-105.1	-15.9	-176.1	-79.8	174.5	159	-112.8	3.1	114.3	D352 T387 R416	D352-R389 WeakPolarHBondContact OD1-CD 3.41Å; D352-R389 IonicContact OD1-NH1 3.88Å; D352-R389 PolarHBondContact OD1-NH1 2.74Å; T387-R389 WeakPolarHBondContact O-CG 3.46Å; T387-R389 PolarHBondContact O-N 2.97Å; T387-R389 VanDerWaalsContact O-N 3.15Å; R389-R416 PolarHBondContact O-N 2.83Å
390	W	95.3	Very high	90	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.9	-171.8	-65	94.1	0	0	0	112.5	L348 I351 D352 L363 A384 I392 R416 C418 N748	L348-W390 HydrophobicContact CD2-CD2 3.88Å; L348-W390 HydrophobicContact CD2-CE3 4.02Å; L348-W390 HydrophobicContact CD2-CG 4.5Å; L348-W390 HydrophobicContact CD2-CH2 4.03Å; L348-W390 HydrophobicContact CD2-CZ2 3.91Å; L348-W390 HydrophobicContact CD2-CZ3 4.09Å; I351-W390 HydrophobicContact CB-CH2 4.39Å; I351-W390 HydrophobicContact CB-CZ2 4.12Å; I351-W390 HydrophobicContact CD1-CH2 4.25Å; I351-W390 HydrophobicContact CG2-CH2 3.87Å; I351-W390 HydrophobicContact CG2-CZ2 3.81Å; D352-W390 PolarHBondContact OD2-NE1 3.48Å; L363-W390 HydrophobicContact CB-CH2 4.16Å; L363-W390 HydrophobicContact CB-CZ3 3.82Å; A384-W390 HydrophobicContact CB-CB 3.9Å; A384-W390 WeakPolarHBondContact CB-O 3.32Å; W390-I392 HydrophobicContact CB-CD1 3.89Å; W390-R416 CarbonylContact C-O 3.55Å; W390-R416 VanDerWaalsContact CA-O 3.26Å; W390-R416 WeakPolarHBondContact CA-O 3.21Å; W390-R416 HydrophobicContact CD2-CB 4.13Å; W390-R416 HydrophobicContact CE3-CB 3.55Å; W390-R416 HydrophobicContact CH2-CB 3.95Å; W390-R416 HydrophobicContact CH2-CG 4.44Å; W390-R416 HydrophobicContact CZ2-CB 4.45Å; W390-R416 HydrophobicContact CZ3-CB 3.46Å; W390-R416 VanDerWaalsContact CZ3-CB 3.46Å; W390-R416 HydrophobicContact CZ3-CG 4.39Å; W390-C418 HydrophobicContact CE3-CB 3.83Å; W390-C418 HydrophobicContact CZ3-CB 4.22Å; W390-N748 PolarHBondContact O-ND2 3.31Å
391	I	95.3	Very high	88.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.1	164.2	-60.7	174.7	0	0	0	107.3	L393 V415 R416 K417 C418 L743 L745 D747 N748	I391-L393 HydrophobicContact CG2-CD2 4.08Å; I391-L393 HydrophobicContact CG2-CG 4.16Å; I391-V415 HydrophobicContact CD1-CG1 3.96Å; I391-V415 HydrophobicContact CG1-CG1 3.78Å; I391-R416 PolarHBondContact N-O 3.46Å; I391-K417 CarbonylContact O-C 3.57Å; I391-K417 WeakPolarHBondContact O-CA 3.18Å; I391-C418 PolarHBondContact O-N 3.11Å; I391-L743 HydrophobicContact CD1-CB 3.64Å; I391-L743 HydrophobicContact CD1-CD1 4.45Å; I391-L743 HydrophobicContact CG2-CD1 4.46Å; I391-L745 HydrophobicContact CG1-CD2 4.26Å; I391-D747 HydrophobicContact CG2-CB 4.4Å; I391-N748 VanDerWaalsContact CA-OD1 3.28Å; I391-N748 WeakPolarHBondContact CA-OD1 3.3Å
392	I	96.2	Very high	87.9	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119.5	-174.3	-48.6	-55.7	0	0	0	109.1	M377 A380 K381 A384 W390 C418 L420 N748	M377-I392 HydrophobicContact CG-CG2 4.13Å; A380-I392 HydrophobicContact CB-CD1 4.08Å; A380-I392 HydrophobicContact CB-CG1 4.13Å; A380-I392 HydrophobicContact CB-CG2 4.18Å; K381-I392 HydrophobicContact CG-CB 4.08Å; K381-I392 HydrophobicContact CG-CG1 4.26Å; K381-I392 HydrophobicContact CG-CG2 4.47Å; A384-I392 HydrophobicContact CB-CD1 4.21Å; A384-I392 HydrophobicContact CB-CG1 3.91Å; W390-I392 HydrophobicContact CB-CD1 3.89Å; I392-C418 WeakPolarHBondContact CA-O 3.39Å; I392-C418 HydrophobicContact CD1-CB 3.66Å; I392-L420 HydrophobicContact CG2-CD1 3.87Å; I392-L420 HydrophobicContact CG2-CG 4.28Å; I392-N748 PolarHBondContact N-OD1 3.36Å
393	L	94.7	Very high	87.3	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.8	-177.4	-61.5	179.5	0	0	0	111.2	I391 K406 K417 C418 I419 L420 L743	I391-L393 HydrophobicContact CG2-CD2 4.08Å; I391-L393 HydrophobicContact CG2-CG 4.16Å; L393-K406 HydrophobicContact CD1-CB 4.24Å; L393-K406 HydrophobicContact CD2-CB 4.44Å; L393-K417 HydrophobicContact CD1-CD 3.67Å; L393-K417 HydrophobicContact CD1-CG 3.99Å; L393-C418 PolarHBondContact N-O 3.47Å; L393-I419 CarbonylContact O-C 3.58Å; L393-I419 VanDerWaalsContact O-CA 3.29Å; L393-I419 WeakPolarHBondContact O-CA 3.25Å; L393-L420 PolarHBondContact O-N 2.81Å; L393-L743 HydrophobicContact CD1-CD1 4.11Å
394	P	94.3	Very high	86.8	Confident	18 Å²	18	44 Å²	44	12%	0.117	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	152.5	170.9	31.8	-34	0	0	0	111.2	I373 M377 L399 L420	I373-P394 HydrophobicContact CG2-CB 3.81Å; M377-P394 HydrophobicContact SD-CB 4.26Å; M377-P394 HydrophobicContact SD-CG 4.1Å; P394-L399 HydrophobicContact CB-CD1 4.15Å; P394-L399 HydrophobicContact CG-CD1 4.06Å; P394-L399 HydrophobicContact CG-CD2 4.33Å; P394-L399 WeakPolarHBondContact O-CD1 3.12Å; P394-L420 CarbonylContact C-O 3.55Å
395	L	91.9	Very high	86.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	99.9	173.2	-175.4	61.4	0	0	0	111.5	Q404 V407 I419 L420 S421 T422 I424 A425 I431	L395-Q404 HydrophobicContact CD1-CB 4.19Å; L395-Q404 HydrophobicContact CD1-CG 4.13Å; L395-V407 HydrophobicContact CB-CG1 4.34Å; L395-V407 HydrophobicContact CD1-CG1 4.1Å; L395-V407 HydrophobicContact CD2-CG1 4.27Å; L395-V407 HydrophobicContact CD2-CG2 4.47Å; L395-V407 HydrophobicContact CG-CG1 4.47Å; L395-I419 HydrophobicContact CB-CG2 3.83Å; L395-I419 HydrophobicContact CD2-CG2 4.11Å; L395-L420 PolarHBondContact N-O 3.24Å; L395-S421 WeakPolarHBondContact O-CA 3.48Å; L395-T422 PolarHBondContact O-N 2.85Å; L395-T422 VanDerWaalsContact O-N 3.1Å; L395-T422 PolarHBondContact O-OG1 2.75Å; L395-I424 HydrophobicContact CG-CG2 4.47Å; L395-A425 HydrophobicContact CD2-CB 3.93Å; L395-I431 HydrophobicContact CD2-CD1 4.41Å
396	H	89.6	Confident	86	Confident	13 Å²	13	42.4 Å²	42.4	6%	0.06	23%	0.228	C	C	.	.			trans	-148.9	167.5	174.4	58.2	84.4	0	0	0	110.9	M370 I373 A398 L399 Q404 T422 I424	M370-H396 HydrophobicContact CG-CB 4Å; M370-H396 PolarHBondContact SD-ND1 3.25Å; I373-H396 HydrophobicContact CD1-CB 4.08Å; H396-A398 VanDerWaalsContact C-N 3.29Å; H396-A398 PolarHBondContact O-N 3.35Å; H396-L399 WeakPolarHBondContact O-CB 3.15Å; H396-L399 PolarHBondContact O-N 3.24Å; H396-Q404 PolarHBondContact O-NE2 2.96Å; H396-T422 HydrophobicContact CB-CG2 4.08Å; H396-I424 VanDerWaalsContact C-CD1 3.41Å
397	S	80.4	Confident	85.8	Confident	78 Å²	78	34.8 Å²	34.8	55%	0.545	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-25.6	-167.9	50.9	0	0	0	0	113.9	L399	S397-L399 VanDerWaalsContact C-N 3.29Å; S397-L399 PolarHBondContact O-N 3.05Å
398	A	76.4	Confident	85.6	Confident	11 Å²	11	34.9 Å²	34.9	9%	0.091	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.1	178.3	0	0	0	0	0	113.7	M370 H396 R685	M370-A398 HydrophobicContact SD-CB 3.59Å; M370-A398 VanDerWaalsContact SD-CB 3.59Å; H396-A398 VanDerWaalsContact C-N 3.29Å; H396-A398 PolarHBondContact O-N 3.35Å; A398-R685 PolarHBondContact O-NH2 2.84Å
399	L	77.9	Confident	85.4	Confident	18 Å²	18	29.3 Å²	29.3	9%	0.094	17%	0.165	C	C	.	.	S	Bend	trans	-64.2	151.4	178.2	-70.2	177.4	0	0	0	112.2	P394 H396 S397 D403 Q404	P394-L399 HydrophobicContact CB-CD1 4.15Å; P394-L399 HydrophobicContact CG-CD1 4.06Å; P394-L399 HydrophobicContact CG-CD2 4.33Å; P394-L399 WeakPolarHBondContact O-CD1 3.12Å; H396-L399 WeakPolarHBondContact O-CB 3.15Å; H396-L399 PolarHBondContact O-N 3.24Å; S397-L399 VanDerWaalsContact C-N 3.29Å; S397-L399 PolarHBondContact O-N 3.05Å; L399-D403 HydrophobicContact CB-CB 4.24Å; L399-D403 HydrophobicContact CD2-CB 4.44Å; L399-Q404 HydrophobicContact CB-CG 3.78Å; L399-Q404 PolarHBondContact O-NE2 3.01Å
400	S	70.2	Confident	85.1	Confident	22 Å²	22	27.6 Å²	27.6	15%	0.154	16%	0.164	C	C	.	.			trans	-59.6	155.2	173.3	83.5	0	0	0	0	111.2	S402 D403 Q404	S400-S402 PolarHBondContact O-N 3.33Å; S400-S402 PolarHBondContact OG-OG 3.11Å; S400-D403 WeakPolarHBondContact CB-OD2 3.3Å; S400-D403 PolarHBondContact O-N 3.01Å; S400-D403 VanDerWaalsContact O-N 3.14Å; S400-D403 WeakPolarHBondContact OG-CB 3.44Å; S400-D403 PolarHBondContact OG-N 2.81Å; S400-D403 PolarHBondContact OG-OD2 3.39Å; S400-Q404 WeakPolarHBondContact O-CG 3.46Å; S400-Q404 PolarHBondContact O-N 3.26Å
401	A	72	Confident	84.8	Confident	52 Å²	52	27.9 Å²	27.9	43%	0.43	17%	0.166	S	C	.	.	H	α-helix	trans	-61.3	-36.2	177.7	0	0	0	0	0	111.5	E405	A401-E405 WeakPolarHBondContact O-CB 3.33Å; A401-E405 PolarHBondContact O-N 2.95Å; A401-E405 VanDerWaalsContact O-N 3.09Å
402	S	71.8	Confident	84.5	Confident	70 Å²	70	29.3 Å²	29.3	49%	0.49	18%	0.175	S	C	.	.	H	α-helix	trans	-66.7	-37.1	174.7	39.3	0	0	0	0	113.2	S400 E405 K406	S400-S402 PolarHBondContact O-N 3.33Å; S400-S402 PolarHBondContact OG-OG 3.11Å; S402-E405 WeakPolarHBondContact O-CB 3.21Å; S402-E405 PolarHBondContact O-N 2.98Å; S402-K406 PolarHBondContact O-N 3.4Å
403	D	81	Confident	83.9	Confident	44 Å²	44	34.7 Å²	34.7	24%	0.235	20%	0.204	C	C	.	.	H	α-helix	trans	-73.5	-40.8	178.5	-68.2	-43.9	0	0	0	111.5	L399 S400 E405 K406	L399-D403 HydrophobicContact CB-CB 4.24Å; L399-D403 HydrophobicContact CD2-CB 4.44Å; S400-D403 WeakPolarHBondContact CB-OD2 3.3Å; S400-D403 PolarHBondContact O-N 3.01Å; S400-D403 VanDerWaalsContact O-N 3.14Å; S400-D403 WeakPolarHBondContact OG-CB 3.44Å; S400-D403 PolarHBondContact OG-N 2.81Å; S400-D403 PolarHBondContact OG-OD2 3.39Å; D403-E405 PolarHBondContact O-N 2.78Å; D403-K406 WeakPolarHBondContact O-CB 3.31Å; D403-K406 PolarHBondContact O-N 3.34Å; D403-K406 VanDerWaalsContact OD1-CE 3.24Å; D403-K406 WeakPolarHBondContact OD1-CE 3.47Å; D403-K406 IonicContact OD1-NZ 3.92Å; D403-K406 PolarHBondContact OD1-NZ 3.49Å
404	Q	84	Confident	83.6	Confident	29 Å²	29	37.5 Å²	37.5	14%	0.136	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-33.3	171.8	-66	-179.4	27.5	0	0	111.3	I197 L395 H396 L399 S400 K406 V407	I197-Q404 HydrophobicContact CD1-CB 4.15Å; L395-Q404 HydrophobicContact CD1-CB 4.19Å; L395-Q404 HydrophobicContact CD1-CG 4.13Å; H396-Q404 PolarHBondContact O-NE2 2.96Å; L399-Q404 HydrophobicContact CB-CG 3.78Å; L399-Q404 PolarHBondContact O-NE2 3.01Å; S400-Q404 WeakPolarHBondContact O-CG 3.46Å; S400-Q404 PolarHBondContact O-N 3.26Å; Q404-K406 VanDerWaalsContact C-N 3.31Å; Q404-K406 PolarHBondContact O-N 2.78Å; Q404-V407 WeakPolarHBondContact O-CG2 3.45Å
405	E	81.9	Confident	83.5	Confident	52 Å²	52	37.8 Å²	37.8	24%	0.243	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-26.9	179.4	-168.6	176	-176.8	0	0	113.5	A401 S402 D403 V407 F408 S737	A401-E405 WeakPolarHBondContact O-CB 3.33Å; A401-E405 PolarHBondContact O-N 2.95Å; A401-E405 VanDerWaalsContact O-N 3.09Å; S402-E405 WeakPolarHBondContact O-CB 3.21Å; S402-E405 PolarHBondContact O-N 2.98Å; D403-E405 PolarHBondContact O-N 2.78Å; E405-V407 PolarHBondContact O-N 3.47Å; E405-F408 HydrophobicContact CG-CD2 4.23Å; E405-F408 WeakPolarHBondContact O-CD2 3.48Å; E405-F408 PolarHBondContact O-N 3.31Å; E405-S737 VanDerWaalsContact CD-OG 3.29Å; E405-S737 VanDerWaalsContact OE1-C 3.28Å; E405-S737 VanDerWaalsContact OE1-CA 3.31Å; E405-S737 WeakPolarHBondContact OE1-CA 3.37Å; E405-S737 WeakPolarHBondContact OE1-CB 3.41Å; E405-S737 VanDerWaalsContact OE1-O 3.06Å; E405-S737 PolarHBondContact OE1-OG 2.97Å; E405-S737 PolarHBondContact OE2-OG 3.36Å
406	K	86.3	Confident	83.6	Confident	50 Å²	50	38.1 Å²	38.1	22%	0.217	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-55.4	-30.1	179.7	-66.1	176.6	-179.9	165.8	0	112.3	L393 S402 D403 Q404 F408 H409	L393-K406 HydrophobicContact CD1-CB 4.24Å; L393-K406 HydrophobicContact CD2-CB 4.44Å; S402-K406 PolarHBondContact O-N 3.4Å; D403-K406 WeakPolarHBondContact O-CB 3.31Å; D403-K406 PolarHBondContact O-N 3.34Å; D403-K406 VanDerWaalsContact OD1-CE 3.24Å; D403-K406 WeakPolarHBondContact OD1-CE 3.47Å; D403-K406 IonicContact OD1-NZ 3.92Å; D403-K406 PolarHBondContact OD1-NZ 3.49Å; Q404-K406 VanDerWaalsContact C-N 3.31Å; Q404-K406 PolarHBondContact O-N 2.78Å; K406-F408 PolarHBondContact O-N 3.41Å; K406-H409 WeakPolarHBondContact O-CB 3.26Å; K406-H409 PolarHBondContact O-N 2.91Å
407	V	88.7	Confident	83.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-63.3	-23.9	179.4	-49.1	0	0	0	0	113	L395 Q404 E405 K417 I419 I431	L395-V407 HydrophobicContact CB-CG1 4.34Å; L395-V407 HydrophobicContact CD1-CG1 4.1Å; L395-V407 HydrophobicContact CD2-CG1 4.27Å; L395-V407 HydrophobicContact CD2-CG2 4.47Å; L395-V407 HydrophobicContact CG-CG1 4.47Å; Q404-V407 WeakPolarHBondContact O-CG2 3.45Å; E405-V407 PolarHBondContact O-N 3.47Å; V407-K417 PolarHBondContact O-NZ 3.06Å; V407-I419 HydrophobicContact CB-CD1 4.01Å; V407-I419 HydrophobicContact CB-CG1 4.41Å; V407-I419 HydrophobicContact CG1-CD1 4.49Å; V407-I419 HydrophobicContact CG1-CG1 4.39Å; V407-I419 HydrophobicContact CG1-CG2 4.22Å; V407-I431 HydrophobicContact CB-CD1 4.24Å; V407-I431 HydrophobicContact CG2-CD1 3.88Å; V407-I431 HydrophobicContact CG2-CG1 4.27Å; V407-I431 WeakPolarHBondContact O-CG2 3.31Å
408	F	87.2	Confident	84.7	Confident	42 Å²	42	33.9 Å²	33.9	18%	0.184	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-86.2	-7.5	177.7	-54.2	-68.5	0	0	0	113.7	I197 E405 K406 L429 I431	I197-F408 HydrophobicContact CD1-CE2 3.99Å; I197-F408 HydrophobicContact CD1-CZ 4.02Å; I197-F408 HydrophobicContact CG1-CE2 4.36Å; I197-F408 HydrophobicContact CG1-CZ 4.27Å; E405-F408 HydrophobicContact CG-CD2 4.23Å; E405-F408 WeakPolarHBondContact O-CD2 3.48Å; E405-F408 PolarHBondContact O-N 3.31Å; K406-F408 PolarHBondContact O-N 3.41Å; F408-L429 HydrophobicContact CE1-CD2 4.29Å; F408-L429 HydrophobicContact CZ-CD2 3.86Å; F408-I431 HydrophobicContact CD1-CG1 4.35Å; F408-I431 HydrophobicContact CE1-CG1 4.15Å
409	H	87	Confident	85.7	Confident	26 Å²	26	33.4 Å²	33.4	12%	0.12	19%	0.194	C	C	.	.	S	Bend	trans	-76.9	160.3	176.2	-63.2	-15.2	0	0	0	111.7	K406 K417 R741 L743	K406-H409 WeakPolarHBondContact O-CB 3.26Å; K406-H409 PolarHBondContact O-N 2.91Å; H409-K417 PolarHBondContact O-NZ 2.98Å; H409-R741 WeakPolarHBondContact CB-O 3.21Å; H409-L743 HydrophobicContact CB-CD1 4.12Å; H409-L743 HydrophobicContact CB-CD2 3.71Å; H409-L743 HydrophobicContact CB-CG 3.64Å
410	V	86.2	Confident	86.6	Confident	45 Å²	45	32.6 Å²	32.6	27%	0.273	19%	0.19	S	C	.	.	B	Isolated β-bridge	trans	-98.7	131.2	-173.2	-178.3	0	0	0	0	108.9	R740 R741 L742 L743	V410-R740 HydrophobicContact CG2-CB 4.26Å; V410-R741 PolarHBondContact N-O 2.96Å; V410-R741 VanDerWaalsContact N-O 3.11Å; V410-L742 CarbonylContact O-C 3.51Å; V410-L742 WeakPolarHBondContact O-CA 3.36Å; V410-L743 PolarHBondContact O-N 2.9Å
411	A	88.2	Confident	87.8	Confident	6 Å²	6	31.5 Å²	31.5	5%	0.05	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-69.6	150.6	172.7	0	0	0	0	0	111.3	V415 K417	A411-V415 WeakPolarHBondContact CB-O 3.37Å; A411-K417 HydrophobicContact CB-CB 4.42Å
412	P	88	Confident	88.8	Confident	29 Å²	29	29.7 Å²	29.7	19%	0.188	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-52.9	158.6	169.1	-25.9	35.1	0	0	0	113.3	V415 L742 L743	P412-V415 HydrophobicContact CB-CB 4.26Å; P412-V415 HydrophobicContact CB-CG2 4.21Å; P412-V415 PolarHBondContact O-N 2.98Å; P412-V415 VanDerWaalsContact O-N 3.16Å; P412-V415 VanDerWaalsContact O-O 3.11Å; P412-L742 HydrophobicContact CG-CD2 4.47Å; P412-L742 HydrophobicContact CG-CG 4.26Å; P412-L743 VanDerWaalsContact CD-O 3.28Å; P412-L743 WeakPolarHBondContact CD-O 3.5Å; P412-L743 WeakPolarHBondContact CG-O 3.26Å
413	D	85	Confident	89.7	Confident	116 Å²	116	29.2 Å²	29.2	62%	0.62	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	142.6	170	-70.3	-35.5	0	0	0	110.3	R360 V415	R360-D413 IonicContact CZ-OD1 2.73Å; R360-D413 IonicContact NE-OD1 3.4Å; R360-D413 IonicContact NH2-OD1 3.69Å; R360-D413 PolarHBondContact NH2-OD1 3.24Å; D413-V415 PolarHBondContact O-N 3.44Å
414	C	87.5	Confident	90	Very high	67 Å²	67	28 Å²	28	45%	0.453	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	5.2	-175.3	-55.5	0	0	0	0	116.4	A357	A357-C414 HydrophobicContact CB-CB 4.12Å; A357-C414 WeakPolarHBondContact O-CA 3.46Å
415	V	92.4	Very high	90.3	Very high	24 Å²	24	26.6 Å²	26.6	15%	0.145	15%	0.145	C	C	.	.			trans	-118.4	137.9	174.7	-178.6	0	0	0	0	109.2	I391 A411 P412 D413 L745	I391-V415 HydrophobicContact CD1-CG1 3.96Å; I391-V415 HydrophobicContact CG1-CG1 3.78Å; A411-V415 WeakPolarHBondContact CB-O 3.37Å; P412-V415 HydrophobicContact CB-CB 4.26Å; P412-V415 HydrophobicContact CB-CG2 4.21Å; P412-V415 PolarHBondContact O-N 2.98Å; P412-V415 VanDerWaalsContact O-N 3.16Å; P412-V415 VanDerWaalsContact O-O 3.11Å; D413-V415 PolarHBondContact O-N 3.44Å; V415-L745 HydrophobicContact CG1-CD2 4.08Å; V415-L745 HydrophobicContact CG2-CD2 4.49Å
416	R	94.8	Very high	90.6	Very high	6 Å²	6	25 Å²	25	2%	0.023	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	153.5	176.9	-63.8	175.1	179.4	137.3	-0.3	110.1	D352 Y355 P356 E359 G361 R389 W390 I391	D352-R416 IonicContact OD1-NH1 2.72Å; D352-R416 PolarHBondContact OD1-NH1 3.39Å; D352-R416 VanDerWaalsContact OD1-NH1 3.16Å; Y355-R416 VanDerWaalsContact CB-NH2 3.35Å; Y355-R416 PolarHBondContact O-NH1 2.98Å; Y355-R416 PolarHBondContact O-NH2 3.38Å; P356-R416 PolarHBondContact O-NH2 3.36Å; E359-R416 PolarHBondContact O-NH2 2.97Å; G361-R416 WeakPolarHBondContact O-CD 3.16Å; G361-R416 VanDerWaalsContact O-CG 3.24Å; G361-R416 WeakPolarHBondContact O-CG 3.38Å; R389-R416 PolarHBondContact O-N 2.83Å; W390-R416 CarbonylContact C-O 3.55Å; W390-R416 VanDerWaalsContact CA-O 3.26Å; W390-R416 WeakPolarHBondContact CA-O 3.21Å; W390-R416 HydrophobicContact CD2-CB 4.13Å; W390-R416 HydrophobicContact CE3-CB 3.55Å; W390-R416 HydrophobicContact CH2-CB 3.95Å; W390-R416 HydrophobicContact CH2-CG 4.44Å; W390-R416 HydrophobicContact CZ2-CB 4.45Å; W390-R416 HydrophobicContact CZ3-CB 3.46Å; W390-R416 VanDerWaalsContact CZ3-CB 3.46Å; W390-R416 HydrophobicContact CZ3-CG 4.39Å; I391-R416 PolarHBondContact N-O 3.46Å
417	K	94.5	Very high	90.3	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.009	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	136.6	169.9	159.1	-173.9	66.9	-160.5	0	109.5	D362 L363 I391 L393 V407 H409 A411 I419 L743	D362-K417 CarbonylContact C-O 3.51Å; D362-K417 VanDerWaalsContact CA-O 3.31Å; D362-K417 WeakPolarHBondContact CA-O 3.42Å; D362-K417 HydrophobicContact CB-CB 4.38Å; D362-K417 WeakPolarHBondContact CB-O 3.41Å; D362-K417 PolarHBondContact OD1-N 3.41Å; D362-K417 WeakPolarHBondContact OD2-CE 3.15Å; D362-K417 IonicContact OD2-NZ 2.68Å; D362-K417 PolarHBondContact OD2-NZ 3.21Å; L363-K417 PolarHBondContact N-O 2.76Å; I391-K417 CarbonylContact O-C 3.57Å; I391-K417 WeakPolarHBondContact O-CA 3.18Å; L393-K417 HydrophobicContact CD1-CD 3.67Å; L393-K417 HydrophobicContact CD1-CG 3.99Å; V407-K417 PolarHBondContact O-NZ 3.06Å; H409-K417 PolarHBondContact O-NZ 2.98Å; A411-K417 HydrophobicContact CB-CB 4.42Å; K417-I419 HydrophobicContact CD-CD1 3.75Å; K417-I419 HydrophobicContact CD-CG1 3.79Å; K417-I419 HydrophobicContact CG-CD1 4.14Å; K417-I419 HydrophobicContact CG-CG1 3.75Å; K417-L743 HydrophobicContact CD-CD1 4.3Å
418	C	97.2	Very high	89.8	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.007	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	117.7	170	-179.1	0	0	0	0	108.6	L348 L363 W390 I391 I392 L393	L348-C418 HydrophobicContact CD2-CB 4.35Å; L363-C418 CarbonylContact O-C 3.46Å; L363-C418 WeakPolarHBondContact O-CA 3.16Å; W390-C418 HydrophobicContact CE3-CB 3.83Å; W390-C418 HydrophobicContact CZ3-CB 4.22Å; I391-C418 PolarHBondContact O-N 3.11Å; I392-C418 WeakPolarHBondContact CA-O 3.39Å; I392-C418 HydrophobicContact CD1-CB 3.66Å; L393-C418 PolarHBondContact N-O 3.47Å
419	I	97.2	Very high	89.5	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.9	179.5	-62	158.1	0	0	0	108.8	L363 L364 I365 L393 L395 V407 K417 I431 I434	L363-I419 PolarHBondContact O-N 3.22Å; L364-I419 HydrophobicContact CD1-CB 3.83Å; L364-I419 HydrophobicContact CD1-CG2 3.71Å; I365-I419 PolarHBondContact N-O 3.1Å; L393-I419 CarbonylContact O-C 3.58Å; L393-I419 VanDerWaalsContact O-CA 3.29Å; L393-I419 WeakPolarHBondContact O-CA 3.25Å; L395-I419 HydrophobicContact CB-CG2 3.83Å; L395-I419 HydrophobicContact CD2-CG2 4.11Å; V407-I419 HydrophobicContact CB-CD1 4.01Å; V407-I419 HydrophobicContact CB-CG1 4.41Å; V407-I419 HydrophobicContact CG1-CD1 4.49Å; V407-I419 HydrophobicContact CG1-CG1 4.39Å; V407-I419 HydrophobicContact CG1-CG2 4.22Å; K417-I419 HydrophobicContact CD-CD1 3.75Å; K417-I419 HydrophobicContact CD-CG1 3.79Å; K417-I419 HydrophobicContact CG-CD1 4.14Å; K417-I419 HydrophobicContact CG-CG1 3.75Å; I419-I431 HydrophobicContact CD1-CD1 3.95Å; I419-I431 HydrophobicContact CD1-CG2 3.87Å; I419-I434 HydrophobicContact CD1-CD1 3.97Å
420	L	97.3	Very high	89	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	100.9	175.5	-55.6	180	0	0	0	108.5	I365 L367 I373 I376 M377 I392 L393 P394 L395	I365-L420 HydrophobicContact CB-CD2 3.96Å; I365-L420 HydrophobicContact CD1-CD2 3.65Å; I365-L420 HydrophobicContact CG1-CD2 3.99Å; L367-L420 HydrophobicContact CD1-CB 4.23Å; L367-L420 HydrophobicContact CD1-CD2 4.46Å; I373-L420 HydrophobicContact CG1-CB 4.33Å; I373-L420 HydrophobicContact CG2-CB 3.99Å; I376-L420 HydrophobicContact CB-CD1 4.46Å; I376-L420 HydrophobicContact CG2-CD1 4.15Å; I376-L420 HydrophobicContact CG2-CD2 4.1Å; M377-L420 HydrophobicContact CB-CD1 3.79Å; M377-L420 HydrophobicContact CG-CD1 4.32Å; I392-L420 HydrophobicContact CG2-CD1 3.87Å; I392-L420 HydrophobicContact CG2-CG 4.28Å; L393-L420 PolarHBondContact O-N 2.81Å; P394-L420 CarbonylContact C-O 3.55Å; L395-L420 PolarHBondContact N-O 3.24Å
421	S	96.2	Very high	88.9	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146.2	-170	-174.1	0	0	0	0	113	I365 F366 L367 L395 A425	I365-S421 PolarHBondContact O-N 3.48Å; F366-S421 CarbonylContact C-O 3.36Å; F366-S421 WeakPolarHBondContact CA-O 3.42Å; L367-S421 PolarHBondContact N-O 3.48Å; L395-S421 WeakPolarHBondContact O-CA 3.48Å; S421-A425 VanDerWaalsContact OG-CB 3.26Å; S421-A425 WeakPolarHBondContact OG-CB 3.45Å; S421-A425 PolarHBondContact OG-N 3.49Å
422	T	93.3	Very high	88.6	Confident	13 Å²	13	22.4 Å²	22.4	8%	0.08	13%	0.128	C	C	.	.			trans	-73.6	-165.3	156.4	52.1	0	0	0	0	110.2	F366 L367 I373 L395 H396 I424	F366-T422 WeakPolarHBondContact CD1-O 3.4Å; L367-T422 WeakPolarHBondContact O-CA 3.43Å; I373-T422 HydrophobicContact CD1-CG2 3.82Å; L395-T422 PolarHBondContact O-N 2.85Å; L395-T422 VanDerWaalsContact O-N 3.1Å; L395-T422 PolarHBondContact O-OG1 2.75Å; H396-T422 HydrophobicContact CB-CG2 4.08Å; T422-I424 PolarHBondContact O-N 2.83Å; T422-I424 WeakPolarHBondContact OG1-CG1 3.31Å
423	N	90.4	Very high	88.6	Confident	60 Å²	60	22.2 Å²	22.2	32%	0.321	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	-63.3	-2.6	172.8	67.7	-21.8	0	0	0	114.8	A425 E426 V443	N423-A425 VanDerWaalsContact C-N 3.29Å; N423-A425 PolarHBondContact O-N 3.46Å; N423-E426 HydrophobicContact CB-CB 4.4Å; N423-E426 WeakPolarHBondContact O-CB 3.33Å; N423-E426 PolarHBondContact O-N 3.37Å; N423-V443 HydrophobicContact CB-CG2 4.47Å
424	I	87.8	Confident	89	Confident	18 Å²	18	17 Å²	17	9%	0.092	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-59	-37.4	179	-65.6	-179.2	0	0	0	113	L395 H396 T422 E426 L429	L395-I424 HydrophobicContact CG-CG2 4.47Å; H396-I424 VanDerWaalsContact C-CD1 3.41Å; T422-I424 PolarHBondContact O-N 2.83Å; T422-I424 WeakPolarHBondContact OG1-CG1 3.31Å; I424-E426 VanDerWaalsContact C-N 3.27Å; I424-E426 PolarHBondContact O-N 2.95Å; I424-L429 HydrophobicContact CG2-CD1 3.92Å; I424-L429 WeakPolarHBondContact O-CD1 3.44Å
425	A	90.3	Very high	89.3	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.008	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-80	-4.1	176.4	0	0	0	0	0	114.1	L364 F366 L395 S421 N423 T427 R473	L364-A425 HydrophobicContact CD1-CB 3.95Å; L364-A425 HydrophobicContact CD2-CB 3.97Å; F366-A425 HydrophobicContact CE1-CB 3.97Å; F366-A425 HydrophobicContact CZ-CB 4.18Å; L395-A425 HydrophobicContact CD2-CB 3.93Å; S421-A425 VanDerWaalsContact OG-CB 3.26Å; S421-A425 WeakPolarHBondContact OG-CB 3.45Å; S421-A425 PolarHBondContact OG-N 3.49Å; N423-A425 VanDerWaalsContact C-N 3.29Å; N423-A425 PolarHBondContact O-N 3.46Å; A425-T427 PolarHBondContact O-N 3.17Å; A425-R473 WeakPolarHBondContact O-CD 3.47Å; A425-R473 PolarHBondContact O-NE 3.05Å
426	E	88.2	Confident	89.5	Confident	17 Å²	17	15 Å²	15	8%	0.079	8%	0.084	C	C	.	.	S	Bend	trans	-69.1	-34	-170	-172.9	170.9	145.1	0	0	113.3	F366 N423 I424 S466 Q469 R470 R473	F366-E426 HydrophobicContact CE1-CB 3.97Å; F366-E426 HydrophobicContact CZ-CB 4.46Å; N423-E426 HydrophobicContact CB-CB 4.4Å; N423-E426 WeakPolarHBondContact O-CB 3.33Å; N423-E426 PolarHBondContact O-N 3.37Å; I424-E426 VanDerWaalsContact C-N 3.27Å; I424-E426 PolarHBondContact O-N 2.95Å; E426-S466 WeakPolarHBondContact OE1-CA 3.43Å; E426-S466 WeakPolarHBondContact OE1-CB 3.41Å; E426-S466 PolarHBondContact OE1-OG 3.37Å; E426-S466 PolarHBondContact OE2-OG 2.78Å; E426-S466 VanDerWaalsContact OE2-OG 3.14Å; E426-Q469 HydrophobicContact CG-CB 4.08Å; E426-R470 HydrophobicContact CG-CG 3.96Å; E426-R470 IonicContact OE2-CZ 2.66Å; E426-R470 IonicContact OE2-NE 3.25Å; E426-R470 PolarHBondContact OE2-NE 3.44Å; E426-R470 IonicContact OE2-NH2 3.58Å; E426-R470 PolarHBondContact OE2-NH2 3.36Å; E426-R473 VanDerWaalsContact C-CZ 3.41Å; E426-R473 PolarHBondContact O-NE 3.07Å; E426-R473 PolarHBondContact O-NH2 3.42Å
427	T	79.7	Confident	89.7	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-138.9	153.7	-177.2	45.8	0	0	0	0	113.5	R195 E265 A425 L429 Q469	R195-T427 PolarHBondContact NH1-OG1 3.17Å; E265-T427 HydrophobicContact CG-CG2 4.35Å; E265-T427 WeakPolarHBondContact OE1-CB 3.37Å; E265-T427 WeakPolarHBondContact OE1-CG2 3.42Å; E265-T427 PolarHBondContact OE1-OG1 3.18Å; E265-T427 PolarHBondContact OE2-OG1 3.15Å; A425-T427 PolarHBondContact O-N 3.17Å; T427-L429 PolarHBondContact O-N 2.9Å; T427-Q469 HydrophobicContact CG2-CG 4.46Å
428	S	76.7	Confident	89.8	Confident	5 Å²	5	14.6 Å²	14.6	4%	0.035	8%	0.082	C	C	.	.	S	Bend	trans	57.7	-20	178	-30	0	0	0	0	118.9	Q193 A198 E262	Q193-S428 PolarHBondContact OE1-OG 2.78Å; A198-S428 VanDerWaalsContact CB-CB 3.41Å; E262-S428 VanDerWaalsContact CG-OG 3.26Å; E262-S428 WeakPolarHBondContact CG-OG 3.41Å; E262-S428 WeakPolarHBondContact OE1-CA 3.43Å; E262-S428 PolarHBondContact OE1-N 3.18Å; E262-S428 PolarHBondContact OE1-OG 2.83Å
429	L	81.6	Confident	89.8	Confident	2 Å²	2	14.6 Å²	14.6	1%	0.01	8%	0.082	C	C	.	.			trans	-80.2	122.5	178.6	-74	-173.7	0	0	0	111.4	I197 F408 I424 T427 R473 R476	I197-L429 HydrophobicContact CB-CD2 4.4Å; I197-L429 HydrophobicContact CD1-CD1 4.41Å; I197-L429 HydrophobicContact CD1-CD2 4.19Å; I197-L429 HydrophobicContact CG1-CD2 3.93Å; I197-L429 HydrophobicContact CG2-CD1 4.29Å; I197-L429 HydrophobicContact CG2-CD2 3.84Å; I197-L429 HydrophobicContact CG2-CG 4.39Å; F408-L429 HydrophobicContact CE1-CD2 4.29Å; F408-L429 HydrophobicContact CZ-CD2 3.86Å; I424-L429 HydrophobicContact CG2-CD1 3.92Å; I424-L429 WeakPolarHBondContact O-CD1 3.44Å; T427-L429 PolarHBondContact O-N 2.9Å; L429-R473 PolarHBondContact O-NH1 3.27Å; L429-R476 PolarHBondContact O-NH1 3.46Å; L429-R476 VanDerWaalsContact O-NH1 3.17Å
430	T	76.5	Confident	89.7	Confident	40 Å²	40	15.3 Å²	15.3	25%	0.245	9%	0.087	C	C	.	.			trans	-100.4	93.9	174.2	56.2	0	0	0	0	109.8
431	I	85	Confident	89.6	Confident	12 Å²	12	15.3 Å²	15.3	6%	0.062	9%	0.087	C	C	.	.			trans	-96.7	114.3	171.3	-54.4	177.4	0	0	0	107.4	L395 V407 F408 I419 I434	L395-I431 HydrophobicContact CD2-CD1 4.41Å; V407-I431 HydrophobicContact CB-CD1 4.24Å; V407-I431 HydrophobicContact CG2-CD1 3.88Å; V407-I431 HydrophobicContact CG2-CG1 4.27Å; V407-I431 WeakPolarHBondContact O-CG2 3.31Å; F408-I431 HydrophobicContact CD1-CG1 4.35Å; F408-I431 HydrophobicContact CE1-CG1 4.15Å; I419-I431 HydrophobicContact CD1-CD1 3.95Å; I419-I431 HydrophobicContact CD1-CG2 3.87Å; I431-I434 HydrophobicContact CB-CD1 4.3Å; I431-I434 HydrophobicContact CB-CG1 3.91Å; I431-I434 HydrophobicContact CG2-CD1 3.76Å; I431-I434 HydrophobicContact CG2-CG1 3.85Å
432	D	81.1	Confident	89.5	Confident	57 Å²	57	19.2 Å²	19.2	31%	0.305	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	144.5	179.2	-70.8	6.2	0	0	0	110.3	R740	D432-R740 VanDerWaalsContact CG-NH2 3.34Å; D432-R740 IonicContact OD1-NH2 2.7Å; D432-R740 IonicContact OD2-CZ 2.88Å; D432-R740 IonicContact OD2-NH1 2.77Å; D432-R740 PolarHBondContact OD2-NH1 2.74Å; D432-R740 IonicContact OD2-NH2 3.92Å; D432-R740 PolarHBondContact OD2-NH2 3.18Å
433	G	87.6	Confident	89.5	Confident	25 Å²	25	19 Å²	19	26%	0.258	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	-5.7	175.1	0	0	0	0	0	115.1	D362 R435	D362-G433 PolarHBondContact N-O 2.93Å; G433-R435 PolarHBondContact O-N 2.91Å
434	I	93.2	Very high	89.5	Confident	5 Å²	5	19.8 Å²	19.8	3%	0.026	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	110.9	173.6	-56.4	-54.4	0	0	0	109.4	D362 L364 I419 I431 V437	D362-I434 HydrophobicContact CB-CD1 3.9Å; L364-I434 HydrophobicContact CB-CD1 4.03Å; L364-I434 HydrophobicContact CB-CG2 3.99Å; I419-I434 HydrophobicContact CD1-CD1 3.97Å; I431-I434 HydrophobicContact CB-CD1 4.3Å; I431-I434 HydrophobicContact CB-CG1 3.91Å; I431-I434 HydrophobicContact CG2-CD1 3.76Å; I431-I434 HydrophobicContact CG2-CG1 3.85Å; I434-V437 HydrophobicContact CG2-CG2 4.02Å
435	R	94.5	Very high	89.4	Confident	49 Å²	49	21.1 Å²	21.1	19%	0.185	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-38.4	175.7	-175.1	176.2	178.9	123.6	-8.5	110.9	E359 G361 D362 G433 A474 P479 G480 V481	E359-R435 IonicContact OE1-CZ 3.92Å; E359-R435 IonicContact OE1-NE 2.86Å; E359-R435 IonicContact OE1-NH1 2.63Å; E359-R435 PolarHBondContact OE1-NH1 3.07Å; E359-R435 IonicContact OE1-NH2 3.7Å; E359-R435 PolarHBondContact OE1-NH2 3.23Å; G361-R435 VanDerWaalsContact CA-CB 3.49Å; D362-R435 PolarHBondContact O-N 3.44Å; G433-R435 PolarHBondContact O-N 2.91Å; R435-A474 WeakPolarHBondContact O-CB 3.37Å; R435-P479 WeakPolarHBondContact CG-O 3.46Å; R435-P479 PolarHBondContact NE-O 2.91Å; R435-G480 CarbonylContact O-C 3.51Å; R435-G480 VanDerWaalsContact O-CA 3.24Å; R435-G480 WeakPolarHBondContact O-CA 3.32Å; R435-V481 PolarHBondContact O-N 3.44Å
436	F	97.3	Very high	89.3	Confident	1 Å²	1	25.2 Å²	25.2	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	135	-177.2	-47.7	-67.7	0	0	0	109.3	I351 Y355 D362 L363 L364 V481 Y483	I351-F436 HydrophobicContact CD1-CB 4.09Å; I351-F436 HydrophobicContact CD1-CD1 4.48Å; I351-F436 HydrophobicContact CD1-CD2 4.08Å; I351-F436 HydrophobicContact CD1-CG 3.96Å; I351-F436 HydrophobicContact CG1-CG 4.47Å; I351-F436 HydrophobicContact CG2-CD2 4.01Å; I351-F436 HydrophobicContact CG2-CE2 3.58Å; I351-F436 HydrophobicContact CG2-CZ 3.88Å; Y355-F436 HydrophobicContact CD1-CZ 4.44Å; Y355-F436 AromaticContact CD2-CE1 3.81Å; Y355-F436 HydrophobicContact CD2-CE1 3.81Å; Y355-F436 AromaticContact CD2-CZ 3.63Å; Y355-F436 HydrophobicContact CD2-CZ 3.63Å; Y355-F436 HydrophobicContact CE1-CE1 4.43Å; Y355-F436 HydrophobicContact CE2-CD1 4.5Å; Y355-F436 AromaticContact CE2-CE1 3.47Å; Y355-F436 HydrophobicContact CE2-CE1 3.47Å; Y355-F436 VanDerWaalsContact CE2-CE1 3.47Å; Y355-F436 AromaticContact CE2-CZ 3.82Å; Y355-F436 HydrophobicContact CE2-CZ 3.82Å; Y355-F436 HydrophobicContact CG-CE1 4.42Å; Y355-F436 AromaticContact CG-CZ 3.97Å; Y355-F436 HydrophobicContact CG-CZ 3.97Å; Y355-F436 AromaticContact CZ-CE1 3.82Å; D362-F436 PolarHBondContact O-N 2.91Å; L363-F436 CarbonylContact C-O 3.6Å; L363-F436 WeakPolarHBondContact CA-O 3.4Å; L363-F436 HydrophobicContact CB-CB 4.2Å; L363-F436 HydrophobicContact CD1-CB 3.53Å; L363-F436 HydrophobicContact CG-CB 4.45Å; L364-F436 PolarHBondContact N-O 3.42Å; F436-V481 CarbonylContact C-O 3.58Å; F436-V481 WeakPolarHBondContact CA-O 3.28Å; F436-V481 HydrophobicContact CD1-CB 4.11Å; F436-V481 HydrophobicContact CD1-CG2 4.26Å; F436-V481 HydrophobicContact CE1-CG2 4.29Å; F436-Y483 HydrophobicContact CD1-CE2 4.38Å
437	V	97.5	Very high	89.3	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.3	169.6	171.2	0	0	0	0	108.1	L364 F366 I434 R473 A474 V481 C482 Y483	L364-V437 CarbonylContact O-C 3.55Å; L364-V437 VanDerWaalsContact O-CA 3.29Å; L364-V437 WeakPolarHBondContact O-CA 3.47Å; F366-V437 HydrophobicContact CD2-CG1 4.09Å; F366-V437 HydrophobicContact CE2-CG1 4.11Å; I434-V437 HydrophobicContact CG2-CG2 4.02Å; V437-R473 HydrophobicContact CG2-CB 3.96Å; V437-A474 HydrophobicContact CG2-CB 3.94Å; V437-V481 PolarHBondContact N-O 2.88Å; V437-C482 HydrophobicContact CB-CB 4.48Å; V437-C482 CarbonylContact O-C 3.56Å; V437-C482 WeakPolarHBondContact O-CA 3.49Å; V437-Y483 PolarHBondContact O-N 3.33Å
438	A	97.9	Very high	89.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.6	166.4	0	0	0	0	0	108.9	L347 L363 L364 I365 F366 Y483 F485	L347-A438 HydrophobicContact CD2-CB 3.54Å; L363-A438 HydrophobicContact CD1-CB 4.22Å; L364-A438 PolarHBondContact O-N 3.44Å; I365-A438 CarbonylContact C-O 3.55Å; I365-A438 WeakPolarHBondContact CA-O 3.35Å; I365-A438 HydrophobicContact CB-CB 4.3Å; I365-A438 HydrophobicContact CG1-CB 4.05Å; I365-A438 HydrophobicContact CG2-CB 4.03Å; F366-A438 PolarHBondContact N-O 2.95Å; A438-Y483 CarbonylContact C-O 3.55Å; A438-Y483 VanDerWaalsContact CA-O 3.31Å; A438-Y483 WeakPolarHBondContact CA-O 3.47Å; A438-F485 HydrophobicContact CB-CE2 3.96Å
439	D	97.5	Very high	90.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	116.5	-176.3	-176.7	16.1	0	0	0	110.1	G441 I462 R470 Y483 F485 Y486	D439-G441 PolarHBondContact O-N 3.04Å; D439-G441 PolarHBondContact OD1-N 3.47Å; D439-I462 VanDerWaalsContact OD2-CD1 3.28Å; D439-I462 WeakPolarHBondContact OD2-CD1 3.39Å; D439-R470 VanDerWaalsContact OD1-CD 3.23Å; D439-R470 WeakPolarHBondContact OD1-CD 3.29Å; D439-R470 IonicContact OD1-CZ 3.09Å; D439-R470 IonicContact OD1-NE 3.49Å; D439-R470 IonicContact OD1-NH1 2.7Å; D439-R470 PolarHBondContact OD1-NH1 3.26Å; D439-Y483 PolarHBondContact N-O 3.24Å; D439-F485 PolarHBondContact O-N 2.92Å; D439-Y486 HydrophobicContact CB-CE1 4.22Å; D439-Y486 WeakPolarHBondContact O-CE1 3.47Å; D439-Y486 PolarHBondContact OD2-OH 2.79Å
440	S	95.1	Very high	90.4	Very high	16 Å²	16	32.2 Å²	32.2	11%	0.112	17%	0.17	C	C	.	.			trans	-70	-18.1	176.3	69.8	0	0	0	0	113.3	F366 K442	F366-S440 VanDerWaalsContact O-CB 3.3Å; F366-S440 WeakPolarHBondContact O-CB 3.47Å; F366-S440 PolarHBondContact O-N 3.04Å; F366-S440 PolarHBondContact O-OG 3.49Å; F366-S440 VanDerWaalsContact O-OG 3.08Å; S440-K442 PolarHBondContact O-N 3.05Å; S440-K442 PolarHBondContact OG-N 3.32Å
441	G	94.8	Very high	90.7	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.01	19%	0.194	C	C	.	.	S	Bend	trans	76.5	5.2	-176	0	0	0	0	0	114.5	D439 S461 I462	D439-G441 PolarHBondContact O-N 3.04Å; D439-G441 PolarHBondContact OD1-N 3.47Å; G441-S461 WeakPolarHBondContact O-CA 3.14Å; G441-I462 PolarHBondContact O-N 2.92Å
442	K	93.2	Very high	90.6	Very high	81 Å²	81	38.2 Å²	38.2	35%	0.352	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	156.4	-178.7	-59.9	-63.6	-179.1	-178.7	0	112.4	S440 E459 F460 S461 R470	S440-K442 PolarHBondContact O-N 3.05Å; S440-K442 PolarHBondContact OG-N 3.32Å; K442-E459 HydrophobicContact CB-CG 4.25Å; K442-E459 HydrophobicContact CD-CG 4.42Å; K442-F460 WeakPolarHBondContact CA-O 3.09Å; K442-S461 PolarHBondContact NZ-OG 3.39Å; K442-R470 PolarHBondContact O-NH1 3.43Å; K442-R470 PolarHBondContact O-NH2 3.4Å
443	V	93	Very high	90.8	Very high	10 Å²	10	39.1 Å²	39.1	6%	0.061	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	141.6	174.3	61.2	0	0	0	0	109.9	N423 E445 E459 F460 I462	N423-V443 HydrophobicContact CB-CG2 4.47Å; V443-E445 HydrophobicContact CG1-CG 4.05Å; V443-E445 HydrophobicContact CG2-CG 4.12Å; V443-E459 WeakPolarHBondContact O-CA 3.44Å; V443-F460 PolarHBondContact N-O 3.46Å; V443-F460 PolarHBondContact O-N 2.73Å; V443-I462 HydrophobicContact CB-CG2 3.82Å; V443-I462 HydrophobicContact CG1-CG2 3.7Å
444	K	90.2	Very high	90.8	Very high	75 Å²	75	38 Å²	38	33%	0.326	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.2	165.3	-62	-171.9	179.4	176.8	0	109.6	S368 L457 K458 E459	S368-K444 VanDerWaalsContact OG-CG 3.31Å; S368-K444 WeakPolarHBondContact OG-CG 3.36Å; S368-K444 PolarHBondContact OG-N 3.02Å; K444-L457 HydrophobicContact CB-CD1 3.84Å; K444-L457 HydrophobicContact CB-CG 4.23Å; K444-K458 WeakPolarHBondContact CA-O 3.35Å; K444-E459 WeakPolarHBondContact CE-OE1 3.45Å; K444-E459 HydrophobicContact CG-CB 4.21Å
445	E	87.4	Confident	90.6	Very high	46 Å²	46	40.7 Å²	40.7	22%	0.215	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.5	177.3	-65.8	-168.5	160.3	0	0	110.7	V443 K458 F460	V443-E445 HydrophobicContact CG1-CG 4.05Å; V443-E445 HydrophobicContact CG2-CG 4.12Å; E445-K458 PolarHBondContact N-O 2.87Å; E445-K458 PolarHBondContact O-N 3.22Å; E445-K458 VanDerWaalsContact O-N 3.09Å; E445-F460 HydrophobicContact CB-CD2 4.1Å; E445-F460 HydrophobicContact CB-CE2 4.33Å
446	L	86.9	Confident	90.4	Very high	88 Å²	88	38.5 Å²	38.5	46%	0.461	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	127.5	168.1	-71.8	166.6	0	0	0	108.9	C456 L457 R504	L446-C456 CarbonylContact C-O 3.32Å; L446-C456 WeakPolarHBondContact CA-O 3.29Å; L446-L457 HydrophobicContact CD2-CB 3.93Å; L446-L457 HydrophobicContact CD2-CD1 3.87Å; L446-L457 HydrophobicContact CD2-CG 4.46Å; L446-L457 HydrophobicContact CG-CD1 3.96Å; L446-R504 PolarHBondContact O-NH1 3.42Å
447	S	89.6	Confident	89.9	Confident	31 Å²	31	41 Å²	41	22%	0.217	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	160.6	167.6	61	0	0	0	0	110.7	C456 R504	S447-C456 PolarHBondContact N-O 3.26Å; S447-C456 PolarHBondContact O-N 3.27Å; S447-C456 WeakPolarHBondContact OG-CB 3.11Å; S447-C456 PolarHBondContact OG-O 3.28Å; S447-R504 CarbonylContact C-O 3.55Å
448	W	89.3	Confident	89.4	Confident	50 Å²	50	45.5 Å²	45.5	19%	0.189	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.6	178.8	178.8	-108.6	0	0	0	109.4	R453 R455 R504 P506	W448-R453 VanDerWaalsContact CH2-C 3.41Å; W448-R453 HydrophobicContact CH2-CB 4.21Å; W448-R453 HydrophobicContact CZ2-CB 4.16Å; W448-R453 HydrophobicContact CZ2-CG 4.48Å; W448-R455 HydrophobicContact CE3-CG 3.97Å; W448-R455 HydrophobicContact CZ3-CG 3.95Å; W448-R504 VanDerWaalsContact CB-O 3.28Å; W448-R504 WeakPolarHBondContact CB-O 3.45Å; W448-R504 PolarHBondContact N-O 2.89Å; W448-P506 HydrophobicContact CD2-CB 4.17Å; W448-P506 HydrophobicContact CD2-CG 4.5Å; W448-P506 HydrophobicContact CE3-CB 4.37Å; W448-P506 HydrophobicContact CE3-CG 4.3Å; W448-P506 HydrophobicContact CH2-CB 4.45Å; W448-P506 HydrophobicContact CZ2-CB 4.26Å; W448-P506 HydrophobicContact CZ3-CG 4.47Å
449	D	87.2	Confident	89	Confident	51 Å²	51	50.1 Å²	50.1	27%	0.273	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	103.8	168.6	-177.1	-9.3	0	0	0	109	K451 A452 R453 M454	D449-K451 VanDerWaalsContact C-N 3.28Å; D449-K451 PolarHBondContact O-N 2.95Å; D449-K451 WeakPolarHBondContact OD1-CB 3.49Å; D449-K451 PolarHBondContact OD1-N 3.24Å; D449-A452 HydrophobicContact CB-CB 4.19Å; D449-A452 PolarHBondContact O-N 3.02Å; D449-A452 PolarHBondContact OD1-N 3.4Å; D449-A452 VanDerWaalsContact OD2-CB 3.26Å; D449-A452 WeakPolarHBondContact OD2-CB 3.4Å; D449-R453 VanDerWaalsContact O-CA 3.26Å; D449-R453 WeakPolarHBondContact O-CA 3.39Å; D449-R453 PolarHBondContact O-N 3.09Å; D449-M454 HydrophobicContact CB-CB 4.48Å; D449-M454 PolarHBondContact N-O 3Å; D449-M454 PolarHBondContact O-N 2.99Å; D449-M454 VanDerWaalsContact O-N 3.16Å
450	S	83	Confident	88.7	Confident	39 Å²	39	54.3 Å²	54.3	27%	0.273	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-29.5	178.4	54.2	0	0	0	0	113.4	E538	S450-E538 WeakPolarHBondContact CA-OE2 3.33Å; S450-E538 WeakPolarHBondContact CB-OE2 3.1Å
451	K	83.2	Confident	88.6	Confident	172 Å²	172	56.3 Å²	56.3	75%	0.748	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-48.1	179.2	-66.9	-177.8	-178.9	177.2	0	110.6	D449 N862	D449-K451 VanDerWaalsContact C-N 3.28Å; D449-K451 PolarHBondContact O-N 2.95Å; D449-K451 WeakPolarHBondContact OD1-CB 3.49Å; D449-K451 PolarHBondContact OD1-N 3.24Å; K451-N862 WeakPolarHBondContact O-CB 3.42Å; K451-N862 PolarHBondContact O-ND2 2.99Å; K451-N862 VanDerWaalsContact O-ND2 3.07Å
452	A	83.9	Confident	88.6	Confident	5 Å²	5	56.4 Å²	56.4	4%	0.041	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.4	-178.6	0	0	0	0	0	113.7	D449 M454 K863	D449-A452 HydrophobicContact CB-CB 4.19Å; D449-A452 PolarHBondContact O-N 3.02Å; D449-A452 PolarHBondContact OD1-N 3.4Å; D449-A452 VanDerWaalsContact OD2-CB 3.26Å; D449-A452 WeakPolarHBondContact OD2-CB 3.4Å; A452-M454 VanDerWaalsContact C-N 3.33Å; A452-M454 HydrophobicContact CB-CB 3.97Å; A452-M454 HydrophobicContact CB-CE 4.33Å; A452-K863 HydrophobicContact CB-CB 4.3Å; A452-K863 HydrophobicContact CB-CD 4.19Å; A452-K863 HydrophobicContact CB-CG 4.5Å
453	R	84	Confident	88.6	Confident	77 Å²	77	53 Å²	53	29%	0.291	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	50.3	-170.3	-64.3	-168.2	167.9	172.8	2.5	112.2	W448 D449 E538	W448-R453 VanDerWaalsContact CH2-C 3.41Å; W448-R453 HydrophobicContact CH2-CB 4.21Å; W448-R453 HydrophobicContact CZ2-CB 4.16Å; W448-R453 HydrophobicContact CZ2-CG 4.48Å; D449-R453 VanDerWaalsContact O-CA 3.26Å; D449-R453 WeakPolarHBondContact O-CA 3.39Å; D449-R453 PolarHBondContact O-N 3.09Å; R453-E538 VanDerWaalsContact CG-OE1 3.28Å; R453-E538 WeakPolarHBondContact CG-OE1 3.3Å; R453-E538 IonicContact NE-OE1 3.2Å; R453-E538 PolarHBondContact NE-OE1 3.34Å; R453-E538 VanDerWaalsContact NE-OE1 3.08Å
454	M	87.7	Confident	88.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	142.1	-168.2	-170.3	165	59.8	0	0	111.8	D449 A452 L950 E952 P956	D449-M454 HydrophobicContact CB-CB 4.48Å; D449-M454 PolarHBondContact N-O 3Å; D449-M454 PolarHBondContact O-N 2.99Å; D449-M454 VanDerWaalsContact O-N 3.16Å; A452-M454 VanDerWaalsContact C-N 3.33Å; A452-M454 HydrophobicContact CB-CB 3.97Å; A452-M454 HydrophobicContact CB-CE 4.33Å; M454-L950 HydrophobicContact CB-CB 4.32Å; M454-L950 HydrophobicContact CB-CD2 3.82Å; M454-L950 HydrophobicContact CB-CG 4.12Å; M454-L950 HydrophobicContact CG-CB 3.97Å; M454-L950 HydrophobicContact CG-CD2 3.77Å; M454-L950 HydrophobicContact CG-CG 3.59Å; M454-L950 VanDerWaalsContact CG-O 3.3Å; M454-L950 WeakPolarHBondContact CG-O 3.15Å; M454-L950 HydrophobicContact SD-CB 4.49Å; M454-L950 HydrophobicContact SD-CD1 4.4Å; M454-L950 HydrophobicContact SD-CD2 3.52Å; M454-L950 VanDerWaalsContact SD-CD2 3.52Å; M454-L950 HydrophobicContact SD-CG 3.48Å; M454-L950 WeakPolarHBondContact SD-CG 3.42Å; M454-E952 HydrophobicContact CE-CB 3.53Å; M454-E952 HydrophobicContact CE-CG 4.22Å; M454-E952 HydrophobicContact CG-CB 4.36Å; M454-E952 HydrophobicContact SD-CB 3.71Å; M454-P956 HydrophobicContact CE-CB 4.28Å; M454-P956 HydrophobicContact SD-CB 3.59Å; M454-P956 VanDerWaalsContact SD-CB 3.59Å
455	R	89.8	Confident	88.6	Confident	63 Å²	63	52.5 Å²	52.5	24%	0.238	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124.5	167.2	-64.4	177.7	175.7	170.5	-4	108.9	W448 E571 D949 L950 M951 E952	W448-R455 HydrophobicContact CE3-CG 3.97Å; W448-R455 HydrophobicContact CZ3-CG 3.95Å; R455-E571 IonicContact CZ-OE1 3.3Å; R455-E571 IonicContact NH1-OE1 3.58Å; R455-E571 PolarHBondContact NH1-OE1 3.17Å; R455-E571 IonicContact NH2-OE1 3.72Å; R455-E571 PolarHBondContact NH2-OE1 2.97Å; R455-D949 IonicContact CZ-OD1 2.72Å; R455-D949 IonicContact CZ-OD2 3.24Å; R455-D949 IonicContact NE-OD2 2.95Å; R455-D949 IonicContact NH1-OD1 2.73Å; R455-D949 IonicContact NH1-OD2 2.95Å; R455-D949 PolarHBondContact NH1-OD2 2.97Å; R455-L950 PolarHBondContact N-O 3.13Å; R455-M951 CarbonylContact O-C 3.55Å; R455-M951 VanDerWaalsContact O-CA 3.28Å; R455-M951 WeakPolarHBondContact O-CA 3.29Å; R455-E952 PolarHBondContact O-N 2.93Å
456	C	89.4	Confident	88.9	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.02	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118	178.3	-64.5	0	0	0	0	109.5	L446 S447 K458 E952	L446-C456 CarbonylContact C-O 3.32Å; L446-C456 WeakPolarHBondContact CA-O 3.29Å; S447-C456 PolarHBondContact N-O 3.26Å; S447-C456 PolarHBondContact O-N 3.27Å; S447-C456 WeakPolarHBondContact OG-CB 3.11Å; S447-C456 PolarHBondContact OG-O 3.28Å; C456-K458 HydrophobicContact CB-CD 4.48Å; C456-E952 CarbonylContact C-O 3.49Å; C456-E952 PolarHBondContact SG-OE2 2.9Å
457	L	88	Confident	89.2	Confident	54 Å²	54	46.7 Å²	46.7	28%	0.283	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	101.6	172.6	-176.6	67.6	0	0	0	109	K444 L446 E952 T953	K444-L457 HydrophobicContact CB-CD1 3.84Å; K444-L457 HydrophobicContact CB-CG 4.23Å; L446-L457 HydrophobicContact CD2-CB 3.93Å; L446-L457 HydrophobicContact CD2-CD1 3.87Å; L446-L457 HydrophobicContact CD2-CG 4.46Å; L446-L457 HydrophobicContact CG-CD1 3.96Å; L457-E952 PolarHBondContact N-O 2.72Å; L457-T953 HydrophobicContact CB-CG2 4.23Å; L457-T953 HydrophobicContact CD2-CG2 4.3Å
458	K	87.5	Confident	89.3	Confident	93 Å²	93	47.1 Å²	47.1	40%	0.404	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149	-177.3	-68.9	177.5	-178.5	170.6	0	110.6	K444 E445 C456 F460 E952	K444-K458 WeakPolarHBondContact CA-O 3.35Å; E445-K458 PolarHBondContact N-O 2.87Å; E445-K458 PolarHBondContact O-N 3.22Å; E445-K458 VanDerWaalsContact O-N 3.09Å; C456-K458 HydrophobicContact CB-CD 4.48Å; K458-F460 HydrophobicContact CB-CD2 4.4Å; K458-F460 HydrophobicContact CB-CE2 3.53Å; K458-F460 HydrophobicContact CB-CZ 3.64Å; K458-F460 WeakPolarHBondContact O-CD2 3.34Å; K458-F460 WeakPolarHBondContact O-CE2 3.27Å; K458-E952 WeakPolarHBondContact CE-OE2 3.14Å; K458-E952 IonicContact NZ-OE2 2.66Å; K458-E952 PolarHBondContact NZ-OE2 3.14Å
459	E	88.9	Confident	89.3	Confident	97 Å²	97	45.4 Å²	45.4	45%	0.453	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.6	175.1	-176.9	167.2	-80.2	0	0	110.5	S368 K442 V443 K444	S368-E459 WeakPolarHBondContact CB-OE1 3.3Å; S368-E459 WeakPolarHBondContact OG-CG 3.37Å; S368-E459 PolarHBondContact OG-OE1 2.89Å; K442-E459 HydrophobicContact CB-CG 4.25Å; K442-E459 HydrophobicContact CD-CG 4.42Å; V443-E459 WeakPolarHBondContact O-CA 3.44Å; K444-E459 WeakPolarHBondContact CE-OE1 3.45Å; K444-E459 HydrophobicContact CG-CB 4.21Å
460	F	90.4	Very high	89.6	Confident	89 Å²	89	43 Å²	43	39%	0.39	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	159.8	178	-60.5	-82.3	0	0	0	110.5	K442 V443 E445 K458	K442-F460 WeakPolarHBondContact CA-O 3.09Å; V443-F460 PolarHBondContact N-O 3.46Å; V443-F460 PolarHBondContact O-N 2.73Å; E445-F460 HydrophobicContact CB-CD2 4.1Å; E445-F460 HydrophobicContact CB-CE2 4.33Å; K458-F460 HydrophobicContact CB-CD2 4.4Å; K458-F460 HydrophobicContact CB-CE2 3.53Å; K458-F460 HydrophobicContact CB-CZ 3.64Å; K458-F460 WeakPolarHBondContact O-CD2 3.34Å; K458-F460 WeakPolarHBondContact O-CE2 3.27Å
461	S	93.9	Very high	90	Very high	57 Å²	57	42.9 Å²	42.9	40%	0.399	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	143.7	161.8	-62.9	0	0	0	0	109.4	G441 K442	G441-S461 WeakPolarHBondContact O-CA 3.14Å; K442-S461 PolarHBondContact NZ-OG 3.39Å
462	I	94.8	Very high	90.3	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.021	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-71.1	160.3	177.4	62.8	179.6	0	0	0	111.6	D439 G441 V443 A467 F494	D439-I462 VanDerWaalsContact OD2-CD1 3.28Å; D439-I462 WeakPolarHBondContact OD2-CD1 3.39Å; G441-I462 PolarHBondContact O-N 2.92Å; V443-I462 HydrophobicContact CB-CG2 3.82Å; V443-I462 HydrophobicContact CG1-CG2 3.7Å; I462-A467 HydrophobicContact CD1-CB 3.68Å; I462-A467 HydrophobicContact CG1-CB 4.25Å; I462-F494 HydrophobicContact CG1-CD2 4.1Å; I462-F494 HydrophobicContact CG1-CE2 3.79Å; I462-F494 WeakPolarHBondContact O-CB 3.17Å; I462-F494 WeakPolarHBondContact O-CD2 3.22Å; I462-F494 WeakPolarHBondContact O-CG 3.33Å
463	S	93.6	Very high	90.6	Very high	8 Å²	8	34.9 Å²	34.9	6%	0.056	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-75.5	160.2	170.7	64.5	0	0	0	0	112.2	A465 S466 A467 E495 F497	S463-A465 PolarHBondContact O-N 3.29Å; S463-S466 WeakPolarHBondContact O-CB 3.37Å; S463-S466 PolarHBondContact O-N 3.37Å; S463-S466 VanDerWaalsContact O-N 3.14Å; S463-S466 WeakPolarHBondContact OG-CB 3.47Å; S463-S466 PolarHBondContact OG-N 3.19Å; S463-S466 VanDerWaalsContact OG-N 3.13Å; S463-A467 WeakPolarHBondContact O-CB 3.5Å; S463-A467 PolarHBondContact O-N 2.92Å; S463-E495 CarbonylContact C-O 3.58Å; S463-E495 VanDerWaalsContact CA-O 3.22Å; S463-E495 WeakPolarHBondContact CA-O 3.33Å; S463-E495 WeakPolarHBondContact CB-O 3.42Å; S463-F497 VanDerWaalsContact CB-C 3.42Å
464	K	93.4	Very high	90.9	Very high	60 Å²	60	31.3 Å²	31.3	26%	0.261	15%	0.154	S	C	.	.	H	α-helix	trans	-55.7	-37.7	170.1	-67.8	177.8	175.1	167.3	0	111.4	N468 Y491 D492 F494 E495	K464-N468 WeakPolarHBondContact O-CB 3.36Å; K464-N468 PolarHBondContact O-N 3.37Å; K464-N468 PolarHBondContact O-ND2 3.01Å; K464-Y491 HydrophobicContact CB-CE2 4.07Å; K464-Y491 WeakPolarHBondContact CE-O 3.5Å; K464-Y491 HydrophobicContact CG-CD2 4.43Å; K464-Y491 HydrophobicContact CG-CE2 3.96Å; K464-D492 VanDerWaalsContact CE-O 3.24Å; K464-D492 WeakPolarHBondContact CE-O 3.32Å; K464-D492 PolarHBondContact NZ-O 3.11Å; K464-F494 WeakPolarHBondContact CE-O 3.41Å; K464-F494 HydrophobicContact CG-CB 3.94Å; K464-E495 PolarHBondContact N-O 2.87Å
465	A	89.7	Confident	90.8	Very high	15 Å²	15	31.5 Å²	31.5	12%	0.124	16%	0.156	C	C	.	.	H	α-helix	trans	-59.1	-52.9	174.5	0	0	0	0	0	112	I296 S463 A467 N468 Q469 A496 F497	I296-A465 VanDerWaalsContact CD1-CA 3.42Å; I296-A465 HydrophobicContact CD1-CB 3.48Å; I296-A465 VanDerWaalsContact CD1-CB 3.48Å; S463-A465 PolarHBondContact O-N 3.29Å; A465-A467 PolarHBondContact O-N 3.06Å; A465-N468 PolarHBondContact O-N 3.47Å; A465-N468 VanDerWaalsContact O-N 3.16Å; A465-Q469 WeakPolarHBondContact O-CG 3.49Å; A465-Q469 PolarHBondContact O-N 3.09Å; A465-A496 WeakPolarHBondContact CB-O 3.47Å; A465-A496 PolarHBondContact N-O 2.79Å; A465-F497 HydrophobicContact CB-CD1 4.3Å
466	S	92	Very high	90.3	Very high	12 Å²	12	30.7 Å²	30.7	8%	0.084	15%	0.153	C	C	.	.	H	α-helix	trans	-58.7	-46.9	176.9	176.4	0	0	0	0	112	E426 S463 N468 Q469 R470	E426-S466 WeakPolarHBondContact OE1-CA 3.43Å; E426-S466 WeakPolarHBondContact OE1-CB 3.41Å; E426-S466 PolarHBondContact OE1-OG 3.37Å; E426-S466 PolarHBondContact OE2-OG 2.78Å; E426-S466 VanDerWaalsContact OE2-OG 3.14Å; S463-S466 WeakPolarHBondContact O-CB 3.37Å; S463-S466 PolarHBondContact O-N 3.37Å; S463-S466 VanDerWaalsContact O-N 3.14Å; S463-S466 WeakPolarHBondContact OG-CB 3.47Å; S463-S466 PolarHBondContact OG-N 3.19Å; S463-S466 VanDerWaalsContact OG-N 3.13Å; S466-N468 PolarHBondContact O-N 2.92Å; S466-Q469 WeakPolarHBondContact O-CB 3.3Å; S466-Q469 PolarHBondContact O-N 3.16Å; S466-R470 WeakPolarHBondContact O-CG 3.09Å; S466-R470 PolarHBondContact O-N 3.21Å
467	A	93.9	Very high	89.7	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.8	-33.7	177.1	0	0	0	0	0	113	I462 S463 A465 K471 R484 Y486 Y491	I462-A467 HydrophobicContact CD1-CB 3.68Å; I462-A467 HydrophobicContact CG1-CB 4.25Å; S463-A467 WeakPolarHBondContact O-CB 3.5Å; S463-A467 PolarHBondContact O-N 2.92Å; A465-A467 PolarHBondContact O-N 3.06Å; A467-K471 WeakPolarHBondContact O-CB 3.49Å; A467-K471 PolarHBondContact O-N 3.4Å; A467-R484 PolarHBondContact O-NH2 3.42Å; A467-Y486 WeakPolarHBondContact CB-OH 3.45Å; A467-Y491 HydrophobicContact CB-CD2 4.12Å; A467-Y491 HydrophobicContact CB-CE2 3.91Å
468	N	90.9	Very high	89.5	Confident	41 Å²	41	32.6 Å²	32.6	22%	0.219	17%	0.17	C	C	.	.	H	α-helix	trans	-76.7	-33	175.7	-76.8	-48	0	0	0	112.7	K464 A465 S466 K471 G472 Y491	K464-N468 WeakPolarHBondContact O-CB 3.36Å; K464-N468 PolarHBondContact O-N 3.37Å; K464-N468 PolarHBondContact O-ND2 3.01Å; A465-N468 PolarHBondContact O-N 3.47Å; A465-N468 VanDerWaalsContact O-N 3.16Å; S466-N468 PolarHBondContact O-N 2.92Å; N468-K471 PolarHBondContact OD1-NZ 2.88Å; N468-G472 PolarHBondContact O-N 3.26Å; N468-Y491 PolarHBondContact ND2-OH 3.44Å
469	Q	89.8	Confident	89.5	Confident	13 Å²	13	31.2 Å²	31.2	6%	0.061	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-45.1	172.9	-68	-73.4	34	0	0	112.5	H264 E426 T427 A465 S466 G472 R473	H264-Q469 PolarHBondContact CD2-NE2 2.9Å; H264-Q469 PolarHBondContact NE2-NE2 3.11Å; E426-Q469 HydrophobicContact CG-CB 4.08Å; T427-Q469 HydrophobicContact CG2-CG 4.46Å; A465-Q469 WeakPolarHBondContact O-CG 3.49Å; A465-Q469 PolarHBondContact O-N 3.09Å; S466-Q469 WeakPolarHBondContact O-CB 3.3Å; S466-Q469 PolarHBondContact O-N 3.16Å; Q469-G472 CarbonylContact O-C 3.53Å; Q469-G472 WeakPolarHBondContact O-CA 3.32Å; Q469-G472 PolarHBondContact O-N 2.84Å; Q469-G472 VanDerWaalsContact O-N 3.14Å; Q469-R473 PolarHBondContact O-N 3.29Å
470	R	93.4	Very high	89.7	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.5	-51.7	174.9	-68.5	-179.3	-179.4	-165.6	0.2	110.8	F366 E426 D439 K442 S466 G472 R473	F366-R470 HydrophobicContact CD1-CG 4.08Å; F366-R470 HydrophobicContact CD2-CB 3.69Å; F366-R470 HydrophobicContact CD2-CG 3.63Å; F366-R470 HydrophobicContact CE1-CG 4.11Å; F366-R470 HydrophobicContact CE2-CB 3.6Å; F366-R470 HydrophobicContact CE2-CG 3.66Å; F366-R470 HydrophobicContact CG-CB 4.39Å; F366-R470 HydrophobicContact CG-CG 3.84Å; F366-R470 HydrophobicContact CZ-CB 4.25Å; F366-R470 HydrophobicContact CZ-CG 3.9Å; E426-R470 HydrophobicContact CG-CG 3.96Å; E426-R470 IonicContact OE2-CZ 2.66Å; E426-R470 IonicContact OE2-NE 3.25Å; E426-R470 PolarHBondContact OE2-NE 3.44Å; E426-R470 IonicContact OE2-NH2 3.58Å; E426-R470 PolarHBondContact OE2-NH2 3.36Å; D439-R470 VanDerWaalsContact OD1-CD 3.23Å; D439-R470 WeakPolarHBondContact OD1-CD 3.29Å; D439-R470 IonicContact OD1-CZ 3.09Å; D439-R470 IonicContact OD1-NE 3.49Å; D439-R470 IonicContact OD1-NH1 2.7Å; D439-R470 PolarHBondContact OD1-NH1 3.26Å; K442-R470 PolarHBondContact O-NH1 3.43Å; K442-R470 PolarHBondContact O-NH2 3.4Å; S466-R470 WeakPolarHBondContact O-CG 3.09Å; S466-R470 PolarHBondContact O-N 3.21Å; R470-G472 PolarHBondContact O-N 3.32Å; R470-R473 WeakPolarHBondContact O-CB 3.31Å; R470-R473 WeakPolarHBondContact O-CG 2.97Å; R470-R473 PolarHBondContact O-N 3.44Å; R470-R473 VanDerWaalsContact O-N 3.08Å
471	K	92.4	Very high	90	Very high	38 Å²	38	22.8 Å²	22.8	17%	0.165	13%	0.134	C	C	.	.	H	α-helix	trans	-52.2	-44.9	172.1	179.1	-178.5	72.4	-173.9	0	111.6	I320 L322 A467 N468 R473 A474 C482	I320-K471 HydrophobicContact CD1-CG 4.33Å; I320-K471 WeakPolarHBondContact CD1-O 3.42Å; I320-K471 HydrophobicContact CG2-CG 4Å; L322-K471 HydrophobicContact CD1-CD 4.07Å; L322-K471 HydrophobicContact CD2-CD 4.48Å; A467-K471 WeakPolarHBondContact O-CB 3.49Å; A467-K471 PolarHBondContact O-N 3.4Å; N468-K471 PolarHBondContact OD1-NZ 2.88Å; K471-R473 PolarHBondContact O-N 3.04Å; K471-R473 VanDerWaalsContact O-N 3.1Å; K471-A474 PolarHBondContact O-N 3.31Å; K471-C482 HydrophobicContact CB-CB 4.31Å; K471-C482 HydrophobicContact CG-CB 3.81Å
472	G	89.2	Confident	90.2	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.01	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	0.1	-179.1	0	0	0	0	0	116.1	T158 N468 Q469 R470 A474	T158-G472 WeakPolarHBondContact CB-O 3.29Å; T158-G472 VanDerWaalsContact OG1-C 3.24Å; T158-G472 VanDerWaalsContact OG1-CA 3.22Å; T158-G472 WeakPolarHBondContact OG1-CA 3.39Å; T158-G472 PolarHBondContact OG1-O 3.35Å; N468-G472 PolarHBondContact O-N 3.26Å; Q469-G472 CarbonylContact O-C 3.53Å; Q469-G472 WeakPolarHBondContact O-CA 3.32Å; Q469-G472 PolarHBondContact O-N 2.84Å; Q469-G472 VanDerWaalsContact O-N 3.14Å; R470-G472 PolarHBondContact O-N 3.32Å; G472-A474 VanDerWaalsContact C-N 3.35Å; G472-A474 CarbonylContact C-O 3.54Å
473	R	90.3	Very high	90.3	Very high	8 Å²	8	20.1 Å²	20.1	3%	0.03	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-26.5	170.7	-63.7	-69.2	143.3	-168.9	-19.4	112.6	L364 F366 A425 E426 L429 V437 Q469 R470 K471	L364-R473 HydrophobicContact CD2-CB 3.96Å; L364-R473 HydrophobicContact CD2-CG 4.02Å; F366-R473 HydrophobicContact CE2-CG 4.19Å; F366-R473 HydrophobicContact CZ-CG 3.98Å; A425-R473 WeakPolarHBondContact O-CD 3.47Å; A425-R473 PolarHBondContact O-NE 3.05Å; E426-R473 VanDerWaalsContact C-CZ 3.41Å; E426-R473 PolarHBondContact O-NE 3.07Å; E426-R473 PolarHBondContact O-NH2 3.42Å; L429-R473 PolarHBondContact O-NH1 3.27Å; V437-R473 HydrophobicContact CG2-CB 3.96Å; Q469-R473 PolarHBondContact O-N 3.29Å; R470-R473 WeakPolarHBondContact O-CB 3.31Å; R470-R473 WeakPolarHBondContact O-CG 2.97Å; R470-R473 PolarHBondContact O-N 3.44Å; R470-R473 VanDerWaalsContact O-N 3.08Å; K471-R473 PolarHBondContact O-N 3.04Å; K471-R473 VanDerWaalsContact O-N 3.1Å
474	A	90	Very high	90.5	Very high	2 Å²	2	19.9 Å²	19.9	2%	0.017	11%	0.112	C	C	.	.	S	Bend	trans	-83.8	175.2	166.7	0	0	0	0	0	110.9	I320 R435 V437 K471 G472 R476	I320-A474 HydrophobicContact CD1-CB 4.17Å; I320-A474 WeakPolarHBondContact CD1-O 3.39Å; I320-A474 HydrophobicContact CG2-CB 4.39Å; R435-A474 WeakPolarHBondContact O-CB 3.37Å; V437-A474 HydrophobicContact CG2-CB 3.94Å; K471-A474 PolarHBondContact O-N 3.31Å; G472-A474 VanDerWaalsContact C-N 3.35Å; G472-A474 CarbonylContact C-O 3.54Å; A474-R476 VanDerWaalsContact C-N 3.3Å; A474-R476 PolarHBondContact O-N 3.43Å
475	G	85.2	Confident	90.6	Very high	4 Å²	4	17.7 Å²	17.7	4%	0.041	10%	0.103	C	C	.	.	S	Bend	trans	78.3	8	174.8	0	0	0	0	0	115.3	Y318 G478	Y318-G475 WeakPolarHBondContact CB-O 3.17Å; Y318-G475 PolarHBondContact N-O 3Å; G475-G478 CarbonylContact C-O 3.54Å; G475-G478 VanDerWaalsContact CA-O 3.24Å; G475-G478 WeakPolarHBondContact CA-O 3.46Å
476	R	80.7	Confident	90.9	Very high	45 Å²	45	17.5 Å²	17.5	17%	0.17	10%	0.099	C	C	.	.	S	Bend	trans	-86.9	-47.9	-179.9	-69.2	-176.4	167	171.6	-4.6	113.1	L317 L429 A474	L317-R476 VanDerWaalsContact CD1-O 3.27Å; L317-R476 WeakPolarHBondContact CD1-O 3.47Å; L429-R476 PolarHBondContact O-NH1 3.46Å; L429-R476 VanDerWaalsContact O-NH1 3.17Å; A474-R476 VanDerWaalsContact C-N 3.3Å; A474-R476 PolarHBondContact O-N 3.43Å
477	T	75.2	Confident	91	Very high	83 Å²	83	19.1 Å²	19.1	51%	0.509	11%	0.109	S	C	.	.	S	Bend	trans	-106.3	-1.8	-175.6	53.2	0	0	0	0	113.7
478	G	83.8	Confident	91.1	Very high	15 Å²	15	24.5 Å²	24.5	16%	0.155	13%	0.134	C	C	.	.	S	Bend	trans	171.7	176.2	-179.5	0	0	0	0	0	110.6	Y318 G475 G480	Y318-G478 VanDerWaalsContact CB-C 3.41Å; Y318-G478 WeakPolarHBondContact CB-O 3.25Å; Y318-G478 VanDerWaalsContact CD2-CA 3.5Å; Y318-G478 VanDerWaalsContact CG-C 3.41Å; G475-G478 CarbonylContact C-O 3.54Å; G475-G478 VanDerWaalsContact CA-O 3.24Å; G475-G478 WeakPolarHBondContact CA-O 3.46Å; G478-G480 PolarHBondContact O-N 3.2Å
479	P	88.4	Confident	91.3	Very high	63 Å²	63	29.1 Å²	29.1	41%	0.409	15%	0.154	S	C	.	.			trans	-53.6	131.6	175.5	-24.8	34.5	0	0	0	111.5	Y318 R435	Y318-P479 HydrophobicContact CD1-CG 4.44Å; R435-P479 WeakPolarHBondContact CG-O 3.46Å; R435-P479 PolarHBondContact NE-O 2.91Å
480	G	93.1	Very high	91.5	Very high	4 Å²	4	31.6 Å²	31.6	4%	0.041	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	164.7	-176.1	0	0	0	0	0	113.5	P319 I320 D321 R435 G478	P319-G480 PolarHBondContact O-N 2.97Å; I320-G480 WeakPolarHBondContact CA-O 3.46Å; D321-G480 PolarHBondContact N-O 2.93Å; R435-G480 CarbonylContact O-C 3.51Å; R435-G480 VanDerWaalsContact O-CA 3.24Å; R435-G480 WeakPolarHBondContact O-CA 3.32Å; G478-G480 PolarHBondContact O-N 3.2Å
481	V	96.6	Very high	91.6	Very high	6 Å²	6	33.3 Å²	33.3	4%	0.036	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.3	168.6	-167.9	0	0	0	0	109.4	D321 R435 F436 V437 Y483	D321-V481 HydrophobicContact CB-CG1 4.32Å; D321-V481 HydrophobicContact CB-CG2 4.36Å; D321-V481 CarbonylContact O-C 3.53Å; D321-V481 VanDerWaalsContact O-CA 3.3Å; D321-V481 WeakPolarHBondContact O-CA 3.49Å; R435-V481 PolarHBondContact O-N 3.44Å; F436-V481 CarbonylContact C-O 3.58Å; F436-V481 WeakPolarHBondContact CA-O 3.28Å; F436-V481 HydrophobicContact CD1-CB 4.11Å; F436-V481 HydrophobicContact CD1-CG2 4.26Å; F436-V481 HydrophobicContact CE1-CG2 4.29Å; V437-V481 PolarHBondContact N-O 2.88Å; V481-Y483 HydrophobicContact CB-CE2 4.16Å; V481-Y483 HydrophobicContact CG1-CD1 4.49Å; V481-Y483 HydrophobicContact CG1-CD2 4.39Å; V481-Y483 HydrophobicContact CG1-CE1 3.88Å; V481-Y483 HydrophobicContact CG1-CE2 3.78Å; V481-Y483 VanDerWaalsContact CG1-CZ 3.5Å
482	C	97.4	Very high	91.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	124.3	175.9	-177.1	0	0	0	0	109.7	I320 D321 L322 H323 V437 K471	I320-C482 HydrophobicContact CG2-CB 3.95Å; D321-C482 PolarHBondContact O-N 3.41Å; L322-C482 HydrophobicContact CD1-CB 3.82Å; H323-C482 PolarHBondContact N-O 2.79Å; V437-C482 HydrophobicContact CB-CB 4.48Å; V437-C482 CarbonylContact O-C 3.56Å; V437-C482 WeakPolarHBondContact O-CA 3.49Å; K471-C482 HydrophobicContact CB-CB 4.31Å; K471-C482 HydrophobicContact CG-CB 3.81Å
483	Y	98.1	Very high	92.1	Very high	5 Å²	5	41 Å²	41	2%	0.02	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.1	176	-58.3	-76.9	0	0	0	109.1	H323 I325 L347 F436 V437 A438 D439 V481	H323-Y483 HydrophobicContact CB-CD1 3.73Å; H323-Y483 HydrophobicContact CB-CE1 4.1Å; H323-Y483 CarbonylContact O-C 3.52Å; H323-Y483 WeakPolarHBondContact O-CA 3.45Å; I325-Y483 HydrophobicContact CD1-CD1 3.49Å; I325-Y483 VanDerWaalsContact CD1-CD1 3.49Å; I325-Y483 HydrophobicContact CD1-CE1 4.14Å; I325-Y483 HydrophobicContact CD1-CG 4.33Å; I325-Y483 HydrophobicContact CG1-CD1 4.4Å; L347-Y483 HydrophobicContact CD1-CD1 4.12Å; L347-Y483 HydrophobicContact CD1-CD2 3.61Å; L347-Y483 HydrophobicContact CD1-CE1 4.27Å; L347-Y483 HydrophobicContact CD1-CE2 3.76Å; L347-Y483 HydrophobicContact CD1-CG 3.78Å; L347-Y483 HydrophobicContact CD2-CD2 4.13Å; L347-Y483 HydrophobicContact CD2-CG 4.41Å; L347-Y483 HydrophobicContact CG-CD2 4.47Å; F436-Y483 HydrophobicContact CD1-CE2 4.38Å; V437-Y483 PolarHBondContact O-N 3.33Å; A438-Y483 CarbonylContact C-O 3.55Å; A438-Y483 VanDerWaalsContact CA-O 3.31Å; A438-Y483 WeakPolarHBondContact CA-O 3.47Å; D439-Y483 PolarHBondContact N-O 3.24Å; V481-Y483 HydrophobicContact CB-CE2 4.16Å; V481-Y483 HydrophobicContact CG1-CD1 4.49Å; V481-Y483 HydrophobicContact CG1-CD2 4.39Å; V481-Y483 HydrophobicContact CG1-CE1 3.88Å; V481-Y483 HydrophobicContact CG1-CE2 3.78Å; V481-Y483 VanDerWaalsContact CG1-CZ 3.5Å
484	R	97.7	Very high	92.4	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.2	177.2	-70.6	178.8	166.4	-175	-7.2	109.2	L322 H323 Y324 I325 A467 Y486 Y491	L322-R484 HydrophobicContact CD1-CG 4.11Å; H323-R484 PolarHBondContact O-N 2.81Å; Y324-R484 HydrophobicContact CD1-CB 3.77Å; Y324-R484 HydrophobicContact CD1-CG 4.43Å; Y324-R484 HydrophobicContact CE1-CB 4.14Å; Y324-R484 HydrophobicContact CE1-CG 4.35Å; Y324-R484 PolarHBondContact OH-NH1 3.44Å; I325-R484 CarbonylContact C-O 3.6Å; I325-R484 PolarHBondContact N-O 3.26Å; A467-R484 PolarHBondContact O-NH2 3.42Å; R484-Y486 HydrophobicContact CB-CD1 4.12Å; R484-Y486 HydrophobicContact CB-CD2 4.25Å; R484-Y486 HydrophobicContact CB-CE1 3.8Å; R484-Y486 HydrophobicContact CB-CE2 3.94Å; R484-Y486 HydrophobicContact CB-CG 4.34Å; R484-Y486 VanDerWaalsContact CD-OH 3.29Å; R484-Y486 WeakPolarHBondContact CD-OH 3.15Å; R484-Y486 HydrophobicContact CG-CE1 3.98Å; R484-Y486 HydrophobicContact CG-CE2 4Å; R484-Y486 WeakPolarHBondContact CG-OH 3.27Å; R484-Y486 PolarHBondContact NE-OH 3.11Å; R484-Y486 VanDerWaalsContact NE-OH 3.12Å; R484-Y486 PolarHBondContact O-N 3.19Å; R484-Y486 VanDerWaalsContact O-N 3.16Å; R484-Y491 VanDerWaalsContact NH1-CE2 3.27Å
485	F	95.6	Very high	92.5	Very high	14 Å²	14	48 Å²	48	6%	0.061	25%	0.249	C	C	.	.	S	Bend	trans	-84.6	29.8	178.5	-69.7	-58.7	0	0	0	113.5	I325 L327 P343 Y344 L347 A438 D439	I325-F485 WeakPolarHBondContact O-CA 3.36Å; I325-F485 WeakPolarHBondContact O-CD1 3.35Å; L327-F485 HydrophobicContact CD2-CB 4.21Å; L327-F485 HydrophobicContact CD2-CD1 4.06Å; L327-F485 HydrophobicContact CD2-CG 4.33Å; L327-F485 HydrophobicContact CG-CB 4.4Å; P343-F485 HydrophobicContact CB-CE1 4.14Å; P343-F485 HydrophobicContact CB-CZ 4.47Å; Y344-F485 HydrophobicContact CD1-CD2 4.39Å; Y344-F485 AromaticContact CD1-CE2 3.6Å; Y344-F485 HydrophobicContact CD1-CE2 3.6Å; Y344-F485 HydrophobicContact CD1-CZ 4.24Å; Y344-F485 AromaticContact CE1-CD2 3.73Å; Y344-F485 HydrophobicContact CE1-CD2 3.73Å; Y344-F485 AromaticContact CE1-CE2 3.39Å; Y344-F485 HydrophobicContact CE1-CE2 3.39Å; Y344-F485 HydrophobicContact CE1-CZ 4.38Å; Y344-F485 HydrophobicContact CG-CE2 4.43Å; L347-F485 HydrophobicContact CB-CZ 4.25Å; L347-F485 HydrophobicContact CD2-CE2 4.36Å; L347-F485 HydrophobicContact CD2-CZ 3.92Å; A438-F485 HydrophobicContact CB-CE2 3.96Å; D439-F485 PolarHBondContact O-N 2.92Å
486	Y	95.1	Very high	92.8	Very high	12 Å²	12	50.2 Å²	50.2	5%	0.047	27%	0.268	C	S	.	.	S	Bend	trans	-138.5	163.7	177.7	46.5	-87.8	0	0	0	108.1	Y324 D439 A467 R484 D490 Y491 F494	Y324-Y486 WeakPolarHBondContact CD1-O 3.45Å; Y324-Y486 HydrophobicContact CE1-CD2 4.41Å; Y324-Y486 HydrophobicContact CE1-CE2 4.26Å; D439-Y486 HydrophobicContact CB-CE1 4.22Å; D439-Y486 WeakPolarHBondContact O-CE1 3.47Å; D439-Y486 PolarHBondContact OD2-OH 2.79Å; A467-Y486 WeakPolarHBondContact CB-OH 3.45Å; R484-Y486 HydrophobicContact CB-CD1 4.12Å; R484-Y486 HydrophobicContact CB-CD2 4.25Å; R484-Y486 HydrophobicContact CB-CE1 3.8Å; R484-Y486 HydrophobicContact CB-CE2 3.94Å; R484-Y486 HydrophobicContact CB-CG 4.34Å; R484-Y486 VanDerWaalsContact CD-OH 3.29Å; R484-Y486 WeakPolarHBondContact CD-OH 3.15Å; R484-Y486 HydrophobicContact CG-CE1 3.98Å; R484-Y486 HydrophobicContact CG-CE2 4Å; R484-Y486 WeakPolarHBondContact CG-OH 3.27Å; R484-Y486 PolarHBondContact NE-OH 3.11Å; R484-Y486 VanDerWaalsContact NE-OH 3.12Å; R484-Y486 PolarHBondContact O-N 3.19Å; R484-Y486 VanDerWaalsContact O-N 3.16Å; Y486-D490 HydrophobicContact CD2-CB 4.44Å; Y486-Y491 HydrophobicContact CE2-CD2 4.31Å; Y486-F494 AromaticContact CD2-CE2 3.95Å; Y486-F494 HydrophobicContact CD2-CE2 3.95Å; Y486-F494 AromaticContact CD2-CZ 3.94Å; Y486-F494 HydrophobicContact CD2-CZ 3.94Å; Y486-F494 AromaticContact CE2-CE2 3.66Å; Y486-F494 HydrophobicContact CE2-CE2 3.66Å; Y486-F494 HydrophobicContact CE2-CZ 4.14Å; Y486-F494 HydrophobicContact CG-CE2 4.49Å; Y486-F494 HydrophobicContact CG-CZ 4.19Å; Y486-F494 AromaticContact CZ-CE2 3.97Å
487	T	95	Very high	93.2	Very high	46 Å²	46	52.2 Å²	52.2	28%	0.282	28%	0.278	S	S	.	.			trans	-76.3	165.6	178.6	66.5	0	0	0	0	111.2	P326 E489 D490 Y491	P326-T487 HydrophobicContact CB-CG2 3.67Å; P326-T487 HydrophobicContact CG-CG2 4.11Å; T487-E489 VanDerWaalsContact C-N 3.26Å; T487-E489 PolarHBondContact OG1-N 2.72Å; T487-D490 WeakPolarHBondContact CB-OD2 3.42Å; T487-D490 PolarHBondContact N-OD2 3.44Å; T487-D490 PolarHBondContact O-N 2.84Å; T487-D490 PolarHBondContact OG1-N 2.78Å; T487-D490 PolarHBondContact OG1-OD2 3.02Å; T487-Y491 PolarHBondContact O-N 3.22Å
488	Q	95.5	Very high	93.8	Very high	112 Å²	112	50.2 Å²	50.2	52%	0.523	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-34.7	169.7	-177	173.9	-20	0	0	111.4	Y324 D490 Y491 D492	Y324-Q488 HydrophobicContact CD1-CB 4.33Å; Y324-Q488 HydrophobicContact CD2-CB 4.12Å; Y324-Q488 HydrophobicContact CE1-CB 4.17Å; Y324-Q488 HydrophobicContact CE2-CB 3.96Å; Y324-Q488 HydrophobicContact CE2-CG 4.11Å; Y324-Q488 HydrophobicContact CG-CB 4.3Å; Q488-D490 PolarHBondContact O-N 2.98Å; Q488-Y491 WeakPolarHBondContact O-CB 3.45Å; Q488-Y491 PolarHBondContact O-N 3.18Å; Q488-D492 VanDerWaalsContact O-CG 3.3Å; Q488-D492 PolarHBondContact O-N 2.85Å
489	E	94.7	Very high	94.1	Very high	138 Å²	138	52.4 Å²	52.4	65%	0.645	28%	0.278	S	S	*	.	H	α-helix	trans	-61.6	-42.9	175.1	-175.6	176.4	-177.4	0	0	111.6	T487 Y491 D492 N493	T487-E489 VanDerWaalsContact C-N 3.26Å; T487-E489 PolarHBondContact OG1-N 2.72Å; E489-Y491 VanDerWaalsContact C-N 3.32Å; E489-Y491 PolarHBondContact O-N 3.39Å; E489-D492 PolarHBondContact O-N 2.93Å; E489-D492 VanDerWaalsContact O-N 3.17Å; E489-N493 WeakPolarHBondContact O-CB 3.25Å; E489-N493 PolarHBondContact O-N 3.36Å; E489-N493 PolarHBondContact O-ND2 2.89Å
490	D	94.9	Very high	94.3	Very high	66 Å²	66	50 Å²	50	35%	0.353	26%	0.262	S	S	.	.	H	α-helix	trans	-57.9	-46.5	173.5	-63.4	-45.3	0	0	0	111	Y486 T487 Q488 D492 N493 F494	Y486-D490 HydrophobicContact CD2-CB 4.44Å; T487-D490 WeakPolarHBondContact CB-OD2 3.42Å; T487-D490 PolarHBondContact N-OD2 3.44Å; T487-D490 PolarHBondContact O-N 2.84Å; T487-D490 PolarHBondContact OG1-N 2.78Å; T487-D490 PolarHBondContact OG1-OD2 3.02Å; Q488-D490 PolarHBondContact O-N 2.98Å; D490-D492 VanDerWaalsContact C-N 3.31Å; D490-D492 PolarHBondContact O-N 3.34Å; D490-N493 CarbonylContact O-C 3.58Å; D490-N493 PolarHBondContact O-N 3.37Å; D490-N493 VanDerWaalsContact O-N 3.16Å; D490-F494 HydrophobicContact CB-CE1 4.15Å; D490-F494 HydrophobicContact CB-CZ 4.38Å; D490-F494 WeakPolarHBondContact O-CD1 3.48Å; D490-F494 VanDerWaalsContact O-CE1 3.27Å; D490-F494 WeakPolarHBondContact O-CE1 3.44Å; D490-F494 WeakPolarHBondContact O-CG 3.37Å; D490-F494 PolarHBondContact O-N 3.23Å
491	Y	96	Very high	94.2	Very high	36 Å²	36	51.8 Å²	51.8	14%	0.141	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-42	176.6	172.8	-99.4	0	0	0	112.2	K464 A467 N468 R484 Y486 T487 Q488 E489 N493 F494	K464-Y491 HydrophobicContact CB-CE2 4.07Å; K464-Y491 WeakPolarHBondContact CE-O 3.5Å; K464-Y491 HydrophobicContact CG-CD2 4.43Å; K464-Y491 HydrophobicContact CG-CE2 3.96Å; A467-Y491 HydrophobicContact CB-CD2 4.12Å; A467-Y491 HydrophobicContact CB-CE2 3.91Å; N468-Y491 PolarHBondContact ND2-OH 3.44Å; R484-Y491 VanDerWaalsContact NH1-CE2 3.27Å; Y486-Y491 HydrophobicContact CE2-CD2 4.31Å; T487-Y491 PolarHBondContact O-N 3.22Å; Q488-Y491 WeakPolarHBondContact O-CB 3.45Å; Q488-Y491 PolarHBondContact O-N 3.18Å; E489-Y491 VanDerWaalsContact C-N 3.32Å; E489-Y491 PolarHBondContact O-N 3.39Å; Y491-N493 PolarHBondContact O-N 3.23Å; Y491-F494 HydrophobicContact CD2-CD2 4.25Å; Y491-F494 WeakPolarHBondContact O-CB 3.25Å; Y491-F494 PolarHBondContact O-N 3.23Å
492	D	95.8	Very high	94	Very high	81 Å²	81	51.6 Å²	51.6	43%	0.433	27%	0.268	S	S	.	.	H	α-helix	trans	-68	-27.3	179.6	-69.4	-27.8	0	0	0	111.8	K464 Q488 E489 D490	K464-D492 VanDerWaalsContact CE-O 3.24Å; K464-D492 WeakPolarHBondContact CE-O 3.32Å; K464-D492 PolarHBondContact NZ-O 3.11Å; Q488-D492 VanDerWaalsContact O-CG 3.3Å; Q488-D492 PolarHBondContact O-N 2.85Å; E489-D492 PolarHBondContact O-N 2.93Å; E489-D492 VanDerWaalsContact O-N 3.17Å; D490-D492 VanDerWaalsContact C-N 3.31Å; D490-D492 PolarHBondContact O-N 3.34Å
493	N	96	Very high	93.8	Very high	120 Å²	120	57 Å²	57	64%	0.642	29%	0.288	S	S	*	.	H	α-helix	trans	-83.5	-12.8	173.5	-70	-32.9	0	0	0	114.4	E489 D490 Y491	E489-N493 WeakPolarHBondContact O-CB 3.25Å; E489-N493 PolarHBondContact O-N 3.36Å; E489-N493 PolarHBondContact O-ND2 2.89Å; D490-N493 CarbonylContact O-C 3.58Å; D490-N493 PolarHBondContact O-N 3.37Å; D490-N493 VanDerWaalsContact O-N 3.16Å; Y491-N493 PolarHBondContact O-N 3.23Å
494	F	95.3	Very high	93.4	Very high	21 Å²	21	58.9 Å²	58.9	9%	0.092	30%	0.296	C	S	.	.	S	Bend	trans	-64	146	176	-68.5	-9.2	0	0	0	112	I462 K464 Y486 D490 Y491	I462-F494 HydrophobicContact CG1-CD2 4.1Å; I462-F494 HydrophobicContact CG1-CE2 3.79Å; I462-F494 WeakPolarHBondContact O-CB 3.17Å; I462-F494 WeakPolarHBondContact O-CD2 3.22Å; I462-F494 WeakPolarHBondContact O-CG 3.33Å; K464-F494 WeakPolarHBondContact CE-O 3.41Å; K464-F494 HydrophobicContact CG-CB 3.94Å; Y486-F494 AromaticContact CD2-CE2 3.95Å; Y486-F494 HydrophobicContact CD2-CE2 3.95Å; Y486-F494 AromaticContact CD2-CZ 3.94Å; Y486-F494 HydrophobicContact CD2-CZ 3.94Å; Y486-F494 AromaticContact CE2-CE2 3.66Å; Y486-F494 HydrophobicContact CE2-CE2 3.66Å; Y486-F494 HydrophobicContact CE2-CZ 4.14Å; Y486-F494 HydrophobicContact CG-CE2 4.49Å; Y486-F494 HydrophobicContact CG-CZ 4.19Å; Y486-F494 AromaticContact CZ-CE2 3.97Å; D490-F494 HydrophobicContact CB-CE1 4.15Å; D490-F494 HydrophobicContact CB-CZ 4.38Å; D490-F494 WeakPolarHBondContact O-CD1 3.48Å; D490-F494 VanDerWaalsContact O-CE1 3.27Å; D490-F494 WeakPolarHBondContact O-CE1 3.44Å; D490-F494 WeakPolarHBondContact O-CG 3.37Å; D490-F494 PolarHBondContact O-N 3.23Å; Y491-F494 HydrophobicContact CD2-CD2 4.25Å; Y491-F494 WeakPolarHBondContact O-CB 3.25Å; Y491-F494 PolarHBondContact O-N 3.23Å
495	E	93.8	Very high	93	Very high	134 Å²	134	60 Å²	60	63%	0.626	30%	0.303	S	S	*	.			trans	-58.2	145.9	171.4	-65	-172.2	173	0	0	110.6	S463 K464 F497	S463-E495 CarbonylContact C-O 3.58Å; S463-E495 VanDerWaalsContact CA-O 3.22Å; S463-E495 WeakPolarHBondContact CA-O 3.33Å; S463-E495 WeakPolarHBondContact CB-O 3.42Å; K464-E495 PolarHBondContact N-O 2.87Å; E495-F497 VanDerWaalsContact C-N 3.27Å; E495-F497 PolarHBondContact O-N 3.01Å
496	A	90.8	Very high	92.7	Very high	52 Å²	52	60.8 Å²	60.8	43%	0.43	31%	0.309	S	S	.	.	S	Bend	trans	-63.3	-36.1	-179.2	0	0	0	0	0	112.2	A465	A465-A496 WeakPolarHBondContact CB-O 3.47Å; A465-A496 PolarHBondContact N-O 2.79Å
497	F	89.4	Confident	92.5	Very high	86 Å²	86	60.5 Å²	60.5	38%	0.377	31%	0.309	S	S	.	.	S	Bend	trans	-139.1	153.4	-173.3	-57.4	-80.6	0	0	0	110.7	I296 N297 S463 A465 E495	I296-F497 HydrophobicContact CB-CE1 3.68Å; I296-F497 HydrophobicContact CB-CZ 4.44Å; I296-F497 HydrophobicContact CG2-CD1 4.09Å; I296-F497 HydrophobicContact CG2-CE1 3.05Å; I296-F497 HydrophobicContact CG2-CZ 3.42Å; I296-F497 VanDerWaalsContact CG2-CZ 3.42Å; N297-F497 HydrophobicContact CB-CD1 4.42Å; N297-F497 HydrophobicContact CB-CE1 3.59Å; N297-F497 HydrophobicContact CB-CZ 3.69Å; S463-F497 VanDerWaalsContact CB-C 3.42Å; A465-F497 HydrophobicContact CB-CD1 4.3Å; E495-F497 VanDerWaalsContact C-N 3.27Å; E495-F497 PolarHBondContact O-N 3.01Å
498	S	88	Confident	92.2	Very high	42 Å²	42	59.8 Å²	59.8	29%	0.294	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-73.7	153.4	168.2	45	0	0	0	0	110.8
499	T	90.1	Very high	91.8	Very high	61 Å²	61	56.7 Å²	56.7	37%	0.374	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-67.8	128.9	174.1	-65.4	0	0	0	0	110	R503 R504	T499-R503 HydrophobicContact CG2-CB 4.16Å; T499-R504 HydrophobicContact CG2-CG 4.19Å; T499-R504 PolarHBondContact O-NE 2.91Å; T499-R504 PolarHBondContact O-NH2 2.99Å
500	P	91.7	Very high	91.4	Very high	13 Å²	13	50.3 Å²	50.3	8%	0.084	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-53.7	141.7	179.4	-27.5	35.3	0	0	0	113	R266 I502 R503 D529	R266-P500 HydrophobicContact CB-CB 4.08Å; R266-P500 HydrophobicContact CB-CG 4.46Å; P500-I502 HydrophobicContact CB-CG2 4.2Å; P500-I502 PolarHBondContact O-N 2.86Å; P500-R503 PolarHBondContact O-N 3.25Å; P500-R503 VanDerWaalsContact O-N 3.11Å; P500-D529 HydrophobicContact CG-CB 4.48Å
501	E	91.8	Very high	91.2	Very high	41 Å²	41	47.3 Å²	47.3	19%	0.192	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-63.7	-30.3	-175	-171.9	178.2	-153.3	0	0	112.5	R266 H267 W268 R503 R504 V505	R266-E501 WeakPolarHBondContact O-CB 3.42Å; R266-E501 PolarHBondContact O-N 2.84Å; H267-E501 VanDerWaalsContact CA-OE2 3.28Å; H267-E501 WeakPolarHBondContact CA-OE2 3.38Å; H267-E501 IonicContact CE1-OE2 3.3Å; H267-E501 IonicContact CG-OE2 3.91Å; H267-E501 IonicContact ND1-OE2 3.03Å; H267-E501 PolarHBondContact ND1-OE2 3.47Å; W268-E501 HydrophobicContact CB-CB 4.35Å; W268-E501 HydrophobicContact CB-CG 4.39Å; W268-E501 PolarHBondContact N-OE2 2.89Å; E501-R503 PolarHBondContact O-N 3.23Å; E501-R504 PolarHBondContact O-N 3.14Å; E501-V505 HydrophobicContact CG-CG1 3.6Å; E501-V505 WeakPolarHBondContact O-CG2 3.32Å; E501-V505 PolarHBondContact O-N 3.37Å
502	I	91.9	Very high	90.9	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-59.4	-19.5	176.8	-161.7	169.2	0	0	0	113.5	W268 D271 P500 L507 L510 F527 P531	W268-I502 HydrophobicContact CB-CB 3.94Å; W268-I502 HydrophobicContact CB-CG1 4.35Å; D271-I502 HydrophobicContact CB-CD1 4.49Å; P500-I502 HydrophobicContact CB-CG2 4.2Å; P500-I502 PolarHBondContact O-N 2.86Å; I502-L507 HydrophobicContact CG1-CD2 4.05Å; I502-L510 HydrophobicContact CD1-CD2 4.09Å; I502-L510 HydrophobicContact CG1-CD2 4.42Å; I502-F527 HydrophobicContact CD1-CD1 3.55Å; I502-F527 HydrophobicContact CD1-CE1 3.52Å; I502-F527 HydrophobicContact CD1-CZ 4.45Å; I502-P531 HydrophobicContact CG1-CB 4.41Å
503	R	92	Very high	90.4	Very high	113 Å²	113	43.3 Å²	43.3	43%	0.426	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-93.3	-3.6	174.8	-65.6	-172.6	175.6	171.1	3.5	113.7	T499 P500 E501 P530	T499-R503 HydrophobicContact CG2-CB 4.16Å; P500-R503 PolarHBondContact O-N 3.25Å; P500-R503 VanDerWaalsContact O-N 3.11Å; E501-R503 PolarHBondContact O-N 3.23Å; R503-P530 PolarHBondContact NE-O 3.28Å; R503-P530 PolarHBondContact NH2-O 2.97Å; R503-P530 VanDerWaalsContact NH2-O 3.07Å
504	R	90.6	Very high	90	Very high	45 Å²	45	37.6 Å²	37.6	17%	0.17	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-1.7	-172.4	-67.1	-172.5	-68.7	97.4	-3.1	113.6	L446 S447 W448 T499 E501	L446-R504 PolarHBondContact O-NH1 3.42Å; S447-R504 CarbonylContact C-O 3.55Å; W448-R504 VanDerWaalsContact CB-O 3.28Å; W448-R504 WeakPolarHBondContact CB-O 3.45Å; W448-R504 PolarHBondContact N-O 2.89Å; T499-R504 HydrophobicContact CG2-CG 4.19Å; T499-R504 PolarHBondContact O-NE 2.91Å; T499-R504 PolarHBondContact O-NH2 2.99Å; E501-R504 PolarHBondContact O-N 3.14Å
505	V	89.6	Confident	89.6	Confident	26 Å²	26	37.3 Å²	37.3	16%	0.158	19%	0.194	C	C	.	.	S	Bend	trans	-121.4	153.3	-177.4	-60.4	0	0	0	0	111.7	W268 E501 L507	W268-V505 HydrophobicContact CB-CG2 4.12Å; W268-V505 HydrophobicContact CG-CG2 3.94Å; E501-V505 HydrophobicContact CG-CG1 3.6Å; E501-V505 WeakPolarHBondContact O-CG2 3.32Å; E501-V505 PolarHBondContact O-N 3.37Å; V505-L507 HydrophobicContact CG2-CD2 4.27Å
506	P	88.8	Confident	89.2	Confident	31 Å²	31	32.6 Å²	32.6	20%	0.201	17%	0.174	C	C	.	.			trans	-61.5	142.4	169.3	25.2	-33.9	0	0	0	111.4	W448 E508	W448-P506 HydrophobicContact CD2-CB 4.17Å; W448-P506 HydrophobicContact CD2-CG 4.5Å; W448-P506 HydrophobicContact CE3-CB 4.37Å; W448-P506 HydrophobicContact CE3-CG 4.3Å; W448-P506 HydrophobicContact CH2-CB 4.45Å; W448-P506 HydrophobicContact CZ2-CB 4.26Å; W448-P506 HydrophobicContact CZ3-CG 4.47Å; P506-E508 WeakPolarHBondContact CB-OE1 3.43Å; P506-E508 VanDerWaalsContact CB-OE2 3.32Å; P506-E508 WeakPolarHBondContact CB-OE2 3.44Å
507	L	89.9	Confident	88.8	Confident	6 Å²	6	32.3 Å²	32.3	3%	0.031	16%	0.164	C	C	.	.			trans	-108.8	-6.8	-168.1	-60.9	179.9	0	0	0	114.3	I502 V505 T509 L510 V511 P531 C535 I536 A539	I502-L507 HydrophobicContact CG1-CD2 4.05Å; V505-L507 HydrophobicContact CG2-CD2 4.27Å; L507-T509 VanDerWaalsContact C-N 3.3Å; L507-T509 PolarHBondContact O-N 3.25Å; L507-L510 HydrophobicContact CD2-CD2 4.21Å; L507-L510 WeakPolarHBondContact O-CB 3.1Å; L507-L510 PolarHBondContact O-N 3.15Å; L507-V511 HydrophobicContact CB-CG2 4.23Å; L507-V511 WeakPolarHBondContact O-CB 3.34Å; L507-V511 VanDerWaalsContact O-CG2 3.29Å; L507-V511 WeakPolarHBondContact O-CG2 3.37Å; L507-V511 PolarHBondContact O-N 2.86Å; L507-P531 HydrophobicContact CD1-CB 3.61Å; L507-P531 HydrophobicContact CD1-CG 3.88Å; L507-C535 HydrophobicContact CD1-CB 3.91Å; L507-I536 HydrophobicContact CD1-CG1 4.38Å; L507-A539 HydrophobicContact CB-CB 3.98Å
508	E	88.7	Confident	88.5	Confident	31 Å²	31	30.9 Å²	30.9	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-58.7	-37.9	-174	60.3	-79.7	-179.2	0	0	113.5	P506 L512 A539 I542 L543	P506-E508 WeakPolarHBondContact CB-OE1 3.43Å; P506-E508 VanDerWaalsContact CB-OE2 3.32Å; P506-E508 WeakPolarHBondContact CB-OE2 3.44Å; E508-L512 VanDerWaalsContact O-CB 3.32Å; E508-L512 WeakPolarHBondContact O-CB 3.5Å; E508-L512 PolarHBondContact O-N 3.18Å; E508-A539 HydrophobicContact CB-CB 4.22Å; E508-I542 HydrophobicContact CB-CB 4.44Å; E508-I542 HydrophobicContact CB-CG2 4.09Å; E508-I542 HydrophobicContact CG-CG2 4.08Å; E508-L543 HydrophobicContact CB-CD2 4.18Å; E508-L543 HydrophobicContact CB-CG 4.17Å
509	T	87	Confident	88.3	Confident	46 Å²	46	31.1 Å²	31.1	28%	0.282	17%	0.172	S	C	.	.	H	α-helix	trans	-66.8	-44	175.7	-60.1	0	0	0	0	110.7	L507 Q513	L507-T509 VanDerWaalsContact C-N 3.3Å; L507-T509 PolarHBondContact O-N 3.25Å; T509-Q513 WeakPolarHBondContact O-CB 3.19Å; T509-Q513 WeakPolarHBondContact O-CG 3.39Å; T509-Q513 PolarHBondContact O-N 3.48Å; T509-Q513 VanDerWaalsContact O-N 3.08Å
510	L	87.3	Confident	87.6	Confident	5 Å²	5	32.3 Å²	32.3	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-48.8	177.7	170	61.1	0	0	0	111.1	W268 C272 I502 L507 L512 Q513 M514 F527	W268-L510 HydrophobicContact CE3-CB 4.25Å; W268-L510 HydrophobicContact CE3-CD1 4.28Å; W268-L510 HydrophobicContact CE3-CD2 4.11Å; W268-L510 HydrophobicContact CE3-CG 4.44Å; W268-L510 HydrophobicContact CH2-CB 4.47Å; W268-L510 HydrophobicContact CZ3-CB 3.79Å; W268-L510 HydrophobicContact CZ3-CD1 3.86Å; W268-L510 HydrophobicContact CZ3-CD2 4.38Å; W268-L510 HydrophobicContact CZ3-CG 4.2Å; C272-L510 HydrophobicContact CB-CD1 3.82Å; C272-L510 WeakPolarHBondContact SG-CD1 3.37Å; I502-L510 HydrophobicContact CD1-CD2 4.09Å; I502-L510 HydrophobicContact CG1-CD2 4.42Å; L507-L510 HydrophobicContact CD2-CD2 4.21Å; L507-L510 WeakPolarHBondContact O-CB 3.1Å; L507-L510 PolarHBondContact O-N 3.15Å; L510-L512 PolarHBondContact O-N 3.22Å; L510-Q513 WeakPolarHBondContact O-CB 3.24Å; L510-Q513 PolarHBondContact O-N 3.12Å; L510-M514 HydrophobicContact CD1-CG 3.97Å; L510-M514 HydrophobicContact CD1-SD 3.82Å; L510-M514 HydrophobicContact CG-CG 4.47Å; L510-M514 HydrophobicContact CG-SD 3.91Å; L510-M514 VanDerWaalsContact O-CG 3.3Å; L510-M514 WeakPolarHBondContact O-CG 3.44Å; L510-M514 PolarHBondContact O-N 2.58Å; L510-F527 HydrophobicContact CD2-CE1 4.43Å
511	V	90.6	Very high	87.2	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-57	-48.5	179.3	166.1	0	0	0	0	110.3	L507 Q513 M514 L515 I522 A539 L540 L543	L507-V511 HydrophobicContact CB-CG2 4.23Å; L507-V511 WeakPolarHBondContact O-CB 3.34Å; L507-V511 VanDerWaalsContact O-CG2 3.29Å; L507-V511 WeakPolarHBondContact O-CG2 3.37Å; L507-V511 PolarHBondContact O-N 2.86Å; V511-Q513 PolarHBondContact O-N 3.43Å; V511-M514 PolarHBondContact O-N 3.38Å; V511-L515 HydrophobicContact CG1-CD1 4.37Å; V511-L515 WeakPolarHBondContact O-CG 3.47Å; V511-L515 PolarHBondContact O-N 3.21Å; V511-I522 HydrophobicContact CB-CD1 4.07Å; V511-I522 HydrophobicContact CG1-CD1 3.51Å; V511-I522 HydrophobicContact CG2-CD1 4.19Å; V511-A539 HydrophobicContact CB-CB 4.43Å; V511-A539 HydrophobicContact CG2-CB 3.91Å; V511-L540 HydrophobicContact CG1-CD2 3.66Å; V511-L540 HydrophobicContact CG1-CG 4.26Å; V511-L543 HydrophobicContact CB-CD1 4.06Å; V511-L543 HydrophobicContact CG1-CD1 3.46Å; V511-L543 VanDerWaalsContact CG1-CD1 3.46Å
512	L	89.2	Confident	86.9	Confident	5 Å²	5	33.4 Å²	33.4	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-60.7	-44.4	177.5	-178.9	60.8	0	0	0	112	E508 L510 M514 L515 V516 L543 A548 I549 V558 L565 F572	E508-L512 VanDerWaalsContact O-CB 3.32Å; E508-L512 WeakPolarHBondContact O-CB 3.5Å; E508-L512 PolarHBondContact O-N 3.18Å; L510-L512 PolarHBondContact O-N 3.22Å; L512-M514 VanDerWaalsContact C-N 3.32Å; L512-M514 PolarHBondContact O-N 2.95Å; L512-L515 PolarHBondContact O-N 3.09Å; L512-V516 HydrophobicContact CD1-CG2 4.49Å; L512-V516 WeakPolarHBondContact O-CG2 3.5Å; L512-V516 PolarHBondContact O-N 3.3Å; L512-L543 HydrophobicContact CB-CD1 4.03Å; L512-L543 HydrophobicContact CB-CD2 3.92Å; L512-L543 HydrophobicContact CD1-CD2 4.48Å; L512-L543 HydrophobicContact CD2-CD2 4.24Å; L512-L543 HydrophobicContact CG-CD2 4.44Å; L512-A548 HydrophobicContact CD1-CB 4.46Å; L512-I549 HydrophobicContact CD1-CG2 4.49Å; L512-V558 HydrophobicContact CD1-CG1 4.12Å; L512-L565 HydrophobicContact CD2-CB 4.06Å; L512-F572 HydrophobicContact CD2-CD2 4.45Å; L512-F572 HydrophobicContact CD2-CE2 4.21Å
513	Q	85.9	Confident	86.6	Confident	28 Å²	28	38.2 Å²	38.2	13%	0.131	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-41	177.5	-71.9	179.7	-8.5	0	0	112	T509 L510 V511 V516 M517	T509-Q513 WeakPolarHBondContact O-CB 3.19Å; T509-Q513 WeakPolarHBondContact O-CG 3.39Å; T509-Q513 PolarHBondContact O-N 3.48Å; T509-Q513 VanDerWaalsContact O-N 3.08Å; L510-Q513 WeakPolarHBondContact O-CB 3.24Å; L510-Q513 PolarHBondContact O-N 3.12Å; V511-Q513 PolarHBondContact O-N 3.43Å; Q513-V516 PolarHBondContact O-N 2.88Å; Q513-M517 WeakPolarHBondContact O-CE 3.45Å; Q513-M517 WeakPolarHBondContact O-CG 3.24Å; Q513-M517 PolarHBondContact O-N 3.44Å
514	M	87.3	Confident	86.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-43	176.8	-69.2	176	72.7	0	0	112.1	L510 V511 L512 V516 M517 G518 L519 I522 F525 F527	L510-M514 HydrophobicContact CD1-CG 3.97Å; L510-M514 HydrophobicContact CD1-SD 3.82Å; L510-M514 HydrophobicContact CG-CG 4.47Å; L510-M514 HydrophobicContact CG-SD 3.91Å; L510-M514 VanDerWaalsContact O-CG 3.3Å; L510-M514 WeakPolarHBondContact O-CG 3.44Å; L510-M514 PolarHBondContact O-N 2.58Å; V511-M514 PolarHBondContact O-N 3.38Å; L512-M514 VanDerWaalsContact C-N 3.32Å; L512-M514 PolarHBondContact O-N 2.95Å; M514-V516 VanDerWaalsContact C-N 3.33Å; M514-V516 PolarHBondContact O-N 3.37Å; M514-M517 HydrophobicContact CG-CE 4.26Å; M514-M517 PolarHBondContact O-N 3.04Å; M514-G518 PolarHBondContact O-N 3.4Å; M514-L519 HydrophobicContact CB-CB 4.43Å; M514-L519 HydrophobicContact CE-CD1 4.39Å; M514-L519 WeakPolarHBondContact O-CB 3.27Å; M514-L519 PolarHBondContact O-N 3.42Å; M514-I522 HydrophobicContact CB-CD1 4.4Å; M514-I522 HydrophobicContact CB-CG1 4.27Å; M514-I522 HydrophobicContact CE-CB 4.46Å; M514-I522 HydrophobicContact CE-CG1 4.27Å; M514-I522 HydrophobicContact CE-CG2 3.94Å; M514-I522 HydrophobicContact SD-CG2 4.1Å; M514-F525 HydrophobicContact CE-CB 3.61Å; M514-F525 HydrophobicContact CE-CD1 3.59Å; M514-F525 HydrophobicContact CE-CD2 3.4Å; M514-F525 HydrophobicContact CE-CE1 4.02Å; M514-F525 HydrophobicContact CE-CE2 3.87Å; M514-F525 HydrophobicContact CE-CG 3.22Å; M514-F525 HydrophobicContact CE-CZ 4.14Å; M514-F527 HydrophobicContact CE-CE2 4.41Å; M514-F527 HydrophobicContact CE-CZ 3.82Å; M514-F527 HydrophobicContact SD-CE1 4.49Å; M514-F527 HydrophobicContact SD-CZ 3.9Å
515	L	87.7	Confident	86.5	Confident	15 Å²	15	39.5 Å²	39.5	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-60.8	-43.2	176.4	-67	175.2	0	0	0	111.5	V511 L512 M517 G518 I522 I549 V558	V511-L515 HydrophobicContact CG1-CD1 4.37Å; V511-L515 WeakPolarHBondContact O-CG 3.47Å; V511-L515 PolarHBondContact O-N 3.21Å; L512-L515 PolarHBondContact O-N 3.09Å; L515-M517 VanDerWaalsContact C-N 3.31Å; L515-M517 PolarHBondContact O-N 3.4Å; L515-G518 PolarHBondContact O-N 2.69Å; L515-I522 HydrophobicContact CD2-CD1 3.94Å; L515-I522 HydrophobicContact CD2-CG1 4.43Å; L515-I522 HydrophobicContact CG-CD1 4.03Å; L515-I549 HydrophobicContact CD1-CD1 4.46Å; L515-I549 HydrophobicContact CD1-CG2 3.76Å; L515-V558 HydrophobicContact CB-CG2 3.56Å; L515-V558 HydrophobicContact CD1-CG2 4.37Å
516	V	84.3	Confident	86.6	Confident	35 Å²	35	40.1 Å²	40.1	21%	0.212	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-31.7	177.7	169.5	0	0	0	0	112.5	L512 Q513 M514 G518 V558 S566	L512-V516 HydrophobicContact CD1-CG2 4.49Å; L512-V516 WeakPolarHBondContact O-CG2 3.5Å; L512-V516 PolarHBondContact O-N 3.3Å; Q513-V516 PolarHBondContact O-N 2.88Å; M514-V516 VanDerWaalsContact C-N 3.33Å; M514-V516 PolarHBondContact O-N 3.37Å; V516-G518 PolarHBondContact O-N 2.76Å; V516-V558 HydrophobicContact CG2-CG1 3.95Å; V516-V558 HydrophobicContact CG2-CG2 4.24Å; V516-S566 WeakPolarHBondContact CG2-OG 3.4Å
517	M	83.5	Confident	86.8	Confident	45 Å²	45	39.7 Å²	39.7	22%	0.222	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	2.9	171.5	-70.5	-175.5	-63.2	0	0	113.6	M246 Q247 L276 Q513 M514 L515	M246-M517 HydrophobicContact CB-SD 4.38Å; Q247-M517 HydrophobicContact CG-CG 3.94Å; Q247-M517 HydrophobicContact CG-SD 4.06Å; L276-M517 HydrophobicContact CD1-CE 3.88Å; L276-M517 HydrophobicContact CD1-SD 4.19Å; L276-M517 HydrophobicContact CD2-CE 3.94Å; L276-M517 HydrophobicContact CD2-SD 4.29Å; Q513-M517 WeakPolarHBondContact O-CE 3.45Å; Q513-M517 WeakPolarHBondContact O-CG 3.24Å; Q513-M517 PolarHBondContact O-N 3.44Å; M514-M517 HydrophobicContact CG-CE 4.26Å; M514-M517 PolarHBondContact O-N 3.04Å; L515-M517 VanDerWaalsContact C-N 3.31Å; L515-M517 PolarHBondContact O-N 3.4Å
518	G	82.1	Confident	86.9	Confident	56 Å²	56	40.2 Å²	40.2	58%	0.577	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.2	27	178.4	0	0	0	0	0	113.9	M514 L515 V516 P520	M514-G518 PolarHBondContact O-N 3.4Å; L515-G518 PolarHBondContact O-N 2.69Å; V516-G518 PolarHBondContact O-N 2.76Å; G518-P520 VanDerWaalsContact C-CD 3.41Å; G518-P520 WeakPolarHBondContact O-CD 3.15Å
519	L	83.5	Confident	86.9	Confident	48 Å²	48	40.7 Å²	40.7	25%	0.251	22%	0.224	S	C	.	.			trans	-105.3	79.6	174.8	-60	168.4	0	0	0	109.9	L276 M514 F525	L276-L519 HydrophobicContact CD2-CD1 3.64Å; M514-L519 HydrophobicContact CB-CB 4.43Å; M514-L519 HydrophobicContact CE-CD1 4.39Å; M514-L519 WeakPolarHBondContact O-CB 3.27Å; M514-L519 PolarHBondContact O-N 3.42Å; L519-F525 HydrophobicContact CD1-CD2 3.85Å; L519-F525 HydrophobicContact CD1-CE2 3.7Å
520	P	75.1	Confident	87.1	Confident	86 Å²	86	41.4 Å²	41.4	56%	0.558	23%	0.229	S	C	*	.			trans	-69.7	-36.3	-172.9	27.3	-35.3	0	0	0	112.8	G518 I522	G518-P520 VanDerWaalsContact C-CD 3.41Å; G518-P520 WeakPolarHBondContact O-CD 3.15Å; P520-I522 PolarHBondContact O-N 2.95Å
521	D	83.5	Confident	87.3	Confident	67 Å²	67	41.5 Å²	41.5	36%	0.358	23%	0.23	S	C	.	.			trans	-96	75.7	-178.6	-163	-16.1	0	0	0	111.1	K523 K524 F525	D521-K523 PolarHBondContact O-N 3.06Å; D521-K523 PolarHBondContact OD1-N 3.46Å; D521-K524 HydrophobicContact CB-CB 4.35Å; D521-K524 PolarHBondContact O-N 3.48Å; D521-K524 PolarHBondContact OD1-N 3.14Å; D521-K524 WeakPolarHBondContact OD2-CD 3.4Å; D521-K524 WeakPolarHBondContact OD2-CE 3.48Å; D521-K524 WeakPolarHBondContact OD2-CG 3.44Å; D521-K524 IonicContact OD2-NZ 2.7Å; D521-K524 PolarHBondContact OD2-NZ 3.48Å; D521-F525 PolarHBondContact O-N 3.11Å
522	I	85.7	Confident	87.2	Confident	9 Å²	9	47.1 Å²	47.1	5%	0.046	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-59.7	-29.2	179.3	-61.1	166.3	0	0	0	111.2	V511 M514 L515 P520 K524 F525 F527 I536	V511-I522 HydrophobicContact CB-CD1 4.07Å; V511-I522 HydrophobicContact CG1-CD1 3.51Å; V511-I522 HydrophobicContact CG2-CD1 4.19Å; M514-I522 HydrophobicContact CB-CD1 4.4Å; M514-I522 HydrophobicContact CB-CG1 4.27Å; M514-I522 HydrophobicContact CE-CB 4.46Å; M514-I522 HydrophobicContact CE-CG1 4.27Å; M514-I522 HydrophobicContact CE-CG2 3.94Å; M514-I522 HydrophobicContact SD-CG2 4.1Å; L515-I522 HydrophobicContact CD2-CD1 3.94Å; L515-I522 HydrophobicContact CD2-CG1 4.43Å; L515-I522 HydrophobicContact CG-CD1 4.03Å; P520-I522 PolarHBondContact O-N 2.95Å; I522-K524 PolarHBondContact O-N 3.29Å; I522-F525 VanDerWaalsContact O-CB 3.24Å; I522-F525 WeakPolarHBondContact O-CB 3.3Å; I522-F525 PolarHBondContact O-N 3.12Å; I522-F525 VanDerWaalsContact O-N 3.1Å; I522-F527 HydrophobicContact CG2-CE2 4.22Å; I522-F527 HydrophobicContact CG2-CZ 4.35Å; I522-I536 HydrophobicContact CG2-CD1 4.46Å; I522-I536 HydrophobicContact CG2-CG2 4.46Å
523	K	86.3	Confident	87.1	Confident	102 Å²	102	51.1 Å²	51.1	44%	0.443	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-67.3	-25	178.4	-62.4	-174.5	179	-173.1	0	112.2	D521 M533 D537	D521-K523 PolarHBondContact O-N 3.06Å; D521-K523 PolarHBondContact OD1-N 3.46Å; K523-M533 HydrophobicContact CB-SD 4.48Å; K523-M533 HydrophobicContact CD-SD 4.33Å; K523-M533 HydrophobicContact CG-SD 4.16Å; K523-D537 VanDerWaalsContact CE-OD1 3.29Å; K523-D537 WeakPolarHBondContact CE-OD1 3.12Å; K523-D537 IonicContact NZ-OD1 2.88Å; K523-D537 PolarHBondContact NZ-OD1 2.89Å; K523-D537 IonicContact NZ-OD2 3.14Å
524	K	88	Confident	87.3	Confident	169 Å²	169	57.4 Å²	57.4	74%	0.735	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-93.8	-3.3	173.2	-68.4	-174.7	-172.1	129.9	0	113.9	D521 I522	D521-K524 HydrophobicContact CB-CB 4.35Å; D521-K524 PolarHBondContact O-N 3.48Å; D521-K524 PolarHBondContact OD1-N 3.14Å; D521-K524 WeakPolarHBondContact OD2-CD 3.4Å; D521-K524 WeakPolarHBondContact OD2-CE 3.48Å; D521-K524 WeakPolarHBondContact OD2-CG 3.44Å; D521-K524 IonicContact OD2-NZ 2.7Å; D521-K524 PolarHBondContact OD2-NZ 3.48Å; I522-K524 PolarHBondContact O-N 3.29Å
525	F	92	Very high	87.4	Confident	17 Å²	17	58.5 Å²	58.5	8%	0.075	31%	0.31	C	S	.	.	S	Bend	trans	-62.6	137.3	179.9	-178.4	-96.6	0	0	0	110.7	G275 L276 M514 L519 D521 I522 F527	G275-F525 VanDerWaalsContact C-CZ 3.49Å; L276-F525 HydrophobicContact CD2-CE2 3.93Å; L276-F525 HydrophobicContact CD2-CZ 4.2Å; L276-F525 HydrophobicContact CG-CE2 4.27Å; L276-F525 HydrophobicContact CG-CZ 4.02Å; M514-F525 HydrophobicContact CE-CB 3.61Å; M514-F525 HydrophobicContact CE-CD1 3.59Å; M514-F525 HydrophobicContact CE-CD2 3.4Å; M514-F525 HydrophobicContact CE-CE1 4.02Å; M514-F525 HydrophobicContact CE-CE2 3.87Å; M514-F525 HydrophobicContact CE-CG 3.22Å; M514-F525 HydrophobicContact CE-CZ 4.14Å; L519-F525 HydrophobicContact CD1-CD2 3.85Å; L519-F525 HydrophobicContact CD1-CE2 3.7Å; D521-F525 PolarHBondContact O-N 3.11Å; I522-F525 VanDerWaalsContact O-CB 3.24Å; I522-F525 WeakPolarHBondContact O-CB 3.3Å; I522-F525 PolarHBondContact O-N 3.12Å; I522-F525 VanDerWaalsContact O-N 3.1Å; F525-F527 VanDerWaalsContact C-N 3.26Å; F525-F527 HydrophobicContact CB-CD2 4.25Å; F525-F527 HydrophobicContact CB-CE2 3.87Å; F525-F527 HydrophobicContact CB-CZ 4.39Å; F525-F527 AromaticContact CD1-CD1 3.69Å; F525-F527 HydrophobicContact CD1-CD1 3.69Å; F525-F527 AromaticContact CD1-CD2 3.65Å; F525-F527 HydrophobicContact CD1-CD2 3.65Å; F525-F527 AromaticContact CD1-CE1 3.54Å; F525-F527 HydrophobicContact CD1-CE1 3.54Å; F525-F527 AromaticContact CD1-CE2 3.51Å; F525-F527 HydrophobicContact CD1-CE2 3.51Å; F525-F527 AromaticContact CD1-CG 3.74Å; F525-F527 HydrophobicContact CD1-CG 3.74Å; F525-F527 AromaticContact CD1-CZ 3.46Å; F525-F527 HydrophobicContact CD1-CZ 3.46Å; F525-F527 VanDerWaalsContact CD1-CZ 3.46Å; F525-F527 AromaticContact CE1-CD1 3.81Å; F525-F527 HydrophobicContact CE1-CD1 3.81Å; F525-F527 AromaticContact CE1-CE1 3.69Å; F525-F527 HydrophobicContact CE1-CE1 3.69Å; F525-F527 HydrophobicContact CE1-CE2 4.47Å; F525-F527 HydrophobicContact CE1-CG 4.26Å; F525-F527 HydrophobicContact CE1-CZ 4.05Å; F525-F527 HydrophobicContact CG-CD2 4.45Å; F525-F527 HydrophobicContact CG-CE2 4.12Å; F525-F527 HydrophobicContact CG-CZ 4.23Å; F525-F527 PolarHBondContact O-N 3.37Å
526	P	92.1	Very high	87.5	Confident	39 Å²	39	57.9 Å²	57.9	25%	0.253	31%	0.307	S	S	.	.			trans	-77.3	75	-176.9	32.9	-37	0	0	0	110.9	G275 K278 F304	G275-P526 WeakPolarHBondContact CA-O 3.45Å; K278-P526 HydrophobicContact CD-CB 4.24Å; F304-P526 HydrophobicContact CE2-CB 4.36Å; F304-P526 VanDerWaalsContact CE2-O 3.31Å; F304-P526 WeakPolarHBondContact CE2-O 3.37Å; F304-P526 HydrophobicContact CZ-CB 4.43Å; F304-P526 WeakPolarHBondContact CZ-O 3.48Å
527	F	92.8	Very high	87.7	Confident	21 Å²	21	59.1 Å²	59.1	9%	0.092	31%	0.312	C	S	.	.			trans	-69.2	140.4	166.2	-67	-73.6	0	0	0	110	I502 L510 M514 I522 F525 D529 P530	I502-F527 HydrophobicContact CD1-CD1 3.55Å; I502-F527 HydrophobicContact CD1-CE1 3.52Å; I502-F527 HydrophobicContact CD1-CZ 4.45Å; L510-F527 HydrophobicContact CD2-CE1 4.43Å; M514-F527 HydrophobicContact CE-CE2 4.41Å; M514-F527 HydrophobicContact CE-CZ 3.82Å; M514-F527 HydrophobicContact SD-CE1 4.49Å; M514-F527 HydrophobicContact SD-CZ 3.9Å; I522-F527 HydrophobicContact CG2-CE2 4.22Å; I522-F527 HydrophobicContact CG2-CZ 4.35Å; F525-F527 VanDerWaalsContact C-N 3.26Å; F525-F527 HydrophobicContact CB-CD2 4.25Å; F525-F527 HydrophobicContact CB-CE2 3.87Å; F525-F527 HydrophobicContact CB-CZ 4.39Å; F525-F527 AromaticContact CD1-CD1 3.69Å; F525-F527 HydrophobicContact CD1-CD1 3.69Å; F525-F527 AromaticContact CD1-CD2 3.65Å; F525-F527 HydrophobicContact CD1-CD2 3.65Å; F525-F527 AromaticContact CD1-CE1 3.54Å; F525-F527 HydrophobicContact CD1-CE1 3.54Å; F525-F527 AromaticContact CD1-CE2 3.51Å; F525-F527 HydrophobicContact CD1-CE2 3.51Å; F525-F527 AromaticContact CD1-CG 3.74Å; F525-F527 HydrophobicContact CD1-CG 3.74Å; F525-F527 AromaticContact CD1-CZ 3.46Å; F525-F527 HydrophobicContact CD1-CZ 3.46Å; F525-F527 VanDerWaalsContact CD1-CZ 3.46Å; F525-F527 AromaticContact CE1-CD1 3.81Å; F525-F527 HydrophobicContact CE1-CD1 3.81Å; F525-F527 AromaticContact CE1-CE1 3.69Å; F525-F527 HydrophobicContact CE1-CE1 3.69Å; F525-F527 HydrophobicContact CE1-CE2 4.47Å; F525-F527 HydrophobicContact CE1-CG 4.26Å; F525-F527 HydrophobicContact CE1-CZ 4.05Å; F525-F527 HydrophobicContact CG-CD2 4.45Å; F525-F527 HydrophobicContact CG-CE2 4.12Å; F525-F527 HydrophobicContact CG-CZ 4.23Å; F525-F527 PolarHBondContact O-N 3.37Å; F527-D529 VanDerWaalsContact C-N 3.34Å; F527-P530 HydrophobicContact CB-CB 4.23Å
528	I	91.8	Very high	87.9	Confident	17 Å²	17	58 Å²	58	9%	0.087	31%	0.306	C	S	.	.	S	Bend	trans	-62.8	-44.1	172.3	-176.9	167.7	0	0	0	111	D271 L274 T300 F301 F304	D271-I528 HydrophobicContact CB-CG2 4.2Å; L274-I528 HydrophobicContact CD1-CD1 4.32Å; L274-I528 HydrophobicContact CD1-CG2 4.22Å; T300-I528 HydrophobicContact CG2-CD1 4.13Å; T300-I528 HydrophobicContact CG2-CG1 4.05Å; F301-I528 HydrophobicContact CD1-CD1 3.35Å; F301-I528 HydrophobicContact CE1-CD1 3.41Å; F301-I528 VanDerWaalsContact CE1-CD1 3.41Å; F301-I528 HydrophobicContact CG-CD1 4.07Å; F301-I528 HydrophobicContact CZ-CD1 4.17Å; F304-I528 HydrophobicContact CB-CD1 4.44Å; F304-I528 HydrophobicContact CB-CG1 4.39Å; F304-I528 HydrophobicContact CD2-CB 4.01Å; F304-I528 HydrophobicContact CD2-CG1 4.22Å; F304-I528 HydrophobicContact CE2-CB 4.12Å; F304-I528 HydrophobicContact CG-CB 4.3Å; F304-I528 HydrophobicContact CG-CG1 4.25Å; F304-I528 HydrophobicContact CZ-CB 4.49Å
529	D	89.9	Confident	88.2	Confident	42 Å²	42	55.4 Å²	55.4	23%	0.225	28%	0.279	C	S	.	.	S	Bend	trans	-128.7	113.4	164.4	-75.1	-63.8	0	0	0	107.5	R266 P500 F527	R266-D529 IonicContact CZ-OD2 3.36Å; R266-D529 IonicContact NH1-OD2 2.65Å; R266-D529 PolarHBondContact NH1-OD2 2.79Å; R266-D529 IonicContact NH2-OD2 2.75Å; R266-D529 PolarHBondContact NH2-OD2 2.93Å; P500-D529 HydrophobicContact CG-CB 4.48Å; F527-D529 VanDerWaalsContact C-N 3.34Å
530	P	90.3	Very high	88.5	Confident	61 Å²	61	54 Å²	54	40%	0.396	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-66.7	145.7	-178.7	26	-32.9	0	0	0	110.9	R503 F527	R503-P530 PolarHBondContact NE-O 3.28Å; R503-P530 PolarHBondContact NH2-O 2.97Å; R503-P530 VanDerWaalsContact NH2-O 3.07Å; F527-P530 HydrophobicContact CB-CB 4.23Å
531	P	90.6	Very high	89.1	Confident	7 Å²	7	53.6 Å²	53.6	5%	0.045	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-67.9	164.3	167	30.6	-33.6	0	0	0	110.5	I502 L507 M533 I536	I502-P531 HydrophobicContact CG1-CB 4.41Å; L507-P531 HydrophobicContact CD1-CB 3.61Å; L507-P531 HydrophobicContact CD1-CG 3.88Å; P531-M533 PolarHBondContact O-N 3.23Å; P531-I536 HydrophobicContact CG-CD1 3.91Å; P531-I536 HydrophobicContact CG-CG1 3.95Å
532	E	89	Confident	89.2	Confident	120 Å²	120	51.1 Å²	51.1	56%	0.561	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-62.4	135.7	173.8	-64.5	-173.8	-169.9	0	0	110.6	K534 C535 I536	E532-K534 PolarHBondContact O-N 3.48Å; E532-K534 VanDerWaalsContact O-N 3.17Å; E532-C535 WeakPolarHBondContact O-CB 3.39Å; E532-C535 PolarHBondContact O-N 2.79Å; E532-I536 PolarHBondContact O-N 3.29Å
533	M	88.6	Confident	89.3	Confident	89 Å²	89	50.7 Å²	50.7	44%	0.438	25%	0.249	S	C	.	.	H	α-helix	trans	-57.5	-35.2	-178.1	-66.3	-65.6	155.1	0	0	112.2	K523 P531 C535 I536 D537	K523-M533 HydrophobicContact CB-SD 4.48Å; K523-M533 HydrophobicContact CD-SD 4.33Å; K523-M533 HydrophobicContact CG-SD 4.16Å; P531-M533 PolarHBondContact O-N 3.23Å; M533-C535 VanDerWaalsContact C-N 3.28Å; M533-C535 PolarHBondContact O-N 3.24Å; M533-I536 WeakPolarHBondContact O-CB 3.45Å; M533-I536 PolarHBondContact O-N 2.9Å; M533-I536 VanDerWaalsContact O-N 3.14Å; M533-I536 HydrophobicContact SD-CD1 4.19Å; M533-D537 PolarHBondContact O-N 3.07Å
534	K	88.1	Confident	89.3	Confident	161 Å²	161	50 Å²	50	70%	0.7	25%	0.247	S	C	*	.	H	α-helix	trans	-59.6	-37.2	176.2	-65.3	179.6	-179.4	174.9	0	112.6	E532 D537 E538	E532-K534 PolarHBondContact O-N 3.48Å; E532-K534 VanDerWaalsContact O-N 3.17Å; K534-D537 PolarHBondContact O-N 3.33Å; K534-E538 WeakPolarHBondContact O-CB 3.48Å; K534-E538 PolarHBondContact O-N 3.43Å
535	C	89.5	Confident	88.9	Confident	22 Å²	22	42.6 Å²	42.6	15%	0.149	22%	0.216	C	C	.	.	H	α-helix	trans	-71.9	-33.8	178	-60.5	0	0	0	0	111.7	L507 E532 M533 A539	L507-C535 HydrophobicContact CD1-CB 3.91Å; E532-C535 WeakPolarHBondContact O-CB 3.39Å; E532-C535 PolarHBondContact O-N 2.79Å; M533-C535 VanDerWaalsContact C-N 3.28Å; M533-C535 PolarHBondContact O-N 3.24Å; C535-A539 VanDerWaalsContact O-CB 3.32Å; C535-A539 WeakPolarHBondContact O-CB 3.32Å; C535-A539 PolarHBondContact O-N 3.47Å
536	I	89.9	Confident	88.2	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-47.4	172.2	-62.9	171.9	0	0	0	110	L507 I522 P531 E532 M533 E538 A539 L540	L507-I536 HydrophobicContact CD1-CG1 4.38Å; I522-I536 HydrophobicContact CG2-CD1 4.46Å; I522-I536 HydrophobicContact CG2-CG2 4.46Å; P531-I536 HydrophobicContact CG-CD1 3.91Å; P531-I536 HydrophobicContact CG-CG1 3.95Å; E532-I536 PolarHBondContact O-N 3.29Å; M533-I536 WeakPolarHBondContact O-CB 3.45Å; M533-I536 PolarHBondContact O-N 2.9Å; M533-I536 VanDerWaalsContact O-N 3.14Å; M533-I536 HydrophobicContact SD-CD1 4.19Å; I536-E538 VanDerWaalsContact C-N 3.31Å; I536-E538 PolarHBondContact O-N 3.11Å; I536-A539 PolarHBondContact O-N 3.29Å; I536-L540 HydrophobicContact CG2-CD1 4.16Å; I536-L540 HydrophobicContact CG2-CG 4.46Å; I536-L540 WeakPolarHBondContact O-CG 3.29Å; I536-L540 PolarHBondContact O-N 2.9Å
537	D	89.6	Confident	87.7	Confident	60 Å²	60	41.9 Å²	41.9	32%	0.321	22%	0.218	S	C	.	.	H	α-helix	trans	-61.9	-41.3	179.6	-67.2	-32.9	0	0	0	110.8	K523 M533 K534 L540 D541	K523-D537 VanDerWaalsContact CE-OD1 3.29Å; K523-D537 WeakPolarHBondContact CE-OD1 3.12Å; K523-D537 IonicContact NZ-OD1 2.88Å; K523-D537 PolarHBondContact NZ-OD1 2.89Å; K523-D537 IonicContact NZ-OD2 3.14Å; M533-D537 PolarHBondContact O-N 3.07Å; K534-D537 PolarHBondContact O-N 3.33Å; D537-L540 WeakPolarHBondContact O-CB 3.49Å; D537-L540 PolarHBondContact O-N 3.27Å; D537-D541 WeakPolarHBondContact O-CB 3.33Å; D537-D541 VanDerWaalsContact O-CG 3.29Å; D537-D541 PolarHBondContact O-N 2.7Å
538	E	86.9	Confident	87.4	Confident	22 Å²	22	40.9 Å²	40.9	10%	0.103	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-47.7	172.7	-173.2	-170	-176.8	0	0	112.2	S450 R453 K534 I536 L540 D541 I542	S450-E538 WeakPolarHBondContact CA-OE2 3.33Å; S450-E538 WeakPolarHBondContact CB-OE2 3.1Å; R453-E538 VanDerWaalsContact CG-OE1 3.28Å; R453-E538 WeakPolarHBondContact CG-OE1 3.3Å; R453-E538 IonicContact NE-OE1 3.2Å; R453-E538 PolarHBondContact NE-OE1 3.34Å; R453-E538 VanDerWaalsContact NE-OE1 3.08Å; K534-E538 WeakPolarHBondContact O-CB 3.48Å; K534-E538 PolarHBondContact O-N 3.43Å; I536-E538 VanDerWaalsContact C-N 3.31Å; I536-E538 PolarHBondContact O-N 3.11Å; E538-L540 VanDerWaalsContact C-N 3.29Å; E538-L540 PolarHBondContact O-N 3.01Å; E538-D541 CarbonylContact O-C 3.58Å; E538-D541 PolarHBondContact O-N 3.44Å; E538-D541 VanDerWaalsContact O-N 3.09Å; E538-I542 HydrophobicContact CG-CD1 3.99Å; E538-I542 HydrophobicContact CG-CG1 4.42Å; E538-I542 VanDerWaalsContact O-CG1 3.31Å; E538-I542 WeakPolarHBondContact O-CG1 3.42Å; E538-I542 PolarHBondContact O-N 2.99Å
539	A	89.5	Confident	87.2	Confident	2 Å²	2	40.2 Å²	40.2	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-41.6	178.1	0	0	0	0	0	111.6	L507 E508 V511 C535 I536 I542 L543	L507-A539 HydrophobicContact CB-CB 3.98Å; E508-A539 HydrophobicContact CB-CB 4.22Å; V511-A539 HydrophobicContact CB-CB 4.43Å; V511-A539 HydrophobicContact CG2-CB 3.91Å; C535-A539 VanDerWaalsContact O-CB 3.32Å; C535-A539 WeakPolarHBondContact O-CB 3.32Å; C535-A539 PolarHBondContact O-N 3.47Å; I536-A539 PolarHBondContact O-N 3.29Å; A539-I542 PolarHBondContact O-N 3.04Å; A539-L543 VanDerWaalsContact O-CG 3.3Å; A539-L543 WeakPolarHBondContact O-CG 3.31Å; A539-L543 PolarHBondContact O-N 3.15Å
540	L	89.8	Confident	87.1	Confident	17 Å²	17	41.9 Å²	41.9	9%	0.089	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-43.6	172.7	-71.4	172.7	0	0	0	111.5	V511 I536 D537 E538 I542 L543 K544 I549 L556	V511-L540 HydrophobicContact CG1-CD2 3.66Å; V511-L540 HydrophobicContact CG1-CG 4.26Å; I536-L540 HydrophobicContact CG2-CD1 4.16Å; I536-L540 HydrophobicContact CG2-CG 4.46Å; I536-L540 WeakPolarHBondContact O-CG 3.29Å; I536-L540 PolarHBondContact O-N 2.9Å; D537-L540 WeakPolarHBondContact O-CB 3.49Å; D537-L540 PolarHBondContact O-N 3.27Å; E538-L540 VanDerWaalsContact C-N 3.29Å; E538-L540 PolarHBondContact O-N 3.01Å; L540-I542 VanDerWaalsContact C-N 3.3Å; L540-I542 PolarHBondContact O-N 3.43Å; L540-L543 PolarHBondContact O-N 3.27Å; L540-K544 VanDerWaalsContact O-CG 3.29Å; L540-K544 WeakPolarHBondContact O-CG 3.42Å; L540-K544 PolarHBondContact O-N 3.39Å; L540-I549 HydrophobicContact CD2-CD1 3.77Å; L540-L556 HydrophobicContact CD1-CD1 4.25Å; L540-L556 HydrophobicContact CD2-CD1 3.82Å
541	D	87	Confident	86.6	Confident	79 Å²	79	43.1 Å²	43.1	42%	0.422	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-35.9	177.4	-72.7	-15.1	0	0	0	112	D537 E538 K544 S545	D537-D541 WeakPolarHBondContact O-CB 3.33Å; D537-D541 VanDerWaalsContact O-CG 3.29Å; D537-D541 PolarHBondContact O-N 2.7Å; E538-D541 CarbonylContact O-C 3.58Å; E538-D541 PolarHBondContact O-N 3.44Å; E538-D541 VanDerWaalsContact O-N 3.09Å; D541-K544 IonicContact OD1-NZ 2.82Å; D541-K544 PolarHBondContact OD1-NZ 2.92Å; D541-S545 WeakPolarHBondContact O-CA 3.38Å; D541-S545 WeakPolarHBondContact O-CB 3.45Å; D541-S545 PolarHBondContact O-N 3.35Å
542	I	85.1	Confident	85.9	Confident	14 Å²	14	47.9 Å²	47.9	7%	0.072	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-41.2	172	-69.7	168.6	0	0	0	111.1	E508 E538 A539 L540 S545 H546	E508-I542 HydrophobicContact CB-CB 4.44Å; E508-I542 HydrophobicContact CB-CG2 4.09Å; E508-I542 HydrophobicContact CG-CG2 4.08Å; E538-I542 HydrophobicContact CG-CD1 3.99Å; E538-I542 HydrophobicContact CG-CG1 4.42Å; E538-I542 VanDerWaalsContact O-CG1 3.31Å; E538-I542 WeakPolarHBondContact O-CG1 3.42Å; E538-I542 PolarHBondContact O-N 2.99Å; A539-I542 PolarHBondContact O-N 3.04Å; L540-I542 VanDerWaalsContact C-N 3.3Å; L540-I542 PolarHBondContact O-N 3.43Å; I542-S545 WeakPolarHBondContact O-CB 3.24Å; I542-S545 PolarHBondContact O-N 3.42Å; I542-S545 PolarHBondContact O-OG 3.01Å; I542-H546 PolarHBondContact O-N 3.08Å; I542-H546 VanDerWaalsContact O-N 3.16Å; I542-H546 PolarHBondContact O-ND1 3.17Å
543	L	88.2	Confident	85.1	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.2	-42.7	178.1	-69.4	172.7	0	0	0	112.3	E508 V511 L512 A539 L540 S545 H546 G547 A548 I549 F572	E508-L543 HydrophobicContact CB-CD2 4.18Å; E508-L543 HydrophobicContact CB-CG 4.17Å; V511-L543 HydrophobicContact CB-CD1 4.06Å; V511-L543 HydrophobicContact CG1-CD1 3.46Å; V511-L543 VanDerWaalsContact CG1-CD1 3.46Å; L512-L543 HydrophobicContact CB-CD1 4.03Å; L512-L543 HydrophobicContact CB-CD2 3.92Å; L512-L543 HydrophobicContact CD1-CD2 4.48Å; L512-L543 HydrophobicContact CD2-CD2 4.24Å; L512-L543 HydrophobicContact CG-CD2 4.44Å; A539-L543 VanDerWaalsContact O-CG 3.3Å; A539-L543 WeakPolarHBondContact O-CG 3.31Å; A539-L543 PolarHBondContact O-N 3.15Å; L540-L543 PolarHBondContact O-N 3.27Å; L543-S545 VanDerWaalsContact C-N 3.29Å; L543-S545 PolarHBondContact O-N 3.37Å; L543-H546 PolarHBondContact O-N 3.44Å; L543-G547 PolarHBondContact O-N 3.45Å; L543-A548 HydrophobicContact CB-CB 4.46Å; L543-A548 HydrophobicContact CD2-CB 4.16Å; L543-A548 PolarHBondContact O-N 3.03Å; L543-I549 HydrophobicContact CB-CD1 3.66Å; L543-I549 HydrophobicContact CB-CG1 3.77Å; L543-I549 HydrophobicContact CB-CG2 4.34Å; L543-I549 HydrophobicContact CD1-CD1 4.35Å; L543-F572 HydrophobicContact CD2-CD2 3.87Å; L543-F572 HydrophobicContact CD2-CE2 3.5Å; L543-F572 HydrophobicContact CD2-CZ 4.48Å
544	K	86.5	Confident	84.3	Confident	89 Å²	89	54 Å²	54	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-45.7	171.8	-67.7	169.7	-160	158.7	0	110.4	L540 D541 H546 G547 I549	L540-K544 VanDerWaalsContact O-CG 3.29Å; L540-K544 WeakPolarHBondContact O-CG 3.42Å; L540-K544 PolarHBondContact O-N 3.39Å; D541-K544 IonicContact OD1-NZ 2.82Å; D541-K544 PolarHBondContact OD1-NZ 2.92Å; K544-H546 PolarHBondContact O-N 2.99Å; K544-H546 VanDerWaalsContact O-N 3.12Å; K544-G547 PolarHBondContact O-N 2.84Å; K544-I549 HydrophobicContact CB-CG1 4.43Å; K544-I549 HydrophobicContact CG-CD1 3.97Å; K544-I549 HydrophobicContact CG-CG1 3.73Å
545	S	78.8	Confident	83.8	Confident	13 Å²	13	50.2 Å²	50.2	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-47.2	-38.2	175.1	128.8	0	0	0	0	113.5	D541 I542 L543 R975	D541-S545 WeakPolarHBondContact O-CA 3.38Å; D541-S545 WeakPolarHBondContact O-CB 3.45Å; D541-S545 PolarHBondContact O-N 3.35Å; I542-S545 WeakPolarHBondContact O-CB 3.24Å; I542-S545 PolarHBondContact O-N 3.42Å; I542-S545 PolarHBondContact O-OG 3.01Å; L543-S545 VanDerWaalsContact C-N 3.29Å; L543-S545 PolarHBondContact O-N 3.37Å; S545-R975 VanDerWaalsContact CA-NH2 3.27Å; S545-R975 PolarHBondContact O-NE 2.57Å; S545-R975 PolarHBondContact O-NH2 3.46Å; S545-R975 PolarHBondContact OG-NH2 2.93Å
546	H	79.2	Confident	83.6	Confident	11 Å²	11	51.7 Å²	51.7	5%	0.051	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	2.1	-179.1	-69.9	99.8	0	0	0	113.9	I542 L543 K544 A548 F572 R576	I542-H546 PolarHBondContact O-N 3.08Å; I542-H546 VanDerWaalsContact O-N 3.16Å; I542-H546 PolarHBondContact O-ND1 3.17Å; L543-H546 PolarHBondContact O-N 3.44Å; K544-H546 PolarHBondContact O-N 2.99Å; K544-H546 VanDerWaalsContact O-N 3.12Å; H546-A548 VanDerWaalsContact C-N 3.27Å; H546-A548 PolarHBondContact O-N 3Å; H546-F572 HydrophobicContact CB-CD1 4.09Å; H546-F572 HydrophobicContact CB-CE1 3.06Å; H546-F572 HydrophobicContact CB-CE2 4.37Å; H546-F572 HydrophobicContact CB-CZ 3.18Å; H546-F572 AromaticContact CD2-CD1 3.56Å; H546-F572 AromaticContact CD2-CE1 3.25Å; H546-F572 WeakPolarHBondContact CD2-CE1 3.5Å; H546-F572 AromaticContact CE1-CD1 3.87Å; H546-F572 AromaticContact CG-CD1 3.62Å; H546-F572 AromaticContact CG-CE1 3.06Å; H546-F572 AromaticContact CG-CZ 3.68Å; H546-F572 AromaticContact ND1-CD1 3.8Å; H546-F572 AromaticContact ND1-CE1 3.64Å; H546-F572 AromaticContact NE2-CD1 3.75Å; H546-F572 AromaticContact NE2-CE1 3.93Å; H546-R576 PolarHBondContact CD2-NH1 3.05Å
547	G	80.5	Confident	83.4	Confident	30 Å²	30	53.5 Å²	53.5	31%	0.309	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	16.4	-177	0	0	0	0	0	114.4	L543 K544 I549 T559	L543-G547 PolarHBondContact O-N 3.45Å; K544-G547 PolarHBondContact O-N 2.84Å; G547-I549 VanDerWaalsContact C-N 3.35Å; G547-T559 VanDerWaalsContact O-CG2 3.29Å; G547-T559 WeakPolarHBondContact O-CG2 3.32Å; G547-T559 PolarHBondContact O-OG1 2.7Å
548	A	86.1	Confident	83.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	-76.1	-24.7	177	0	0	0	0	0	112.8	L512 L543 H546 T559 G562 L565 F572	L512-A548 HydrophobicContact CD1-CB 4.46Å; L543-A548 HydrophobicContact CB-CB 4.46Å; L543-A548 HydrophobicContact CD2-CB 4.16Å; L543-A548 PolarHBondContact O-N 3.03Å; H546-A548 VanDerWaalsContact C-N 3.27Å; H546-A548 PolarHBondContact O-N 3Å; A548-T559 WeakPolarHBondContact CA-OG1 3.33Å; A548-T559 PolarHBondContact O-N 3.22Å; A548-T559 PolarHBondContact O-OG1 2.77Å; A548-T559 VanDerWaalsContact O-OG1 3.1Å; A548-G562 WeakPolarHBondContact O-CA 3.37Å; A548-L565 HydrophobicContact CB-CD1 4.3Å; A548-F572 HydrophobicContact CB-CE2 3.72Å; A548-F572 HydrophobicContact CB-CZ 3.73Å
549	I	89	Confident	83.3	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.015	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	144.6	176.8	65.7	178.8	0	0	0	110.3	L512 L515 L540 L543 K544 G547 L556 T557 V558	L512-I549 HydrophobicContact CD1-CG2 4.49Å; L515-I549 HydrophobicContact CD1-CD1 4.46Å; L515-I549 HydrophobicContact CD1-CG2 3.76Å; L540-I549 HydrophobicContact CD2-CD1 3.77Å; L543-I549 HydrophobicContact CB-CD1 3.66Å; L543-I549 HydrophobicContact CB-CG1 3.77Å; L543-I549 HydrophobicContact CB-CG2 4.34Å; L543-I549 HydrophobicContact CD1-CD1 4.35Å; K544-I549 HydrophobicContact CB-CG1 4.43Å; K544-I549 HydrophobicContact CG-CD1 3.97Å; K544-I549 HydrophobicContact CG-CG1 3.73Å; G547-I549 VanDerWaalsContact C-N 3.35Å; I549-L556 HydrophobicContact CD1-CD2 4.43Å; I549-T557 VanDerWaalsContact CA-O 3.32Å; I549-T557 WeakPolarHBondContact CA-O 3.47Å; I549-V558 HydrophobicContact CG2-CG2 4.41Å
550	I	86.1	Confident	83	Confident	76 Å²	76	55.1 Å²	55.1	39%	0.39	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133.9	177.1	-64.4	169.7	0	0	0	108.9	Q552 T557 T559	I550-Q552 HydrophobicContact CG2-CG 4.08Å; I550-Q552 PolarHBondContact O-N 3.17Å; I550-T557 PolarHBondContact N-O 3.22Å; I550-T557 PolarHBondContact O-N 3.45Å; I550-T557 PolarHBondContact O-OG1 2.91Å; I550-T559 HydrophobicContact CB-CG2 4.21Å; I550-T559 HydrophobicContact CD1-CG2 3.39Å; I550-T559 HydrophobicContact CG1-CG2 3.43Å; I550-T559 VanDerWaalsContact CG1-CG2 3.43Å
551	P	81.5	Confident	82.8	Confident	88 Å²	88	54.9 Å²	54.9	57%	0.571	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	113	168.4	29.4	-31.5	0	0	0	109.6	L556	P551-L556 HydrophobicContact CB-CD2 4.48Å
552	Q	75.1	Confident	82.8	Confident	107 Å²	107	51.1 Å²	51.1	50%	0.5	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.9	172.5	-68.7	-174.7	-5.4	0	0	108.8	I550 N554 V555 T557	I550-Q552 HydrophobicContact CG2-CG 4.08Å; I550-Q552 PolarHBondContact O-N 3.17Å; Q552-N554 VanDerWaalsContact C-N 3.3Å; Q552-N554 PolarHBondContact O-N 2.96Å; Q552-V555 PolarHBondContact N-O 3.29Å; Q552-V555 WeakPolarHBondContact O-CA 3.38Å; Q552-V555 PolarHBondContact O-N 3.47Å; Q552-T557 HydrophobicContact CB-CG2 4.06Å; Q552-T557 HydrophobicContact CG-CG2 4.46Å; Q552-T557 WeakPolarHBondContact CG-OG1 3.43Å
553	N	71.5	Confident	82.8	Confident	164 Å²	164	52.9 Å²	52.9	88%	0.877	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	43.7	178.3	-58.4	-21.7	0	0	0	113.9	V555	N553-V555 PolarHBondContact O-N 2.7Å; N553-V555 VanDerWaalsContact O-N 3.15Å
554	N	72.1	Confident	82.5	Confident	173 Å²	173	53.2 Å²	53.2	93%	0.925	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	6.9	-173.1	-71.2	-10.7	0	0	0	116.3	Q552	Q552-N554 VanDerWaalsContact C-N 3.3Å; Q552-N554 PolarHBondContact O-N 2.96Å
555	V	78.6	Confident	82.4	Confident	82 Å²	82	49.5 Å²	49.5	50%	0.497	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.7	172.6	-176.7	0	0	0	0	109.3	Q552 N553 T557	Q552-V555 PolarHBondContact N-O 3.29Å; Q552-V555 WeakPolarHBondContact O-CA 3.38Å; Q552-V555 PolarHBondContact O-N 3.47Å; N553-V555 PolarHBondContact O-N 2.7Å; N553-V555 VanDerWaalsContact O-N 3.15Å; V555-T557 PolarHBondContact O-N 3.05Å
556	L	84	Confident	82.6	Confident	53 Å²	53	49.2 Å²	49.2	28%	0.277	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	114.7	173.4	-66.5	172.4	0	0	0	108.9	L540 I549 P551	L540-L556 HydrophobicContact CD1-CD1 4.25Å; L540-L556 HydrophobicContact CD2-CD1 3.82Å; I549-L556 HydrophobicContact CD1-CD2 4.43Å; P551-L556 HydrophobicContact CB-CD2 4.48Å
557	T	85.6	Confident	82.4	Confident	40 Å²	40	50.6 Å²	50.6	25%	0.245	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.3	177.3	57.8	0	0	0	0	109.7	I549 I550 Q552 V555	I549-T557 VanDerWaalsContact CA-O 3.32Å; I549-T557 WeakPolarHBondContact CA-O 3.47Å; I550-T557 PolarHBondContact N-O 3.22Å; I550-T557 PolarHBondContact O-N 3.45Å; I550-T557 PolarHBondContact O-OG1 2.91Å; Q552-T557 HydrophobicContact CB-CG2 4.06Å; Q552-T557 HydrophobicContact CG-CG2 4.46Å; Q552-T557 WeakPolarHBondContact CG-OG1 3.43Å; V555-T557 PolarHBondContact O-N 3.05Å
558	V	87.8	Confident	82.3	Confident	39 Å²	39	49.4 Å²	49.4	24%	0.236	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	127.7	175.1	-176.9	0	0	0	0	108.1	L512 L515 V516 I549 Q563	L512-V558 HydrophobicContact CD1-CG1 4.12Å; L515-V558 HydrophobicContact CB-CG2 3.56Å; L515-V558 HydrophobicContact CD1-CG2 4.37Å; V516-V558 HydrophobicContact CG2-CG1 3.95Å; V516-V558 HydrophobicContact CG2-CG2 4.24Å; I549-V558 HydrophobicContact CG2-CG2 4.41Å; V558-Q563 HydrophobicContact CG1-CB 4.4Å
559	T	87.8	Confident	81.5	Confident	16 Å²	16	51.5 Å²	51.5	10%	0.098	29%	0.287	C	S	.	.			trans	-74.6	162	178.2	65.6	0	0	0	0	110.6	G547 A548 I550 L561 G562 Q563	G547-T559 VanDerWaalsContact O-CG2 3.29Å; G547-T559 WeakPolarHBondContact O-CG2 3.32Å; G547-T559 PolarHBondContact O-OG1 2.7Å; A548-T559 WeakPolarHBondContact CA-OG1 3.33Å; A548-T559 PolarHBondContact O-N 3.22Å; A548-T559 PolarHBondContact O-OG1 2.77Å; A548-T559 VanDerWaalsContact O-OG1 3.1Å; I550-T559 HydrophobicContact CB-CG2 4.21Å; I550-T559 HydrophobicContact CD1-CG2 3.39Å; I550-T559 HydrophobicContact CG1-CG2 3.43Å; I550-T559 VanDerWaalsContact CG1-CG2 3.43Å; T559-L561 PolarHBondContact O-N 3.45Å; T559-L561 PolarHBondContact OG1-N 3.24Å; T559-G562 CarbonylContact O-C 3.53Å; T559-G562 WeakPolarHBondContact O-CA 3.04Å; T559-G562 PolarHBondContact O-N 2.86Å; T559-G562 PolarHBondContact OG1-N 2.99Å; T559-Q563 PolarHBondContact O-N 3.33Å
560	P	83.4	Confident	81	Confident	63 Å²	63	52.2 Å²	52.2	41%	0.409	29%	0.291	S	S	.	.	H	α-helix	trans	-53.5	-34.8	169.6	-28.7	37.1	0	0	0	112.9	L564 L1024 L1028	P560-L564 VanDerWaalsContact O-CB 3.32Å; P560-L564 WeakPolarHBondContact O-CB 2.97Å; P560-L564 PolarHBondContact O-N 3.02Å; P560-L1024 HydrophobicContact CB-CB 4.11Å; P560-L1024 HydrophobicContact CB-CD1 4.2Å; P560-L1028 HydrophobicContact CB-CD1 4.06Å; P560-L1028 HydrophobicContact CG-CD1 4.31Å
561	L	85	Confident	80.6	Confident	13 Å²	13	51.9 Å²	51.9	7%	0.068	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-48.1	172.2	177.5	65.3	0	0	0	111.5	T559 Q563 L564 L565 I579 M1020 L1024	T559-L561 PolarHBondContact O-N 3.45Å; T559-L561 PolarHBondContact OG1-N 3.24Å; L561-Q563 VanDerWaalsContact C-N 3.35Å; L561-Q563 PolarHBondContact O-N 3.34Å; L561-L564 PolarHBondContact O-N 2.91Å; L561-L565 HydrophobicContact CD1-CD1 4.21Å; L561-L565 HydrophobicContact CD1-CG 4.4Å; L561-L565 HydrophobicContact CG-CD1 3.95Å; L561-L565 WeakPolarHBondContact O-CB 3.19Å; L561-L565 VanDerWaalsContact O-CG 3.26Å; L561-L565 WeakPolarHBondContact O-CG 3.14Å; L561-L565 PolarHBondContact O-N 3.24Å; L561-I579 HydrophobicContact CD1-CD1 3.67Å; L561-I579 HydrophobicContact CD1-CG2 3.91Å; L561-M1020 HydrophobicContact CD2-SD 4.33Å; L561-L1024 HydrophobicContact CB-CD1 4.09Å
562	G	88	Confident	80.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-39.9	176.8	0	0	0	0	0	113.2	A548 T559 L565 S566	A548-G562 WeakPolarHBondContact O-CA 3.37Å; T559-G562 CarbonylContact O-C 3.53Å; T559-G562 WeakPolarHBondContact O-CA 3.04Å; T559-G562 PolarHBondContact O-N 2.86Å; T559-G562 PolarHBondContact OG1-N 2.99Å; G562-L565 PolarHBondContact O-N 3.19Å; G562-S566 PolarHBondContact O-N 3.44Å
563	Q	84.1	Confident	81.2	Confident	50 Å²	50	43.9 Å²	43.9	23%	0.234	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-47.7	174.6	-177.1	61	47.2	0	0	110.3	V558 T559 L561 L565 S566 D567	V558-Q563 HydrophobicContact CG1-CB 4.4Å; T559-Q563 PolarHBondContact O-N 3.33Å; L561-Q563 VanDerWaalsContact C-N 3.35Å; L561-Q563 PolarHBondContact O-N 3.34Å; Q563-L565 PolarHBondContact O-N 3.08Å; Q563-S566 WeakPolarHBondContact O-CB 3.26Å; Q563-S566 PolarHBondContact O-N 3.44Å; Q563-S566 PolarHBondContact O-OG 2.81Å; Q563-D567 PolarHBondContact O-N 3.4Å
564	L	81.7	Confident	82.1	Confident	8 Å²	8	36.1 Å²	36.1	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-40.4	178.4	-177.8	56.8	0	0	0	112.6	P560 L561 S566 D567 I568 I579 L705 L1024	P560-L564 VanDerWaalsContact O-CB 3.32Å; P560-L564 WeakPolarHBondContact O-CB 2.97Å; P560-L564 PolarHBondContact O-N 3.02Å; L561-L564 PolarHBondContact O-N 2.91Å; L564-S566 VanDerWaalsContact C-N 3.31Å; L564-S566 PolarHBondContact O-N 2.97Å; L564-D567 PolarHBondContact O-N 2.97Å; L564-I568 WeakPolarHBondContact O-CG1 3.49Å; L564-I568 PolarHBondContact O-N 3.07Å; L564-I579 HydrophobicContact CB-CD1 4.35Å; L564-I579 HydrophobicContact CD2-CD1 3.81Å; L564-I579 HydrophobicContact CD2-CG1 3.92Å; L564-I579 HydrophobicContact CD2-CG2 4.36Å; L564-I579 HydrophobicContact CG-CD1 3.81Å; L564-I579 HydrophobicContact CG-CG1 4.23Å; L564-L705 HydrophobicContact CD2-CD1 3.66Å; L564-L705 HydrophobicContact CD2-CD2 4.17Å; L564-L705 HydrophobicContact CD2-CG 4.03Å; L564-L1024 HydrophobicContact CD2-CD2 3.62Å
565	L	85.5	Confident	82.9	Confident	11 Å²	11	28 Å²	28	6%	0.058	16%	0.159	C	C	.	.	H	α-helix	trans	-64	-36.4	174.9	-74	167.5	0	0	0	112.1	L512 A548 L561 G562 Q563 D567 I568 F572 R576 I579	L512-L565 HydrophobicContact CD2-CB 4.06Å; A548-L565 HydrophobicContact CB-CD1 4.3Å; L561-L565 HydrophobicContact CD1-CD1 4.21Å; L561-L565 HydrophobicContact CD1-CG 4.4Å; L561-L565 HydrophobicContact CG-CD1 3.95Å; L561-L565 WeakPolarHBondContact O-CB 3.19Å; L561-L565 VanDerWaalsContact O-CG 3.26Å; L561-L565 WeakPolarHBondContact O-CG 3.14Å; L561-L565 PolarHBondContact O-N 3.24Å; G562-L565 PolarHBondContact O-N 3.19Å; Q563-L565 PolarHBondContact O-N 3.08Å; L565-D567 VanDerWaalsContact C-N 3.25Å; L565-D567 PolarHBondContact O-N 3.09Å; L565-I568 PolarHBondContact O-N 2.95Å; L565-I568 VanDerWaalsContact O-O 3.07Å; L565-F572 HydrophobicContact CD1-CD2 4.42Å; L565-F572 HydrophobicContact CD1-CE1 3.89Å; L565-F572 HydrophobicContact CD1-CE2 3.6Å; L565-F572 HydrophobicContact CD1-CZ 3.29Å; L565-R576 HydrophobicContact CD2-CB 4.34Å; L565-I579 HydrophobicContact CD2-CD1 3.53Å; L565-I579 HydrophobicContact CG-CD1 3.7Å
566	S	83.1	Confident	83.4	Confident	7 Å²	7	25.8 Å²	25.8	5%	0.049	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-30.5	176.1	81.6	0	0	0	0	113.1	V516 G562 Q563 L564 I568	V516-S566 WeakPolarHBondContact CG2-OG 3.4Å; G562-S566 PolarHBondContact O-N 3.44Å; Q563-S566 WeakPolarHBondContact O-CB 3.26Å; Q563-S566 PolarHBondContact O-N 3.44Å; Q563-S566 PolarHBondContact O-OG 2.81Å; L564-S566 VanDerWaalsContact C-N 3.31Å; L564-S566 PolarHBondContact O-N 2.97Å; S566-I568 VanDerWaalsContact C-N 3.33Å
567	D	74.7	Confident	83.7	Confident	39 Å²	39	23.3 Å²	23.3	21%	0.209	13%	0.129	C	C	.	.	H	α-helix	trans	-75.7	-22	179.6	-75.1	-32.4	0	0	0	112.7	Q563 L564 L565 P569 R1031	Q563-D567 PolarHBondContact O-N 3.4Å; L564-D567 PolarHBondContact O-N 2.97Å; L565-D567 VanDerWaalsContact C-N 3.25Å; L565-D567 PolarHBondContact O-N 3.09Å; D567-P569 VanDerWaalsContact O-CD 3.31Å; D567-P569 WeakPolarHBondContact O-CD 3.48Å; D567-R1031 IonicContact OD2-NH1 3.28Å
568	I	77.8	Confident	84	Confident	5 Å²	5	21.4 Å²	21.4	3%	0.026	12%	0.117	C	C	.	.	S	Bend	trans	-97	106	179	-52.1	171.3	0	0	0	108.4	L564 L565 S566 V570 L578 I579 L699	L564-I568 WeakPolarHBondContact O-CG1 3.49Å; L564-I568 PolarHBondContact O-N 3.07Å; L565-I568 PolarHBondContact O-N 2.95Å; L565-I568 VanDerWaalsContact O-O 3.07Å; S566-I568 VanDerWaalsContact C-N 3.33Å; I568-V570 HydrophobicContact CB-CG2 4.25Å; I568-V570 HydrophobicContact CG2-CB 4.33Å; I568-V570 HydrophobicContact CG2-CG1 4.02Å; I568-V570 HydrophobicContact CG2-CG2 3.45Å; I568-V570 VanDerWaalsContact CG2-CG2 3.45Å; I568-V570 PolarHBondContact O-N 3.37Å; I568-L578 HydrophobicContact CG2-CD1 4.36Å; I568-I579 HydrophobicContact CD1-CD1 4.35Å; I568-I579 HydrophobicContact CD1-CG1 4.23Å; I568-L699 HydrophobicContact CG2-CD1 4.04Å
569	P	70.1	Confident	84	Confident	45 Å²	45	19.7 Å²	19.7	29%	0.292	11%	0.106	S	C	.	.			trans	-78.6	63.1	-175.7	35.4	-40.5	0	0	0	112.3	R223 D567 L699	R223-P569 PolarHBondContact NH2-O 3.04Å; D567-P569 VanDerWaalsContact O-CD 3.31Å; D567-P569 WeakPolarHBondContact O-CD 3.48Å; P569-L699 HydrophobicContact CG-CD1 4.36Å
570	V	77.2	Confident	84	Confident	18 Å²	18	19.3 Å²	19.3	11%	0.109	10%	0.104	C	C	.	.	S	Bend	trans	-130.5	165.3	178.1	-62.2	0	0	0	0	109.6	I568 I574 G575 F696	I568-V570 HydrophobicContact CB-CG2 4.25Å; I568-V570 HydrophobicContact CG2-CB 4.33Å; I568-V570 HydrophobicContact CG2-CG1 4.02Å; I568-V570 HydrophobicContact CG2-CG2 3.45Å; I568-V570 VanDerWaalsContact CG2-CG2 3.45Å; I568-V570 PolarHBondContact O-N 3.37Å; V570-I574 HydrophobicContact CB-CB 4.34Å; V570-I574 HydrophobicContact CB-CG2 4.28Å; V570-I574 HydrophobicContact CG2-CB 4.29Å; V570-I574 HydrophobicContact CG2-CG2 4.31Å; V570-G575 VanDerWaalsContact CG2-CA 3.41Å; V570-G575 VanDerWaalsContact CG2-N 3.32Å; V570-F696 HydrophobicContact CG1-CD1 4.05Å; V570-F696 HydrophobicContact CG1-CE1 3.18Å; V570-F696 HydrophobicContact CG1-CZ 3.55Å
571	E	78.8	Confident	84.3	Confident	69 Å²	69	16.3 Å²	16.3	32%	0.322	8%	0.084	S	C	.	.			trans	-57.8	145.3	170.1	-67.3	-174.6	156.5	0	0	110.3	R455 S573 I574 G575	R455-E571 IonicContact CZ-OE1 3.3Å; R455-E571 IonicContact NH1-OE1 3.58Å; R455-E571 PolarHBondContact NH1-OE1 3.17Å; R455-E571 IonicContact NH2-OE1 3.72Å; R455-E571 PolarHBondContact NH2-OE1 2.97Å; E571-S573 VanDerWaalsContact C-N 3.31Å; E571-S573 PolarHBondContact O-N 3.34Å; E571-I574 HydrophobicContact CB-CD1 4.48Å; E571-I574 HydrophobicContact CB-CG1 4.49Å; E571-I574 PolarHBondContact O-N 3.07Å; E571-G575 PolarHBondContact O-N 3.34Å
572	F	81.7	Confident	84.4	Confident	15 Å²	15	15.9 Å²	15.9	7%	0.066	8%	0.083	C	C	.	.	H	α-helix	trans	-53.9	-45.9	-169.6	-168.2	-73	0	0	0	112.4	L512 L543 H546 A548 L565 I574 G575 R576	L512-F572 HydrophobicContact CD2-CD2 4.45Å; L512-F572 HydrophobicContact CD2-CE2 4.21Å; L543-F572 HydrophobicContact CD2-CD2 3.87Å; L543-F572 HydrophobicContact CD2-CE2 3.5Å; L543-F572 HydrophobicContact CD2-CZ 4.48Å; H546-F572 HydrophobicContact CB-CD1 4.09Å; H546-F572 HydrophobicContact CB-CE1 3.06Å; H546-F572 HydrophobicContact CB-CE2 4.37Å; H546-F572 HydrophobicContact CB-CZ 3.18Å; H546-F572 AromaticContact CD2-CD1 3.56Å; H546-F572 AromaticContact CD2-CE1 3.25Å; H546-F572 WeakPolarHBondContact CD2-CE1 3.5Å; H546-F572 AromaticContact CE1-CD1 3.87Å; H546-F572 AromaticContact CG-CD1 3.62Å; H546-F572 AromaticContact CG-CE1 3.06Å; H546-F572 AromaticContact CG-CZ 3.68Å; H546-F572 AromaticContact ND1-CD1 3.8Å; H546-F572 AromaticContact ND1-CE1 3.64Å; H546-F572 AromaticContact NE2-CD1 3.75Å; H546-F572 AromaticContact NE2-CE1 3.93Å; A548-F572 HydrophobicContact CB-CE2 3.72Å; A548-F572 HydrophobicContact CB-CZ 3.73Å; L565-F572 HydrophobicContact CD1-CD2 4.42Å; L565-F572 HydrophobicContact CD1-CE1 3.89Å; L565-F572 HydrophobicContact CD1-CE2 3.6Å; L565-F572 HydrophobicContact CD1-CZ 3.29Å; F572-I574 VanDerWaalsContact C-N 3.33Å; F572-I574 PolarHBondContact O-N 3.13Å; F572-G575 PolarHBondContact O-N 2.99Å; F572-R576 PolarHBondContact O-N 3.04Å
573	S	87.2	Confident	84.2	Confident	12 Å²	12	16.1 Å²	16.1	8%	0.084	8%	0.084	C	C	.	.	H	α-helix	trans	-59.9	-40.9	179	-50	0	0	0	0	112.6	E571 M577 G827 Q831	E571-S573 VanDerWaalsContact C-N 3.31Å; E571-S573 PolarHBondContact O-N 3.34Å; S573-M577 WeakPolarHBondContact O-CB 3.37Å; S573-M577 PolarHBondContact O-N 2.75Å; S573-G827 VanDerWaalsContact CA-O 3.28Å; S573-G827 WeakPolarHBondContact CA-O 3.35Å; S573-G827 WeakPolarHBondContact CB-O 3.35Å; S573-Q831 PolarHBondContact OG-OE1 3.17Å
574	I	90.1	Very high	84.3	Confident	1 Å²	1	14.4 Å²	14.4	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-69.8	-41.4	178.2	-59.1	-177.7	0	0	0	110.6	V570 E571 F572 R576 M577 L578 A594 M597 A598 F696 L948	V570-I574 HydrophobicContact CB-CB 4.34Å; V570-I574 HydrophobicContact CB-CG2 4.28Å; V570-I574 HydrophobicContact CG2-CB 4.29Å; V570-I574 HydrophobicContact CG2-CG2 4.31Å; E571-I574 HydrophobicContact CB-CD1 4.48Å; E571-I574 HydrophobicContact CB-CG1 4.49Å; E571-I574 PolarHBondContact O-N 3.07Å; F572-I574 VanDerWaalsContact C-N 3.33Å; F572-I574 PolarHBondContact O-N 3.13Å; I574-R576 VanDerWaalsContact C-N 3.34Å; I574-R576 PolarHBondContact O-N 3.24Å; I574-M577 WeakPolarHBondContact O-CB 3.38Å; I574-M577 PolarHBondContact O-N 3.42Å; I574-L578 HydrophobicContact CG2-CD1 4.39Å; I574-L578 WeakPolarHBondContact O-CG 3.35Å; I574-L578 PolarHBondContact O-N 2.62Å; I574-A594 HydrophobicContact CG2-CB 3.79Å; I574-M597 HydrophobicContact CD1-CB 4.44Å; I574-A598 HydrophobicContact CD1-CB 3.88Å; I574-F696 HydrophobicContact CG2-CE2 4.34Å; I574-F696 HydrophobicContact CG2-CZ 4.47Å; I574-L948 HydrophobicContact CD1-CD2 4.47Å; I574-L948 HydrophobicContact CG1-CD1 4.23Å
575	G	89.4	Confident	84.4	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-60.3	-45.7	176.9	0	0	0	0	0	111.5	V570 E571 F572 L578 I579	V570-G575 VanDerWaalsContact CG2-CA 3.41Å; V570-G575 VanDerWaalsContact CG2-N 3.32Å; E571-G575 PolarHBondContact O-N 3.34Å; F572-G575 PolarHBondContact O-N 2.99Å; G575-L578 PolarHBondContact O-N 3.32Å; G575-I579 WeakPolarHBondContact O-CG1 3.38Å; G575-I579 PolarHBondContact O-N 3.15Å; G575-I579 VanDerWaalsContact O-N 3.14Å
576	R	87.9	Confident	84.5	Confident	37 Å²	37	20 Å²	20	14%	0.14	10%	0.097	C	C	.	.	H	α-helix	trans	-65	-41.8	178	-170.9	178.7	-175.2	-165.8	3	111.9	H546 L565 F572 I574 L578 I579 M580 G826 Y829	H546-R576 PolarHBondContact CD2-NH1 3.05Å; L565-R576 HydrophobicContact CD2-CB 4.34Å; F572-R576 PolarHBondContact O-N 3.04Å; I574-R576 VanDerWaalsContact C-N 3.34Å; I574-R576 PolarHBondContact O-N 3.24Å; R576-L578 VanDerWaalsContact C-N 3.31Å; R576-L578 PolarHBondContact O-N 3.07Å; R576-I579 PolarHBondContact O-N 3.08Å; R576-I579 VanDerWaalsContact O-N 3.16Å; R576-M580 HydrophobicContact CG-CG 4.35Å; R576-M580 WeakPolarHBondContact O-CB 3.34Å; R576-M580 WeakPolarHBondContact O-CG 3.21Å; R576-M580 PolarHBondContact O-N 3.32Å; R576-G826 WeakPolarHBondContact CD-O 3.19Å; R576-G826 PolarHBondContact NE-O 2.78Å; R576-G826 PolarHBondContact NH1-O 2.9Å; R576-Y829 PolarHBondContact NH1-O 2.65Å
577	M	91.4	Very high	84.8	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.7	-44.2	175	-175.2	-170.3	-68.5	0	0	112	S573 I574 I579 M580 A581 V590 A594 M597 V823 L824 M828	S573-M577 WeakPolarHBondContact O-CB 3.37Å; S573-M577 PolarHBondContact O-N 2.75Å; I574-M577 WeakPolarHBondContact O-CB 3.38Å; I574-M577 PolarHBondContact O-N 3.42Å; M577-I579 VanDerWaalsContact C-N 3.34Å; M577-I579 PolarHBondContact O-N 3.43Å; M577-M580 PolarHBondContact O-N 2.8Å; M577-A581 WeakPolarHBondContact O-CB 3.28Å; M577-A581 PolarHBondContact O-N 2.73Å; M577-V590 HydrophobicContact CG-CG1 3.61Å; M577-V590 HydrophobicContact SD-CG1 4.06Å; M577-A594 HydrophobicContact SD-CB 4.41Å; M577-M597 HydrophobicContact CE-CE 3.5Å; M577-M597 VanDerWaalsContact CE-CE 3.5Å; M577-M597 HydrophobicContact CE-SD 4.28Å; M577-M597 HydrophobicContact SD-CE 3.46Å; M577-M597 WeakPolarHBondContact SD-CE 3.35Å; M577-V823 HydrophobicContact CG-CG1 4.49Å; M577-L824 HydrophobicContact CE-CB 4.34Å; M577-L824 HydrophobicContact CE-CD2 3.66Å; M577-L824 HydrophobicContact CG-CD2 3.73Å; M577-L824 HydrophobicContact SD-CD2 3.25Å; M577-L824 WeakPolarHBondContact SD-CD2 3.1Å; M577-M828 HydrophobicContact CE-CG 3.96Å; M577-M828 HydrophobicContact CE-SD 4.14Å
578	L	91.2	Very high	85.5	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-63.6	-38.7	176.4	-70.1	168.9	0	0	0	112.4	I568 I574 G575 R576 S582 V590 L591 A594 F696 L700	I568-L578 HydrophobicContact CG2-CD1 4.36Å; I574-L578 HydrophobicContact CG2-CD1 4.39Å; I574-L578 WeakPolarHBondContact O-CG 3.35Å; I574-L578 PolarHBondContact O-N 2.62Å; G575-L578 PolarHBondContact O-N 3.32Å; R576-L578 VanDerWaalsContact C-N 3.31Å; R576-L578 PolarHBondContact O-N 3.07Å; L578-S582 PolarHBondContact O-N 3.08Å; L578-V590 HydrophobicContact CD2-CG1 4.34Å; L578-L591 HydrophobicContact CD2-CD2 3.8Å; L578-L591 HydrophobicContact CD2-CG 4.47Å; L578-A594 HydrophobicContact CD2-CB 3.93Å; L578-A594 HydrophobicContact CG-CB 4.27Å; L578-F696 HydrophobicContact CD1-CB 4.01Å; L578-F696 HydrophobicContact CD1-CD1 4.25Å; L578-F696 HydrophobicContact CD1-CD2 4.02Å; L578-F696 HydrophobicContact CD1-CG 3.84Å; L578-F696 HydrophobicContact CD2-CB 4.14Å; L578-F696 HydrophobicContact CD2-CD2 4.27Å; L578-F696 HydrophobicContact CD2-CG 4.47Å; L578-L700 HydrophobicContact CB-CD1 4.42Å; L578-L700 HydrophobicContact CB-CD2 4.24Å; L578-L700 HydrophobicContact CD2-CD1 4.36Å
579	I	87.9	Confident	86.2	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-68.6	-47.6	176.8	-63.6	167.3	0	0	0	110.2	L561 L564 L565 I568 G575 R576 M577 A581 S582 L583 L705	L561-I579 HydrophobicContact CD1-CD1 3.67Å; L561-I579 HydrophobicContact CD1-CG2 3.91Å; L564-I579 HydrophobicContact CB-CD1 4.35Å; L564-I579 HydrophobicContact CD2-CD1 3.81Å; L564-I579 HydrophobicContact CD2-CG1 3.92Å; L564-I579 HydrophobicContact CD2-CG2 4.36Å; L564-I579 HydrophobicContact CG-CD1 3.81Å; L564-I579 HydrophobicContact CG-CG1 4.23Å; L565-I579 HydrophobicContact CD2-CD1 3.53Å; L565-I579 HydrophobicContact CG-CD1 3.7Å; I568-I579 HydrophobicContact CD1-CD1 4.35Å; I568-I579 HydrophobicContact CD1-CG1 4.23Å; G575-I579 WeakPolarHBondContact O-CG1 3.38Å; G575-I579 PolarHBondContact O-N 3.15Å; G575-I579 VanDerWaalsContact O-N 3.14Å; R576-I579 PolarHBondContact O-N 3.08Å; R576-I579 VanDerWaalsContact O-N 3.16Å; M577-I579 VanDerWaalsContact C-N 3.34Å; M577-I579 PolarHBondContact O-N 3.43Å; I579-A581 PolarHBondContact O-N 3.32Å; I579-S582 WeakPolarHBondContact O-CB 3.48Å; I579-S582 PolarHBondContact O-N 3.22Å; I579-S582 PolarHBondContact O-OG 3.09Å; I579-L583 PolarHBondContact O-N 2.79Å; I579-L705 HydrophobicContact CB-CD1 4.44Å; I579-L705 HydrophobicContact CG1-CD1 4.02Å; I579-L705 HydrophobicContact CG2-CD1 4.43Å
580	M	87.4	Confident	87.3	Confident	9 Å²	9	20.5 Å²	20.5	4%	0.044	10%	0.098	C	C	.	.	H	α-helix	trans	-58.9	-37.4	176.4	-70.7	-64.3	-67.8	0	0	112	R576 M577 S582 L583 L584 V823 Y973 M1020	R576-M580 HydrophobicContact CG-CG 4.35Å; R576-M580 WeakPolarHBondContact O-CB 3.34Å; R576-M580 WeakPolarHBondContact O-CG 3.21Å; R576-M580 PolarHBondContact O-N 3.32Å; M577-M580 PolarHBondContact O-N 2.8Å; M580-S582 PolarHBondContact O-N 3.3Å; M580-L583 WeakPolarHBondContact O-CB 3.5Å; M580-L583 PolarHBondContact O-N 3.37Å; M580-L583 VanDerWaalsContact O-N 3.12Å; M580-L583 HydrophobicContact SD-CD1 3.94Å; M580-L584 PolarHBondContact O-N 3.15Å; M580-V823 HydrophobicContact CB-CG1 3.89Å; M580-Y973 HydrophobicContact CE-CE1 4.32Å; M580-M1020 HydrophobicContact SD-CE 3.67Å
581	A	90.6	Very high	88	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.1	-28.9	175.9	0	0	0	0	0	113.6	M577 I579 L583 R585 L586 T587 V590 V823	M577-A581 WeakPolarHBondContact O-CB 3.28Å; M577-A581 PolarHBondContact O-N 2.73Å; I579-A581 PolarHBondContact O-N 3.32Å; A581-L583 VanDerWaalsContact C-N 3.35Å; A581-R585 PolarHBondContact O-N 2.92Å; A581-L586 PolarHBondContact O-N 2.85Å; A581-T587 PolarHBondContact O-N 2.85Å; A581-T587 PolarHBondContact O-OG1 3.46Å; A581-V590 HydrophobicContact CB-CB 3.55Å; A581-V590 HydrophobicContact CB-CG1 3.68Å; A581-V590 HydrophobicContact CB-CG2 3.61Å; A581-V823 HydrophobicContact CB-CG1 3.94Å
582	S	86.7	Confident	88.7	Confident	4 Å²	4	16.5 Å²	16.5	3%	0.028	8%	0.078	C	C	.	.	H	α-helix	trans	-69.7	-34.9	174.4	75.5	0	0	0	0	111.7	L578 I579 M580 L584 R585	L578-S582 PolarHBondContact O-N 3.08Å; I579-S582 WeakPolarHBondContact O-CB 3.48Å; I579-S582 PolarHBondContact O-N 3.22Å; I579-S582 PolarHBondContact O-OG 3.09Å; M580-S582 PolarHBondContact O-N 3.3Å; S582-L584 PolarHBondContact O-N 3.06Å; S582-R585 PolarHBondContact O-N 3.25Å
583	L	84.5	Confident	89.2	Confident	4 Å²	4	16 Å²	16	2%	0.021	8%	0.076	C	C	.	.	H	α-helix	trans	-65.9	-38.5	178.9	-56	-179.2	0	0	0	112	I579 M580 A581 L1019 M1020 E1023 Q1072	I579-L583 PolarHBondContact O-N 2.79Å; M580-L583 WeakPolarHBondContact O-CB 3.5Å; M580-L583 PolarHBondContact O-N 3.37Å; M580-L583 VanDerWaalsContact O-N 3.12Å; M580-L583 HydrophobicContact SD-CD1 3.94Å; A581-L583 VanDerWaalsContact C-N 3.35Å; L583-L1019 HydrophobicContact CB-CD2 4.19Å; L583-L1019 HydrophobicContact CD2-CG 4.38Å; L583-M1020 HydrophobicContact CD1-CB 4.06Å; L583-M1020 HydrophobicContact CD1-CE 3.66Å; L583-M1020 HydrophobicContact CD1-CG 4.3Å; L583-M1020 HydrophobicContact CD2-CB 4.46Å; L583-E1023 HydrophobicContact CD2-CB 3.92Å; L583-E1023 HydrophobicContact CD2-CG 3.94Å; L583-Q1072 WeakPolarHBondContact O-CG 3.36Å
584	L	85.6	Confident	89.5	Confident	14 Å²	14	15.4 Å²	15.4	7%	0.073	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	10.6	-177	-58.4	-178.7	0	0	0	113.8	M580 S582 L586 L819 V823 L1075 L1079	M580-L584 PolarHBondContact O-N 3.15Å; S582-L584 PolarHBondContact O-N 3.06Å; L584-L586 HydrophobicContact CB-CG 4.44Å; L584-L586 PolarHBondContact O-N 3.01Å; L584-L819 HydrophobicContact CD1-CD1 3.67Å; L584-L819 HydrophobicContact CD1-CG 4.03Å; L584-V823 HydrophobicContact CB-CG2 4.25Å; L584-V823 HydrophobicContact CD1-CG2 3.42Å; L584-V823 VanDerWaalsContact CD1-CG2 3.42Å; L584-V823 HydrophobicContact CG-CG2 4.22Å; L584-L1075 HydrophobicContact CD2-CD2 3.73Å; L584-L1075 HydrophobicContact CD2-CG 3.99Å; L584-L1079 HydrophobicContact CD1-CD1 4.03Å; L584-L1079 HydrophobicContact CD2-CD1 3.96Å
585	R	83.4	Confident	89.6	Confident	119 Å²	119	15.4 Å²	15.4	45%	0.449	7%	0.072	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	17.9	-175.9	-60.1	-61.4	-153.1	164.9	11.2	115.1	A581 S582 T587	A581-R585 PolarHBondContact O-N 2.92Å; S582-R585 PolarHBondContact O-N 3.25Å; R585-T587 PolarHBondContact O-N 2.83Å
586	L	88.3	Confident	89.7	Confident	18 Å²	18	15.5 Å²	15.5	9%	0.094	7%	0.073	C	C	.	.			trans	-90.7	31.7	175.1	-67.1	179.6	0	0	0	112.3	A581 L584 N588 P589 V590 L819 L820 V823	A581-L586 PolarHBondContact O-N 2.85Å; L584-L586 HydrophobicContact CB-CG 4.44Å; L584-L586 PolarHBondContact O-N 3.01Å; L586-N588 PolarHBondContact O-N 2.8Å; L586-P589 HydrophobicContact CB-CG 4.17Å; L586-P589 HydrophobicContact CD2-CG 4.44Å; L586-P589 VanDerWaalsContact O-CD 3.3Å; L586-P589 WeakPolarHBondContact O-CD 3.02Å; L586-P589 VanDerWaalsContact O-CG 3.27Å; L586-P589 WeakPolarHBondContact O-CG 3.22Å; L586-V590 WeakPolarHBondContact O-CB 3.23Å; L586-V590 VanDerWaalsContact O-CG2 3.23Å; L586-V590 WeakPolarHBondContact O-CG2 3.37Å; L586-V590 PolarHBondContact O-N 2.71Å; L586-L819 HydrophobicContact CD1-CB 3.97Å; L586-L819 HydrophobicContact CD1-CD2 3.8Å; L586-L819 HydrophobicContact CD1-CG 3.63Å; L586-L819 HydrophobicContact CG-CD2 4.34Å; L586-L820 HydrophobicContact CD1-CB 4.28Å; L586-L820 HydrophobicContact CD1-CD1 4.46Å; L586-V823 HydrophobicContact CD1-CG2 4.11Å
587	T	88.6	Confident	89.8	Confident	10 Å²	10	14.2 Å²	14.2	6%	0.061	7%	0.069	C	C	.	.	H	α-helix	trans	-66.7	-41.6	-172.1	-42.3	0	0	0	0	112.2	A581 R585 V590 L591 L700 L706	A581-T587 PolarHBondContact O-N 2.85Å; A581-T587 PolarHBondContact O-OG1 3.46Å; R585-T587 PolarHBondContact O-N 2.83Å; T587-V590 PolarHBondContact O-N 2.87Å; T587-L591 HydrophobicContact CG2-CD1 3.96Å; T587-L591 HydrophobicContact CG2-CG 4.07Å; T587-L591 WeakPolarHBondContact O-CB 3.34Å; T587-L591 WeakPolarHBondContact O-CG 3.35Å; T587-L591 PolarHBondContact O-N 3.15Å; T587-L700 HydrophobicContact CG2-CD1 3.45Å; T587-L700 VanDerWaalsContact CG2-CD1 3.45Å; T587-L706 HydrophobicContact CG2-CD1 4.08Å; T587-L706 HydrophobicContact CG2-CD2 4.08Å; T587-L706 HydrophobicContact CG2-CG 4.33Å
588	N	89.6	Confident	89.7	Confident	88 Å²	88	16 Å²	16	47%	0.471	8%	0.084	S	C	.	.	H	α-helix	trans	-60	-51.7	-178.7	-75.2	-26.4	0	0	0	114.9	L586 L591 S592 Q809	L586-N588 PolarHBondContact O-N 2.8Å; N588-L591 PolarHBondContact O-N 3.15Å; N588-S592 PolarHBondContact O-N 3.28Å; N588-Q809 PolarHBondContact O-NE2 3.34Å
589	P	92.2	Very high	89.3	Confident	9 Å²	9	17.1 Å²	17.1	6%	0.058	9%	0.089	C	C	.	.	H	α-helix	trans	-63.7	-42.1	175.5	24.4	-35	0	0	0	112.2	L586 L591 S592 L593 Q809 M812 L820	L586-P589 HydrophobicContact CB-CG 4.17Å; L586-P589 HydrophobicContact CD2-CG 4.44Å; L586-P589 VanDerWaalsContact O-CD 3.3Å; L586-P589 WeakPolarHBondContact O-CD 3.02Å; L586-P589 VanDerWaalsContact O-CG 3.27Å; L586-P589 WeakPolarHBondContact O-CG 3.22Å; P589-L591 VanDerWaalsContact C-N 3.3Å; P589-L591 PolarHBondContact O-N 3.3Å; P589-S592 WeakPolarHBondContact O-CB 3.39Å; P589-S592 PolarHBondContact O-N 3.31Å; P589-S592 VanDerWaalsContact O-N 3.12Å; P589-L593 PolarHBondContact O-N 3.38Å; P589-Q809 HydrophobicContact CB-CG 4.03Å; P589-M812 HydrophobicContact CB-CE 3.79Å; P589-M812 HydrophobicContact CB-SD 4.44Å; P589-M812 HydrophobicContact CG-CE 3.61Å; P589-L820 HydrophobicContact CB-CD1 4.11Å; P589-L820 HydrophobicContact CB-CD2 4.02Å; P589-L820 HydrophobicContact CG-CD1 4.07Å
590	V	93.3	Very high	89	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.4	-33.6	-178.9	176	0	0	0	0	111.8	M577 L578 A581 L586 T587 S592 L593 A594 L820 V823	M577-V590 HydrophobicContact CG-CG1 3.61Å; M577-V590 HydrophobicContact SD-CG1 4.06Å; L578-V590 HydrophobicContact CD2-CG1 4.34Å; A581-V590 HydrophobicContact CB-CB 3.55Å; A581-V590 HydrophobicContact CB-CG1 3.68Å; A581-V590 HydrophobicContact CB-CG2 3.61Å; L586-V590 WeakPolarHBondContact O-CB 3.23Å; L586-V590 VanDerWaalsContact O-CG2 3.23Å; L586-V590 WeakPolarHBondContact O-CG2 3.37Å; L586-V590 PolarHBondContact O-N 2.71Å; T587-V590 PolarHBondContact O-N 2.87Å; V590-S592 VanDerWaalsContact C-N 3.29Å; V590-S592 PolarHBondContact O-N 2.89Å; V590-L593 PolarHBondContact O-N 2.85Å; V590-A594 WeakPolarHBondContact O-CB 3.46Å; V590-A594 PolarHBondContact O-N 2.88Å; V590-L820 HydrophobicContact CG2-CD1 3.37Å; V590-V823 HydrophobicContact CG2-CG1 3.89Å
591	L	92.7	Very high	88.9	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-59.8	-39.6	173.5	-76.8	168.6	0	0	0	112	L578 T587 N588 P589 A595 R693 F696 A697 L700	L578-L591 HydrophobicContact CD2-CD2 3.8Å; L578-L591 HydrophobicContact CD2-CG 4.47Å; T587-L591 HydrophobicContact CG2-CD1 3.96Å; T587-L591 HydrophobicContact CG2-CG 4.07Å; T587-L591 WeakPolarHBondContact O-CB 3.34Å; T587-L591 WeakPolarHBondContact O-CG 3.35Å; T587-L591 PolarHBondContact O-N 3.15Å; N588-L591 PolarHBondContact O-N 3.15Å; P589-L591 VanDerWaalsContact C-N 3.3Å; P589-L591 PolarHBondContact O-N 3.3Å; L591-A595 WeakPolarHBondContact O-CB 3.37Å; L591-A595 PolarHBondContact O-N 2.93Å; L591-A595 VanDerWaalsContact O-N 3.14Å; L591-R693 HydrophobicContact CB-CG 3.77Å; L591-F696 HydrophobicContact CD2-CB 3.34Å; L591-A697 HydrophobicContact CD1-CB 3.82Å; L591-A697 HydrophobicContact CD2-CB 4.2Å; L591-A697 VanDerWaalsContact CD2-N 3.33Å; L591-L700 HydrophobicContact CD2-CD1 4.16Å
592	S	93	Very high	88.6	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.007	13%	0.126	C	C	.	.	H	α-helix	trans	-67.4	-51.1	174.7	-62.8	0	0	0	0	110.6	N588 P589 V590 A594 A595 G596 M689 R693 Q809	N588-S592 PolarHBondContact O-N 3.28Å; P589-S592 WeakPolarHBondContact O-CB 3.39Å; P589-S592 PolarHBondContact O-N 3.31Å; P589-S592 VanDerWaalsContact O-N 3.12Å; V590-S592 VanDerWaalsContact C-N 3.29Å; V590-S592 PolarHBondContact O-N 2.89Å; S592-A594 PolarHBondContact O-N 3.23Å; S592-A595 PolarHBondContact O-N 3.44Å; S592-G596 PolarHBondContact O-N 2.72Å; S592-M689 WeakPolarHBondContact O-CE 3.48Å; S592-R693 PolarHBondContact OG-NE 3.15Å; S592-Q809 PolarHBondContact OG-OE1 2.72Å
593	L	93.1	Very high	88.6	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-51.4	179.5	-74.3	163.5	0	0	0	112.3	P589 V590 A595 G596 M597 A631 F632 V635 L820 L824	P589-L593 PolarHBondContact O-N 3.38Å; V590-L593 PolarHBondContact O-N 2.85Å; L593-A595 VanDerWaalsContact C-N 3.3Å; L593-A595 PolarHBondContact O-N 3.16Å; L593-G596 PolarHBondContact O-N 2.92Å; L593-M597 HydrophobicContact CB-CE 4.05Å; L593-M597 WeakPolarHBondContact O-CE 3.14Å; L593-M597 PolarHBondContact O-N 3.09Å; L593-A631 HydrophobicContact CD2-CB 3.96Å; L593-A631 WeakPolarHBondContact CD2-O 3.2Å; L593-F632 HydrophobicContact CD1-CE1 4.45Å; L593-F632 HydrophobicContact CD2-CD1 4.46Å; L593-F632 HydrophobicContact CD2-CG 4.46Å; L593-V635 HydrophobicContact CB-CG2 4.41Å; L593-V635 HydrophobicContact CD2-CB 4.32Å; L593-V635 HydrophobicContact CD2-CG2 3.54Å; L593-V635 HydrophobicContact CG-CG2 3.8Å; L593-L820 HydrophobicContact CD1-CD1 3.95Å; L593-L820 HydrophobicContact CD1-CD2 3.85Å; L593-L820 HydrophobicContact CD1-CG 4Å; L593-L824 HydrophobicContact CB-CD2 4.43Å; L593-L824 HydrophobicContact CD1-CD1 3.84Å; L593-L824 HydrophobicContact CD1-CD2 3.98Å; L593-L824 HydrophobicContact CD1-CG 4.42Å
594	A	92.9	Very high	88.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.7	-41.2	177.7	0	0	0	0	0	111.8	I574 M577 L578 V590 S592 M597 A598 F696	I574-A594 HydrophobicContact CG2-CB 3.79Å; M577-A594 HydrophobicContact SD-CB 4.41Å; L578-A594 HydrophobicContact CD2-CB 3.93Å; L578-A594 HydrophobicContact CG-CB 4.27Å; V590-A594 WeakPolarHBondContact O-CB 3.46Å; V590-A594 PolarHBondContact O-N 2.88Å; S592-A594 PolarHBondContact O-N 3.23Å; A594-M597 PolarHBondContact O-N 2.83Å; A594-A598 WeakPolarHBondContact O-CB 3.1Å; A594-A598 PolarHBondContact O-N 3.31Å; A594-F696 HydrophobicContact CB-CD2 4.02Å; A594-F696 HydrophobicContact CB-CE2 3.94Å
595	A	91.7	Very high	87.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.2	-38.8	177.7	0	0	0	0	0	112.1	L591 S592 L593 M689 L692 R693 F696	L591-A595 WeakPolarHBondContact O-CB 3.37Å; L591-A595 PolarHBondContact O-N 2.93Å; L591-A595 VanDerWaalsContact O-N 3.14Å; S592-A595 PolarHBondContact O-N 3.44Å; L593-A595 VanDerWaalsContact C-N 3.3Å; L593-A595 PolarHBondContact O-N 3.16Å; A595-M689 HydrophobicContact CB-CG 3.77Å; A595-L692 HydrophobicContact CB-CB 3.87Å; A595-R693 HydrophobicContact CB-CB 4.06Å; A595-F696 HydrophobicContact CB-CD2 4.49Å; A595-F696 HydrophobicContact CB-CE2 4.35Å
596	G	91.1	Very high	86.8	Confident	4 Å²	4	26.9 Å²	26.9	4%	0.041	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-41.7	175.5	0	0	0	0	0	112.9	S592 L593 I599	S592-G596 PolarHBondContact O-N 2.72Å; L593-G596 PolarHBondContact O-N 2.92Å; G596-I599 VanDerWaalsContact O-CG1 3.32Å; G596-I599 WeakPolarHBondContact O-CG1 3.1Å
597	M	91.3	Very high	85.6	Confident	9 Å²	9	30.3 Å²	30.3	4%	0.044	17%	0.172	C	C	.	.	H	α-helix	trans	-71.2	-28.2	177.3	-75	-177	-73.8	0	0	113.7	I574 M577 L593 A594 I599 A631 L824 L948	I574-M597 HydrophobicContact CD1-CB 4.44Å; M577-M597 HydrophobicContact CE-CE 3.5Å; M577-M597 VanDerWaalsContact CE-CE 3.5Å; M577-M597 HydrophobicContact CE-SD 4.28Å; M577-M597 HydrophobicContact SD-CE 3.46Å; M577-M597 WeakPolarHBondContact SD-CE 3.35Å; L593-M597 HydrophobicContact CB-CE 4.05Å; L593-M597 WeakPolarHBondContact O-CE 3.14Å; L593-M597 PolarHBondContact O-N 3.09Å; A594-M597 PolarHBondContact O-N 2.83Å; M597-I599 VanDerWaalsContact C-N 3.34Å; M597-A631 HydrophobicContact CG-CB 4.17Å; M597-A631 HydrophobicContact SD-CB 4.15Å; M597-L824 HydrophobicContact CE-CD2 4.42Å; M597-L948 HydrophobicContact CB-CD2 4.05Å
598	A	88.4	Confident	84.3	Confident	39 Å²	39	33 Å²	33	32%	0.322	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-9.2	-178.8	0	0	0	0	0	114.6	I574 A594 L692 F696	I574-A598 HydrophobicContact CD1-CB 3.88Å; A594-A598 WeakPolarHBondContact O-CB 3.1Å; A594-A598 PolarHBondContact O-N 3.31Å; A598-L692 HydrophobicContact CB-CD1 4.24Å; A598-F696 HydrophobicContact CB-CE2 4.3Å; A598-F696 HydrophobicContact CB-CZ 3.97Å
599	I	83.6	Confident	83.2	Confident	23 Å²	23	31.2 Å²	31.2	12%	0.118	18%	0.183	C	C	.	.	S	Bend	trans	-108.6	159.9	177.7	59.7	178.7	0	0	0	111.3	G596 M597 C601 P602 R685 E688 M689 L692	G596-I599 VanDerWaalsContact O-CG1 3.32Å; G596-I599 WeakPolarHBondContact O-CG1 3.1Å; M597-I599 VanDerWaalsContact C-N 3.34Å; I599-C601 PolarHBondContact O-N 3.27Å; I599-P602 HydrophobicContact CD1-CG 3.57Å; I599-P602 HydrophobicContact CG1-CG 4.4Å; I599-R685 HydrophobicContact CD1-CB 4.36Å; I599-R685 WeakPolarHBondContact CD1-O 3.38Å; I599-E688 HydrophobicContact CG2-CB 4.47Å; I599-M689 HydrophobicContact CD1-CB 3.86Å; I599-M689 HydrophobicContact CD1-CG 4.3Å; I599-L692 HydrophobicContact CG2-CD1 3.12Å
600	Q	80.2	Confident	81.8	Confident	92 Å²	92	35.6 Å²	35.6	43%	0.43	21%	0.214	S	C	.	.	S	Bend	trans	-58.3	128.1	161.8	-174.9	172	13.3	0	0	108.6	P602	Q600-P602 WeakPolarHBondContact O-CD 3.15Å
601	C	85.6	Confident	80.8	Confident	60 Å²	60	38 Å²	38	41%	0.405	24%	0.239	S	C	.	.			trans	-46.5	122.9	-173.9	-174	0	0	0	0	111	I599 L603	I599-C601 PolarHBondContact O-N 3.27Å; C601-L603 PolarHBondContact O-N 2.83Å
602	P	85.4	Confident	79.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	-59.7	-23.7	176.8	-28.7	37.1	0	0	0	114.1	I599 Q600 L634 A681 Q682 R685 L686	I599-P602 HydrophobicContact CD1-CG 3.57Å; I599-P602 HydrophobicContact CG1-CG 4.4Å; Q600-P602 WeakPolarHBondContact O-CD 3.15Å; P602-L634 HydrophobicContact CB-CD1 4.14Å; P602-L634 HydrophobicContact CG-CD1 3.73Å; P602-L634 HydrophobicContact CG-CD2 4.48Å; P602-A681 CarbonylContact O-C 3.59Å; P602-A681 WeakPolarHBondContact O-CA 3.32Å; P602-Q682 PolarHBondContact O-N 2.9Å; P602-R685 HydrophobicContact CB-CB 3.76Å; P602-R685 HydrophobicContact CG-CB 3.72Å; P602-L686 HydrophobicContact CB-CD2 3.97Å; P602-L686 HydrophobicContact CB-CG 4.34Å; P602-L686 HydrophobicContact CG-CD2 4.14Å
603	L	86.7	Confident	79	Confident	27 Å²	27	44.6 Å²	44.6	14%	0.141	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-82.3	124.7	179.3	-58.1	176.9	0	0	0	110	C601 L621 V637 A681	C601-L603 PolarHBondContact O-N 2.83Å; L603-L621 HydrophobicContact CD1-CD1 3.96Å; L603-L621 HydrophobicContact CD1-CD2 4.18Å; L603-L621 HydrophobicContact CD2-CD1 4.15Å; L603-V637 HydrophobicContact CD2-CG1 4.23Å; L603-V637 HydrophobicContact CD2-CG2 4.44Å; L603-A681 HydrophobicContact CD2-CB 3.97Å
604	L	77.5	Confident	78	Confident	69 Å²	69	47 Å²	47	36%	0.361	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-65.4	139.3	176.2	-74.5	159.8	0	0	0	110.1	Y606 F609 G680 Q682	L604-Y606 PolarHBondContact O-N 3.17Å; L604-F609 HydrophobicContact CB-CE2 3.73Å; L604-F609 HydrophobicContact CB-CZ 3.88Å; L604-F609 HydrophobicContact CD1-CE2 4.48Å; L604-F609 HydrophobicContact CD1-CZ 3.85Å; L604-F609 HydrophobicContact CG-CZ 4.35Å; L604-G680 WeakPolarHBondContact CB-O 3.46Å; L604-G680 WeakPolarHBondContact CG-O 3.28Å; L604-G680 PolarHBondContact N-O 2.97Å; L604-Q682 HydrophobicContact CD1-CG 4.27Å; L604-Q682 HydrophobicContact CD2-CG 4.22Å; L604-Q682 HydrophobicContact CG-CG 4.04Å
605	P	69.8	Low	77.3	Confident	51 Å²	51	50.7 Å²	50.7	33%	0.331	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-54.5	130	172.4	-25.4	34.6	0	0	0	110.5	T607 A608 N871	P605-T607 PolarHBondContact O-N 2.91Å; P605-A608 HydrophobicContact CB-CB 4.42Å; P605-A608 WeakPolarHBondContact O-CB 3.34Å; P605-A608 PolarHBondContact O-N 3.36Å; P605-N871 VanDerWaalsContact CA-ND2 3.35Å; P605-N871 WeakPolarHBondContact CA-ND2 3.26Å; P605-N871 VanDerWaalsContact CB-ND2 3.34Å; P605-N871 WeakPolarHBondContact CB-ND2 3.4Å
606	Y	67	Low	76.8	Confident	58 Å²	58	58.3 Å²	58.3	23%	0.227	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-62.7	-28.1	175.4	65.2	-107.4	0	0	0	111	L604 A608 F609 Q614 I618 P870 N871	L604-Y606 PolarHBondContact O-N 3.17Å; Y606-A608 PolarHBondContact O-N 3.05Å; Y606-F609 PolarHBondContact O-N 3.2Å; Y606-F609 VanDerWaalsContact O-O 3.06Å; Y606-Q614 HydrophobicContact CD2-CG 4.38Å; Y606-I618 HydrophobicContact CG-CD1 4.48Å; Y606-P870 WeakPolarHBondContact CE1-O 3.3Å; Y606-P870 WeakPolarHBondContact OH-CB 3.47Å; Y606-P870 PolarHBondContact OH-O 2.98Å; Y606-N871 WeakPolarHBondContact CD1-OD1 3.44Å; Y606-N871 HydrophobicContact CE1-CB 4.36Å; Y606-N871 WeakPolarHBondContact CE1-OD1 3.32Å
607	T	63.9	Low	76.3	Confident	91 Å²	91	60.4 Å²	60.4	56%	0.558	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-65.4	-14.7	176.1	55.8	0	0	0	0	113.3	P605 F609	P605-T607 PolarHBondContact O-N 2.91Å; T607-F609 PolarHBondContact O-N 3.15Å
608	A	61.1	Low	75.7	Confident	66 Å²	66	62.4 Å²	62.4	55%	0.545	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-73.4	-10.1	170.6	0	0	0	0	0	112.4	P605 Y606	P605-A608 HydrophobicContact CB-CB 4.42Å; P605-A608 WeakPolarHBondContact O-CB 3.34Å; P605-A608 PolarHBondContact O-N 3.36Å; Y606-A608 PolarHBondContact O-N 3.05Å
609	F	65.7	Low	75.6	Confident	51 Å²	51	65.6 Å²	65.6	22%	0.224	37%	0.373	C	S	.	.	S	Bend	trans	-124.2	156.5	-177.5	-48.1	-63.8	0	0	0	110.5	L604 Y606 T607 Q614	L604-F609 HydrophobicContact CB-CE2 3.73Å; L604-F609 HydrophobicContact CB-CZ 3.88Å; L604-F609 HydrophobicContact CD1-CE2 4.48Å; L604-F609 HydrophobicContact CD1-CZ 3.85Å; L604-F609 HydrophobicContact CG-CZ 4.35Å; Y606-F609 PolarHBondContact O-N 3.2Å; Y606-F609 VanDerWaalsContact O-O 3.06Å; T607-F609 PolarHBondContact O-N 3.15Å; F609-Q614 HydrophobicContact CB-CB 4.35Å
610	S	62.8	Low	75.7	Confident	100 Å²	100	65.5 Å²	65.5	70%	0.699	38%	0.375	S	S	*	.			trans	-132.9	156.6	-179	61.6	0	0	0	0	111.5
611	G	72.5	Confident	76	Confident	52 Å²	52	62.2 Å²	62.2	54%	0.536	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	-143.1	174.3	0	0	0	0	0	113.9	E613 Q614	G611-E613 VanDerWaalsContact C-N 3.27Å; G611-E613 PolarHBondContact O-N 2.95Å; G611-Q614 WeakPolarHBondContact O-CB 3.35Å; G611-Q614 PolarHBondContact O-N 3.27Å
612	A	75.4	Confident	76.1	Confident	68 Å²	68	61.5 Å²	61.5	56%	0.562	36%	0.359	S	S	*	.	H	α-helix	trans	-62.7	-29.1	-173.1	0	0	0	0	0	114	Q614 T615 R616	A612-Q614 VanDerWaalsContact C-N 3.34Å; A612-T615 PolarHBondContact O-N 3.36Å; A612-R616 VanDerWaalsContact O-CG 3.29Å; A612-R616 WeakPolarHBondContact O-CG 3.11Å; A612-R616 PolarHBondContact O-N 2.68Å
613	E	72.4	Confident	76.2	Confident	73 Å²	73	69 Å²	69	34%	0.341	39%	0.394	S	S	.	.	H	α-helix	trans	-68.2	-37.2	179.1	-174.8	60.9	-168.3	0	0	111.7	G611 R617	G611-E613 VanDerWaalsContact C-N 3.27Å; G611-E613 PolarHBondContact O-N 2.95Å; E613-R617 WeakPolarHBondContact O-CG 3.15Å; E613-R617 PolarHBondContact O-N 2.98Å; E613-R617 VanDerWaalsContact O-N 3.13Å; E613-R617 IonicContact OE1-CZ 2.7Å; E613-R617 IonicContact OE1-NE 2.69Å; E613-R617 PolarHBondContact OE1-NE 3.3Å; E613-R617 VanDerWaalsContact OE1-NE 3.14Å; E613-R617 IonicContact OE1-NH1 3.71Å; E613-R617 IonicContact OE1-NH2 3.08Å; E613-R617 PolarHBondContact OE1-NH2 2.97Å
614	Q	73.7	Confident	76.4	Confident	54 Å²	54	68.9 Å²	68.9	25%	0.252	39%	0.392	S	S	.	.	H	α-helix	trans	-60.9	-49.5	175.5	-174.2	-172.4	-1.7	0	0	110.7	Y606 F609 G611 A612 R617 I618	Y606-Q614 HydrophobicContact CD2-CG 4.38Å; F609-Q614 HydrophobicContact CB-CB 4.35Å; G611-Q614 WeakPolarHBondContact O-CB 3.35Å; G611-Q614 PolarHBondContact O-N 3.27Å; A612-Q614 VanDerWaalsContact C-N 3.34Å; Q614-R617 PolarHBondContact O-N 3.19Å; Q614-I618 HydrophobicContact CG-CD1 4.01Å; Q614-I618 VanDerWaalsContact O-CG1 3.3Å; Q614-I618 WeakPolarHBondContact O-CG1 3.34Å; Q614-I618 PolarHBondContact O-N 3.5Å; Q614-I618 VanDerWaalsContact O-N 3.1Å
615	T	77.7	Confident	77	Confident	78 Å²	78	66.7 Å²	66.7	48%	0.479	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-48.1	178.9	-49.2	0	0	0	0	111.6	A612 R617 I618 D619	A612-T615 PolarHBondContact O-N 3.36Å; T615-R617 VanDerWaalsContact C-N 3.3Å; T615-R617 PolarHBondContact O-N 3.22Å; T615-I618 PolarHBondContact O-N 3.42Å; T615-I618 VanDerWaalsContact O-N 3.15Å; T615-D619 VanDerWaalsContact O-CG 3.3Å; T615-D619 PolarHBondContact O-N 3.21Å
616	R	81.7	Confident	78	Confident	160 Å²	160	65 Å²	65	60%	0.604	37%	0.369	S	S	*	.	H	α-helix	trans	-57	-41.1	179.2	-75.6	174.3	-177.8	-170.8	-0.8	113	A612 A620	A612-R616 VanDerWaalsContact O-CG 3.29Å; A612-R616 WeakPolarHBondContact O-CG 3.11Å; A612-R616 PolarHBondContact O-N 2.68Å; R616-A620 WeakPolarHBondContact O-CB 3.45Å; R616-A620 PolarHBondContact O-N 3.21Å
617	R	79.3	Confident	79.1	Confident	47 Å²	47	65.2 Å²	65.2	18%	0.177	37%	0.374	C	S	.	.	H	α-helix	trans	-71.1	-38	178.8	-71.7	-166.4	176.7	119.7	9.7	112.5	E613 Q614 T615 A620 L621 R677	E613-R617 WeakPolarHBondContact O-CG 3.15Å; E613-R617 PolarHBondContact O-N 2.98Å; E613-R617 VanDerWaalsContact O-N 3.13Å; E613-R617 IonicContact OE1-CZ 2.7Å; E613-R617 IonicContact OE1-NE 2.69Å; E613-R617 PolarHBondContact OE1-NE 3.3Å; E613-R617 VanDerWaalsContact OE1-NE 3.14Å; E613-R617 IonicContact OE1-NH1 3.71Å; E613-R617 IonicContact OE1-NH2 3.08Å; E613-R617 PolarHBondContact OE1-NH2 2.97Å; Q614-R617 PolarHBondContact O-N 3.19Å; T615-R617 VanDerWaalsContact C-N 3.3Å; T615-R617 PolarHBondContact O-N 3.22Å; R617-A620 PolarHBondContact O-N 3.11Å; R617-L621 VanDerWaalsContact O-CB 3.3Å; R617-L621 WeakPolarHBondContact O-CB 3.44Å; R617-L621 PolarHBondContact O-N 3.41Å; R617-R677 PolarHBondContact NE-O 3.21Å
618	I	80.1	Confident	80.4	Confident	51 Å²	51	61.5 Å²	61.5	26%	0.262	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-48.1	174.9	-69.2	166.8	0	0	0	109.7	Y606 Q614 T615 A620 L621 A622	Y606-I618 HydrophobicContact CG-CD1 4.48Å; Q614-I618 HydrophobicContact CG-CD1 4.01Å; Q614-I618 VanDerWaalsContact O-CG1 3.3Å; Q614-I618 WeakPolarHBondContact O-CG1 3.34Å; Q614-I618 PolarHBondContact O-N 3.5Å; Q614-I618 VanDerWaalsContact O-N 3.1Å; T615-I618 PolarHBondContact O-N 3.42Å; T615-I618 VanDerWaalsContact O-N 3.15Å; I618-A620 VanDerWaalsContact C-N 3.32Å; I618-A620 PolarHBondContact O-N 2.69Å; I618-L621 PolarHBondContact O-N 2.87Å; I618-A622 PolarHBondContact O-N 2.93Å
619	D	84.8	Confident	81.9	Confident	107 Å²	107	58.4 Å²	58.4	57%	0.572	32%	0.324	S	S	*	.	H	α-helix	trans	-62.4	-40.1	178.9	-64	-20.9	0	0	0	111.7	T615 A622	T615-D619 VanDerWaalsContact O-CG 3.3Å; T615-D619 PolarHBondContact O-N 3.21Å; D619-A622 WeakPolarHBondContact O-CB 3.47Å; D619-A622 PolarHBondContact O-N 3.05Å
620	A	85.9	Confident	83.1	Confident	20 Å²	20	57.6 Å²	57.6	17%	0.165	32%	0.322	C	S	.	.	H	α-helix	trans	-69.6	-31.5	176.7	0	0	0	0	0	113.3	R616 R617 I618 R678 I679	R616-A620 WeakPolarHBondContact O-CB 3.45Å; R616-A620 PolarHBondContact O-N 3.21Å; R617-A620 PolarHBondContact O-N 3.11Å; I618-A620 VanDerWaalsContact C-N 3.32Å; I618-A620 PolarHBondContact O-N 2.69Å; A620-R678 HydrophobicContact CB-CG 3.97Å; A620-I679 HydrophobicContact CB-CG2 4.23Å
621	L	87.9	Confident	84.4	Confident	24 Å²	24	53 Å²	53	13%	0.126	29%	0.291	C	S	.	.	H	α-helix	trans	-77.5	-27.7	177.4	-175.1	63.2	0	0	0	111.9	L603 R617 I618 E623 Y624 E625 V637	L603-L621 HydrophobicContact CD1-CD1 3.96Å; L603-L621 HydrophobicContact CD1-CD2 4.18Å; L603-L621 HydrophobicContact CD2-CD1 4.15Å; R617-L621 VanDerWaalsContact O-CB 3.3Å; R617-L621 WeakPolarHBondContact O-CB 3.44Å; R617-L621 PolarHBondContact O-N 3.41Å; I618-L621 PolarHBondContact O-N 2.87Å; L621-E623 PolarHBondContact O-N 3.1Å; L621-E623 VanDerWaalsContact O-N 3.07Å; L621-Y624 PolarHBondContact O-N 3.24Å; L621-E625 HydrophobicContact CG-CG 4.38Å; L621-E625 PolarHBondContact O-N 3.39Å; L621-V637 HydrophobicContact CD1-CG2 4.05Å
622	A	87	Confident	85.4	Confident	45 Å²	45	51.1 Å²	51.1	37%	0.372	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.2	-176.4	0	0	0	0	0	114	I618 D619 Y624	I618-A622 PolarHBondContact O-N 2.93Å; D619-A622 WeakPolarHBondContact O-CB 3.47Å; D619-A622 PolarHBondContact O-N 3.05Å; A622-Y624 VanDerWaalsContact C-N 3.28Å; A622-Y624 PolarHBondContact O-N 3.32Å
623	E	88.2	Confident	86.3	Confident	156 Å²	156	48 Å²	48	73%	0.729	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.1	174.7	-173	179.2	168.7	0	0	112.9	L621	L621-E623 PolarHBondContact O-N 3.1Å; L621-E623 VanDerWaalsContact O-N 3.07Å
624	Y	90.6	Very high	87.2	Confident	26 Å²	26	45 Å²	45	10%	0.102	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-6.9	-174.9	-52.5	-69.5	0	0	0	113.5	L621 A622 S626 N636 V637 E640 W675 I679	L621-Y624 PolarHBondContact O-N 3.24Å; A622-Y624 VanDerWaalsContact C-N 3.28Å; A622-Y624 PolarHBondContact O-N 3.32Å; Y624-S626 PolarHBondContact O-N 2.85Å; Y624-N636 WeakPolarHBondContact O-CB 3.35Å; Y624-N636 PolarHBondContact O-ND2 3.25Å; Y624-V637 HydrophobicContact CD2-CG2 4.4Å; Y624-V637 HydrophobicContact CG-CG2 4.09Å; Y624-E640 HydrophobicContact CD1-CB 4.48Å; Y624-E640 HydrophobicContact CE1-CB 4.05Å; Y624-E640 HydrophobicContact CE1-CG 3.74Å; Y624-W675 HydrophobicContact CE2-CZ2 4.18Å; Y624-W675 AromaticContact CZ-NE1 3.75Å; Y624-W675 PolarHBondContact OH-NE1 3.47Å; Y624-I679 HydrophobicContact CD2-CG2 4.39Å; Y624-I679 HydrophobicContact CE2-CG2 3.93Å
625	E	89.1	Confident	88.1	Confident	22 Å²	22	43 Å²	43	10%	0.103	22%	0.219	C	C	.	.			trans	-64.5	120.6	-179.2	-72.9	-173.7	162.3	0	0	112	L621 T633 V873 R876 K877	L621-E625 HydrophobicContact CG-CG 4.38Å; L621-E625 PolarHBondContact O-N 3.39Å; E625-T633 HydrophobicContact CG-CG2 4.29Å; E625-V873 HydrophobicContact CB-CG2 4.22Å; E625-V873 HydrophobicContact CG-CG2 4.39Å; E625-R876 IonicContact OE1-CZ 3.86Å; E625-R876 IonicContact OE1-NE 3.66Å; E625-R876 PolarHBondContact OE1-NE 3.24Å; E625-R876 IonicContact OE1-NH2 3.19Å; E625-R876 PolarHBondContact OE1-NH2 3.28Å; E625-K877 VanDerWaalsContact OE2-CE 3.29Å; E625-K877 WeakPolarHBondContact OE2-CE 3.36Å; E625-K877 IonicContact OE2-NZ 3.52Å; E625-K877 PolarHBondContact OE2-NZ 3.02Å
626	S	91.4	Very high	88.8	Confident	15 Å²	15	41.8 Å²	41.8	11%	0.105	21%	0.21	C	C	.	.			trans	-90.4	133.7	171.4	-177.6	0	0	0	0	110.4	Y624 H628 G629 F632 T633	Y624-S626 PolarHBondContact O-N 2.85Å; S626-H628 PolarHBondContact O-N 3.23Å; S626-H628 VanDerWaalsContact O-N 3.15Å; S626-H628 WeakPolarHBondContact OG-CB 3.4Å; S626-H628 PolarHBondContact OG-N 3.49Å; S626-G629 PolarHBondContact O-N 2.75Å; S626-F632 VanDerWaalsContact CB-CB 3.47Å; S626-F632 WeakPolarHBondContact OG-CB 3.48Å; S626-T633 PolarHBondContact N-OG1 3.15Å
627	D	90.1	Very high	89.3	Confident	64 Å²	64	34.1 Å²	34.1	34%	0.342	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-5.3	171.9	80.9	2.5	0	0	0	112.6	F874 V880 R963	D627-F874 WeakPolarHBondContact O-CE1 3.37Å; D627-V880 HydrophobicContact CB-CG1 3.97Å; D627-V880 HydrophobicContact CB-CG2 4.24Å; D627-R963 VanDerWaalsContact O-CD 3.26Å; D627-R963 WeakPolarHBondContact O-CD 3.36Å; D627-R963 PolarHBondContact O-NE 3.14Å; D627-R963 IonicContact OD1-CZ 3.68Å; D627-R963 IonicContact OD1-NE 3.82Å; D627-R963 IonicContact OD1-NH2 3.05Å; D627-R963 PolarHBondContact OD1-NH2 2.82Å; D627-R963 IonicContact OD2-CZ 3.09Å; D627-R963 IonicContact OD2-NH2 3.38Å; D627-R963 PolarHBondContact OD2-NH2 3.31Å
628	H	91.7	Very high	90	Very high	13 Å²	13	32 Å²	32	6%	0.06	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-17.3	179.2	-64.8	-14.9	0	0	0	113.5	S626 F632 K821 I962 R963	S626-H628 PolarHBondContact O-N 3.23Å; S626-H628 VanDerWaalsContact O-N 3.15Å; S626-H628 WeakPolarHBondContact OG-CB 3.4Å; S626-H628 PolarHBondContact OG-N 3.49Å; H628-F632 HydrophobicContact CB-CB 4.08Å; H628-F632 HydrophobicContact CB-CD1 4.25Å; H628-F632 HydrophobicContact CB-CD2 3.51Å; H628-F632 HydrophobicContact CB-CE2 3.94Å; H628-F632 HydrophobicContact CB-CG 3.69Å; H628-F632 HydrophobicContact CB-CZ 4.46Å; H628-K821 PolarHBondContact CE1-NZ 2.89Å; H628-K821 PolarHBondContact ND1-NZ 2.87Å; H628-K821 VanDerWaalsContact ND1-NZ 3.12Å; H628-I962 WeakPolarHBondContact O-CA 3.21Å; H628-R963 PolarHBondContact ND1-NH2 3.08Å; H628-R963 PolarHBondContact O-N 2.95Å
629	G	92.5	Very high	90.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	136.4	179.1	179	0	0	0	0	0	113.9	S626 A631 F632 T633 T961	S626-G629 PolarHBondContact O-N 2.75Å; G629-A631 VanDerWaalsContact C-N 3.35Å; G629-A631 PolarHBondContact O-N 2.77Å; G629-F632 PolarHBondContact O-N 3.21Å; G629-T633 PolarHBondContact O-N 3.22Å; G629-T633 VanDerWaalsContact O-N 3.11Å; G629-T633 PolarHBondContact O-OG1 2.81Å; G629-T633 VanDerWaalsContact O-OG1 3.12Å; G629-T961 WeakPolarHBondContact CA-O 3.4Å
630	D	89.5	Confident	90.9	Very high	34 Å²	34	26.6 Å²	26.6	18%	0.182	14%	0.144	C	C	.	.	H	α-helix	trans	-64.3	-38.8	-176.5	-75.3	-7.2	0	0	0	112.4	F632 T633 L634 D872 V873 T961	D630-F632 VanDerWaalsContact C-N 3.31Å; D630-F632 PolarHBondContact O-N 3.47Å; D630-T633 PolarHBondContact O-N 3.15Å; D630-L634 WeakPolarHBondContact O-CB 3.34Å; D630-L634 PolarHBondContact O-N 2.7Å; D630-D872 WeakPolarHBondContact OD1-CA 3.43Å; D630-D872 WeakPolarHBondContact OD2-CA 3.36Å; D630-V873 PolarHBondContact OD1-N 3.35Å; D630-T961 PolarHBondContact N-O 3.33Å
631	A	91.6	Very high	91.1	Very high	4 Å²	4	25.7 Å²	25.7	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-40.6	-179.6	0	0	0	0	0	111.9	L593 M597 G629 L634 V635 I962	L593-A631 HydrophobicContact CD2-CB 3.96Å; L593-A631 WeakPolarHBondContact CD2-O 3.2Å; M597-A631 HydrophobicContact CG-CB 4.17Å; M597-A631 HydrophobicContact SD-CB 4.15Å; G629-A631 VanDerWaalsContact C-N 3.35Å; G629-A631 PolarHBondContact O-N 2.77Å; A631-L634 PolarHBondContact O-N 2.77Å; A631-V635 WeakPolarHBondContact O-CG2 3.17Å; A631-V635 PolarHBondContact O-N 3.11Å; A631-V635 VanDerWaalsContact O-N 3.12Å; A631-I962 HydrophobicContact CB-CD1 4.17Å; A631-I962 HydrophobicContact CB-CG1 4.28Å
632	F	93.7	Very high	91.2	Very high	12 Å²	12	24.6 Å²	24.6	5%	0.053	13%	0.13	C	C	.	.	H	α-helix	trans	-72.5	-40.6	177.6	-71.3	-91.7	0	0	0	111.8	L593 S626 H628 G629 D630 L634 V635 N636 L817 L820 K821 L824 I962	L593-F632 HydrophobicContact CD1-CE1 4.45Å; L593-F632 HydrophobicContact CD2-CD1 4.46Å; L593-F632 HydrophobicContact CD2-CG 4.46Å; S626-F632 VanDerWaalsContact CB-CB 3.47Å; S626-F632 WeakPolarHBondContact OG-CB 3.48Å; H628-F632 HydrophobicContact CB-CB 4.08Å; H628-F632 HydrophobicContact CB-CD1 4.25Å; H628-F632 HydrophobicContact CB-CD2 3.51Å; H628-F632 HydrophobicContact CB-CE2 3.94Å; H628-F632 HydrophobicContact CB-CG 3.69Å; H628-F632 HydrophobicContact CB-CZ 4.46Å; G629-F632 PolarHBondContact O-N 3.21Å; D630-F632 VanDerWaalsContact C-N 3.31Å; D630-F632 PolarHBondContact O-N 3.47Å; F632-L634 VanDerWaalsContact C-N 3.26Å; F632-L634 PolarHBondContact O-N 3.49Å; F632-V635 PolarHBondContact O-N 3.17Å; F632-V635 VanDerWaalsContact O-N 3.17Å; F632-N636 PolarHBondContact O-N 3.44Å; F632-N636 PolarHBondContact O-OD1 2.91Å; F632-L817 HydrophobicContact CE1-CD2 4.22Å; F632-L820 HydrophobicContact CE1-CD2 3.86Å; F632-L820 HydrophobicContact CE1-CG 4.42Å; F632-L820 HydrophobicContact CZ-CD2 4.38Å; F632-L820 HydrophobicContact CZ-CG 4.46Å; F632-K821 HydrophobicContact CZ-CG 4.24Å; F632-L824 HydrophobicContact CE2-CD1 3.72Å; F632-L824 HydrophobicContact CZ-CD1 3.59Å; F632-I962 HydrophobicContact CE2-CD1 4.4Å; F632-I962 HydrophobicContact CE2-CG1 4.49Å; F632-I962 HydrophobicContact CE2-CG2 3.82Å
633	T	92.5	Very high	91.2	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-56.4	-43.9	172.6	-60.6	0	0	0	0	111.1	E625 S626 G629 D630 V635 N636 V637	E625-T633 HydrophobicContact CG-CG2 4.29Å; S626-T633 PolarHBondContact N-OG1 3.15Å; G629-T633 PolarHBondContact O-N 3.22Å; G629-T633 VanDerWaalsContact O-N 3.11Å; G629-T633 PolarHBondContact O-OG1 2.81Å; G629-T633 VanDerWaalsContact O-OG1 3.12Å; D630-T633 PolarHBondContact O-N 3.15Å; T633-V635 PolarHBondContact O-N 2.89Å; T633-N636 PolarHBondContact O-N 3.01Å; T633-V637 WeakPolarHBondContact O-CG2 3.41Å; T633-V637 PolarHBondContact O-N 3.45Å; T633-V637 VanDerWaalsContact O-N 3.14Å
634	L	92.2	Very high	91	Very high	11 Å²	11	18.9 Å²	18.9	6%	0.058	10%	0.095	C	C	.	.	H	α-helix	trans	-65.3	-38.2	178.5	179.5	57.3	0	0	0	112.6	P602 D630 A631 F632 V637 F638	P602-L634 HydrophobicContact CB-CD1 4.14Å; P602-L634 HydrophobicContact CG-CD1 3.73Å; P602-L634 HydrophobicContact CG-CD2 4.48Å; D630-L634 WeakPolarHBondContact O-CB 3.34Å; D630-L634 PolarHBondContact O-N 2.7Å; A631-L634 PolarHBondContact O-N 2.77Å; F632-L634 VanDerWaalsContact C-N 3.26Å; F632-L634 PolarHBondContact O-N 3.49Å; L634-V637 PolarHBondContact O-N 2.86Å; L634-F638 WeakPolarHBondContact O-CB 3.42Å; L634-F638 PolarHBondContact O-N 3.39Å
635	V	92	Very high	90.7	Very high	11 Å²	11	18.5 Å²	18.5	7%	0.067	9%	0.094	C	C	.	.	H	α-helix	trans	-67.5	-40.9	176	169.3	0	0	0	0	111.6	L593 A631 F632 T633 V637 F638 D639 M689	L593-V635 HydrophobicContact CB-CG2 4.41Å; L593-V635 HydrophobicContact CD2-CB 4.32Å; L593-V635 HydrophobicContact CD2-CG2 3.54Å; L593-V635 HydrophobicContact CG-CG2 3.8Å; A631-V635 WeakPolarHBondContact O-CG2 3.17Å; A631-V635 PolarHBondContact O-N 3.11Å; A631-V635 VanDerWaalsContact O-N 3.12Å; F632-V635 PolarHBondContact O-N 3.17Å; F632-V635 VanDerWaalsContact O-N 3.17Å; T633-V635 PolarHBondContact O-N 2.89Å; V635-V637 VanDerWaalsContact C-N 3.31Å; V635-V637 PolarHBondContact O-N 3.42Å; V635-F638 CarbonylContact O-C 3.56Å; V635-F638 WeakPolarHBondContact O-CB 3.42Å; V635-F638 PolarHBondContact O-N 3.35Å; V635-F638 VanDerWaalsContact O-N 3.07Å; V635-D639 WeakPolarHBondContact O-CB 3.3Å; V635-D639 PolarHBondContact O-N 3.13Å; V635-M689 HydrophobicContact CG2-CE 4.23Å
636	N	93.5	Very high	90.3	Very high	52 Å²	52	17.5 Å²	17.5	28%	0.278	9%	0.089	S	C	.	.	H	α-helix	trans	-57.3	-45.4	174.6	-68.1	-10.2	0	0	0	111.8	Y624 F632 T633 F638 D639 E640	Y624-N636 WeakPolarHBondContact O-CB 3.35Å; Y624-N636 PolarHBondContact O-ND2 3.25Å; F632-N636 PolarHBondContact O-N 3.44Å; F632-N636 PolarHBondContact O-OD1 2.91Å; T633-N636 PolarHBondContact O-N 3.01Å; N636-F638 VanDerWaalsContact C-N 3.34Å; N636-F638 PolarHBondContact O-N 3.03Å; N636-D639 PolarHBondContact O-N 3.18Å; N636-E640 WeakPolarHBondContact O-CB 3.29Å; N636-E640 PolarHBondContact O-N 3.41Å
637	V	92.8	Very high	89.8	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.2	-42.2	175.1	171.9	0	0	0	0	111.1	L603 L621 Y624 T633 L634 V635 W641 W675 I679	L603-V637 HydrophobicContact CD2-CG1 4.23Å; L603-V637 HydrophobicContact CD2-CG2 4.44Å; L621-V637 HydrophobicContact CD1-CG2 4.05Å; Y624-V637 HydrophobicContact CD2-CG2 4.4Å; Y624-V637 HydrophobicContact CG-CG2 4.09Å; T633-V637 WeakPolarHBondContact O-CG2 3.41Å; T633-V637 PolarHBondContact O-N 3.45Å; T633-V637 VanDerWaalsContact O-N 3.14Å; L634-V637 PolarHBondContact O-N 2.86Å; V635-V637 VanDerWaalsContact C-N 3.31Å; V635-V637 PolarHBondContact O-N 3.42Å; V637-W641 WeakPolarHBondContact O-CB 3.11Å; V637-W641 PolarHBondContact O-N 3Å; V637-W675 HydrophobicContact CG1-CH2 3.81Å; V637-W675 WeakPolarHBondContact O-CH2 3.23Å; V637-I679 HydrophobicContact CG1-CD1 3.64Å
638	F	93.2	Very high	89	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.009	10%	0.095	C	C	.	.	H	α-helix	trans	-65.6	-44.8	179.2	175.5	-103.1	0	0	0	112.4	L634 V635 N636 W641 I642 L686 M689 V690	L634-F638 WeakPolarHBondContact O-CB 3.42Å; L634-F638 PolarHBondContact O-N 3.39Å; V635-F638 CarbonylContact O-C 3.56Å; V635-F638 WeakPolarHBondContact O-CB 3.42Å; V635-F638 PolarHBondContact O-N 3.35Å; V635-F638 VanDerWaalsContact O-N 3.07Å; N636-F638 VanDerWaalsContact C-N 3.34Å; N636-F638 PolarHBondContact O-N 3.03Å; F638-W641 HydrophobicContact CD2-CE3 4.3Å; F638-W641 HydrophobicContact CE2-CE3 4.28Å; F638-W641 HydrophobicContact CE2-CZ3 4.24Å; F638-W641 WeakPolarHBondContact O-CB 3.3Å; F638-W641 PolarHBondContact O-N 2.93Å; F638-I642 HydrophobicContact CD1-CG1 4.32Å; F638-I642 HydrophobicContact CE1-CG1 3.92Å; F638-I642 HydrophobicContact CE2-CD1 4.21Å; F638-I642 HydrophobicContact CE2-CG1 4.14Å; F638-I642 HydrophobicContact CZ-CD1 3.99Å; F638-I642 HydrophobicContact CZ-CG1 3.83Å; F638-I642 WeakPolarHBondContact O-CG1 3.37Å; F638-I642 PolarHBondContact O-N 3.28Å; F638-L686 HydrophobicContact CB-CD2 4.5Å; F638-L686 HydrophobicContact CD2-CD2 4.15Å; F638-M689 HydrophobicContact CB-CE 3.67Å; F638-M689 HydrophobicContact CB-SD 3.86Å; F638-M689 HydrophobicContact CD1-CE 3.79Å; F638-M689 HydrophobicContact CD1-SD 4.38Å; F638-M689 HydrophobicContact CD2-CB 4.15Å; F638-M689 HydrophobicContact CD2-CE 3.93Å; F638-M689 HydrophobicContact CD2-CG 3.98Å; F638-M689 HydrophobicContact CD2-SD 3.41Å; F638-M689 WeakPolarHBondContact CD2-SD 3.26Å; F638-M689 HydrophobicContact CE1-CE 4.39Å; F638-M689 HydrophobicContact CE2-CB 3.91Å; F638-M689 HydrophobicContact CE2-CG 3.93Å; F638-M689 HydrophobicContact CE2-SD 4Å; F638-M689 HydrophobicContact CG-CE 3.51Å; F638-M689 HydrophobicContact CG-SD 3.63Å; F638-M689 HydrophobicContact CZ-CG 4.41Å; F638-V690 HydrophobicContact CE2-CG2 3.67Å; F638-V690 HydrophobicContact CZ-CG2 3.77Å
639	D	92.1	Very high	88	Confident	4 Å²	4	19.1 Å²	19.1	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-64.3	-43.9	-179.9	-78.7	-7.3	0	0	0	111.2	V635 N636 W641 I642 K643 A806 Q809	V635-D639 WeakPolarHBondContact O-CB 3.3Å; V635-D639 PolarHBondContact O-N 3.13Å; N636-D639 PolarHBondContact O-N 3.18Å; D639-W641 VanDerWaalsContact C-N 3.33Å; D639-W641 PolarHBondContact O-N 3.37Å; D639-I642 PolarHBondContact O-N 3.28Å; D639-K643 PolarHBondContact O-N 3.42Å; D639-A806 HydrophobicContact CB-CB 3.69Å; D639-Q809 WeakPolarHBondContact OD2-CB 3.5Å; D639-Q809 PolarHBondContact OD2-OE1 3.37Å
640	E	91	Very high	86.6	Confident	41 Å²	41	20.9 Å²	20.9	19%	0.192	11%	0.113	C	C	.	.	H	α-helix	trans	-61.8	-42.5	174.1	-170.8	60	-154.2	0	0	111.3	Y624 N636 I642 K643 M644 W675	Y624-E640 HydrophobicContact CD1-CB 4.48Å; Y624-E640 HydrophobicContact CE1-CB 4.05Å; Y624-E640 HydrophobicContact CE1-CG 3.74Å; N636-E640 WeakPolarHBondContact O-CB 3.29Å; N636-E640 PolarHBondContact O-N 3.41Å; E640-I642 VanDerWaalsContact C-N 3.34Å; E640-I642 PolarHBondContact O-N 2.68Å; E640-K643 WeakPolarHBondContact O-CB 3.25Å; E640-K643 PolarHBondContact O-N 2.92Å; E640-M644 HydrophobicContact CG-CE 3.88Å; E640-M644 WeakPolarHBondContact O-CE 3.35Å; E640-M644 PolarHBondContact O-N 3.09Å; E640-W675 HydrophobicContact CB-CZ2 4.26Å; E640-W675 HydrophobicContact CG-CZ2 4.08Å
641	W	91.3	Very high	85	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-40.8	175.7	179	77.2	0	0	0	112.9	V637 F638 D639 K645 W675 Q683 L686 H687 V690 L793	V637-W641 WeakPolarHBondContact O-CB 3.11Å; V637-W641 PolarHBondContact O-N 3Å; F638-W641 HydrophobicContact CD2-CE3 4.3Å; F638-W641 HydrophobicContact CE2-CE3 4.28Å; F638-W641 HydrophobicContact CE2-CZ3 4.24Å; F638-W641 WeakPolarHBondContact O-CB 3.3Å; F638-W641 PolarHBondContact O-N 2.93Å; D639-W641 VanDerWaalsContact C-N 3.33Å; D639-W641 PolarHBondContact O-N 3.37Å; W641-K645 HydrophobicContact CD2-CG 4.27Å; W641-K645 HydrophobicContact CZ2-CD 4.42Å; W641-K645 HydrophobicContact CZ2-CG 4.12Å; W641-K645 WeakPolarHBondContact O-CB 3.36Å; W641-K645 VanDerWaalsContact O-CG 3.32Å; W641-K645 WeakPolarHBondContact O-CG 3.39Å; W641-K645 PolarHBondContact O-N 2.95Å; W641-W675 HydrophobicContact CB-CH2 3.94Å; W641-W675 HydrophobicContact CB-CZ3 3.83Å; W641-W675 AromaticContact CD1-CZ3 3.84Å; W641-W675 HydrophobicContact CG-CZ3 4.22Å; W641-Q683 HydrophobicContact CZ2-CG 4.03Å; W641-L686 HydrophobicContact CB-CD1 4.04Å; W641-L686 HydrophobicContact CD2-CB 3.91Å; W641-L686 HydrophobicContact CD2-CD1 3.77Å; W641-L686 HydrophobicContact CD2-CG 4.42Å; W641-L686 HydrophobicContact CE3-CB 3.83Å; W641-L686 HydrophobicContact CE3-CD1 4.4Å; W641-L686 HydrophobicContact CG-CD1 3.57Å; W641-L686 HydrophobicContact CH2-CB 4.02Å; W641-L686 HydrophobicContact CZ2-CB 4.1Å; W641-L686 HydrophobicContact CZ3-CB 3.88Å; W641-H687 AromaticContact CH2-CE1 3.82Å; W641-H687 AromaticContact CH2-CG 3.96Å; W641-H687 AromaticContact CH2-ND1 3.79Å; W641-H687 AromaticContact CZ2-CD2 3.95Å; W641-H687 AromaticContact CZ2-CE1 3.84Å; W641-H687 AromaticContact CZ2-NE2 3.65Å; W641-V690 HydrophobicContact CH2-CG2 4.4Å; W641-V690 HydrophobicContact CZ3-CG2 3.78Å; W641-L793 HydrophobicContact CH2-CD2 3.85Å; W641-L793 HydrophobicContact CZ2-CD2 4.36Å; W641-L793 HydrophobicContact CZ3-CD2 4.42Å
642	I	89.8	Confident	82.7	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-43.6	175.2	-71.4	-63.9	0	0	0	110.8	F638 D639 E640 K645 S646 V690 L802 A803	F638-I642 HydrophobicContact CD1-CG1 4.32Å; F638-I642 HydrophobicContact CE1-CG1 3.92Å; F638-I642 HydrophobicContact CE2-CD1 4.21Å; F638-I642 HydrophobicContact CE2-CG1 4.14Å; F638-I642 HydrophobicContact CZ-CD1 3.99Å; F638-I642 HydrophobicContact CZ-CG1 3.83Å; F638-I642 WeakPolarHBondContact O-CG1 3.37Å; F638-I642 PolarHBondContact O-N 3.28Å; D639-I642 PolarHBondContact O-N 3.28Å; E640-I642 VanDerWaalsContact C-N 3.34Å; E640-I642 PolarHBondContact O-N 2.68Å; I642-K645 PolarHBondContact O-N 3Å; I642-S646 WeakPolarHBondContact O-CB 3.45Å; I642-S646 PolarHBondContact O-N 3.01Å; I642-S646 PolarHBondContact O-OG 3.14Å; I642-V690 HydrophobicContact CD1-CG2 3.93Å; I642-L802 HydrophobicContact CD1-CD1 4.39Å; I642-L802 HydrophobicContact CG2-CB 3.78Å; I642-A803 HydrophobicContact CG2-CB 4.34Å
643	K	85.8	Confident	80.3	Confident	64 Å²	64	36.1 Å²	36.1	28%	0.278	18%	0.184	S	C	.	.	H	α-helix	trans	-58.9	-53.8	177.1	-176.1	179.6	175.5	-173.9	0	111.1	D639 E640 K645 S646 E647	D639-K643 PolarHBondContact O-N 3.42Å; E640-K643 WeakPolarHBondContact O-CB 3.25Å; E640-K643 PolarHBondContact O-N 2.92Å; K643-K645 VanDerWaalsContact C-N 3.29Å; K643-K645 PolarHBondContact O-N 2.92Å; K643-S646 PolarHBondContact O-N 3.18Å; K643-S646 PolarHBondContact O-OG 3.23Å; K643-E647 WeakPolarHBondContact CE-OE1 3.48Å; K643-E647 WeakPolarHBondContact CG-OE1 3.3Å; K643-E647 WeakPolarHBondContact O-CG 3.41Å; K643-E647 PolarHBondContact O-N 3.36Å
644	M	84.6	Confident	77.6	Confident	17 Å²	17	43.8 Å²	43.8	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-40.1	175.9	-74.3	-176.3	-80.5	0	0	112.8	E640 A648 I672 W675	E640-M644 HydrophobicContact CG-CE 3.88Å; E640-M644 WeakPolarHBondContact O-CE 3.35Å; E640-M644 PolarHBondContact O-N 3.09Å; M644-A648 WeakPolarHBondContact O-CB 3.46Å; M644-A648 PolarHBondContact O-N 3.18Å; M644-I672 HydrophobicContact CB-CD1 4.43Å; M644-I672 HydrophobicContact CB-CG1 4.1Å; M644-W675 HydrophobicContact CE-CD2 3.21Å; M644-W675 HydrophobicContact CE-CE3 3.44Å; M644-W675 VanDerWaalsContact CE-CE3 3.44Å; M644-W675 HydrophobicContact CE-CG 3.74Å; M644-W675 HydrophobicContact CE-CH2 3.7Å; M644-W675 HydrophobicContact CE-CZ2 3.51Å; M644-W675 HydrophobicContact CE-CZ3 3.69Å; M644-W675 HydrophobicContact SD-CB 4.25Å; M644-W675 HydrophobicContact SD-CD2 4Å; M644-W675 HydrophobicContact SD-CE3 4.5Å; M644-W675 HydrophobicContact SD-CG 3.86Å
645	K	84.2	Confident	75	Confident	18 Å²	18	51.1 Å²	51.1	8%	0.078	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-39.1	175.8	-79.3	-76.5	178.4	-178.9	0	112.1	W641 I642 K643 T649 I672 Q683 D790 L793 L799	W641-K645 HydrophobicContact CD2-CG 4.27Å; W641-K645 HydrophobicContact CZ2-CD 4.42Å; W641-K645 HydrophobicContact CZ2-CG 4.12Å; W641-K645 WeakPolarHBondContact O-CB 3.36Å; W641-K645 VanDerWaalsContact O-CG 3.32Å; W641-K645 WeakPolarHBondContact O-CG 3.39Å; W641-K645 PolarHBondContact O-N 2.95Å; I642-K645 PolarHBondContact O-N 3Å; K643-K645 VanDerWaalsContact C-N 3.29Å; K643-K645 PolarHBondContact O-N 2.92Å; K645-T649 PolarHBondContact O-N 2.98Å; K645-T649 PolarHBondContact O-OG1 3.1Å; K645-I672 HydrophobicContact CD-CD1 3.59Å; K645-I672 HydrophobicContact CG-CD1 3.91Å; K645-Q683 VanDerWaalsContact NZ-NE2 3.13Å; K645-D790 IonicContact NZ-OD1 3.45Å; K645-D790 PolarHBondContact NZ-OD1 2.91Å; K645-D790 IonicContact NZ-OD2 3.39Å; K645-D790 PolarHBondContact NZ-OD2 3.11Å; K645-L793 HydrophobicContact CB-CD2 4.23Å; K645-L793 HydrophobicContact CD-CD2 3.93Å; K645-L793 HydrophobicContact CG-CD2 4Å; K645-L799 HydrophobicContact CB-CD2 4.29Å
646	S	81.8	Confident	72.3	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	30%	0.296	C	S	.	.	H	α-helix	trans	-68.8	-44.3	179.8	74.8	0	0	0	0	112.2	I642 K643 T649 G650 I652	I642-S646 WeakPolarHBondContact O-CB 3.45Å; I642-S646 PolarHBondContact O-N 3.01Å; I642-S646 PolarHBondContact O-OG 3.14Å; K643-S646 PolarHBondContact O-N 3.18Å; K643-S646 PolarHBondContact O-OG 3.23Å; S646-T649 PolarHBondContact O-N 2.83Å; S646-G650 PolarHBondContact O-N 3.27Å; S646-I652 VanDerWaalsContact OG-CD1 3.29Å; S646-I652 WeakPolarHBondContact OG-CD1 3.34Å
647	E	80.3	Confident	69.6	Low	111 Å²	111	65.1 Å²	65.1	52%	0.519	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-47.1	175.4	-69.8	172.5	-177.9	0	0	111.1	K643 T649 G650	K643-E647 WeakPolarHBondContact CE-OE1 3.48Å; K643-E647 WeakPolarHBondContact CG-OE1 3.3Å; K643-E647 WeakPolarHBondContact O-CG 3.41Å; K643-E647 PolarHBondContact O-N 3.36Å; E647-T649 PolarHBondContact O-N 3.36Å; E647-G650 PolarHBondContact O-N 3.04Å
648	A	73.7	Confident	67	Low	6 Å²	6	72.8 Å²	72.8	5%	0.05	36%	0.362	C	S	.	.	H	α-helix	trans	-61.1	-27.9	178.5	0	0	0	0	0	113.5	M644 G650 I672	M644-A648 WeakPolarHBondContact O-CB 3.46Å; M644-A648 PolarHBondContact O-N 3.18Å; A648-G650 VanDerWaalsContact C-N 3.35Å; A648-I672 HydrophobicContact CB-CD1 4.07Å
649	T	69.4	Low	64.2	Low	10 Å²	10	80.4 Å²	80.4	6%	0.061	40%	0.402	C	S	.	.	H	α-helix	trans	-80.8	-17.8	178	-50.5	0	0	0	0	111.9	K645 S646 E647 L651 L769 L773 V794	K645-T649 PolarHBondContact O-N 2.98Å; K645-T649 PolarHBondContact O-OG1 3.1Å; S646-T649 PolarHBondContact O-N 2.83Å; E647-T649 PolarHBondContact O-N 3.36Å; T649-L651 HydrophobicContact CG2-CD1 3.85Å; T649-L651 HydrophobicContact CG2-CG 4.03Å; T649-L769 HydrophobicContact CG2-CD2 4.35Å; T649-L773 HydrophobicContact CG2-CD1 3.84Å; T649-V794 HydrophobicContact CG2-CG1 4.04Å; T649-V794 HydrophobicContact CG2-CG2 3.86Å
650	G	63.7	Low	61.6	Low	37 Å²	37	88.1 Å²	88.1	38%	0.381	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	17.6	179.3	0	0	0	0	0	114.9	S646 E647 A648 I652	S646-G650 PolarHBondContact O-N 3.27Å; E647-G650 PolarHBondContact O-N 3.04Å; A648-G650 VanDerWaalsContact C-N 3.35Å; G650-I652 VanDerWaalsContact C-N 3.29Å; G650-I652 PolarHBondContact O-N 3.21Å
651	L	54.9	Low	59.1	Low	100 Å²	100	95.6 Å²	95.6	52%	0.524	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-8.9	179.8	-72.3	167.2	0	0	0	113.6	T649 V794	T649-L651 HydrophobicContact CG2-CD1 3.85Å; T649-L651 HydrophobicContact CG2-CG 4.03Å; L651-V794 HydrophobicContact CD1-CG1 4.38Å
652	I	44.4	Very low	56.4	Low	81 Å²	81	101.9 Å²	101.9	42%	0.415	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	44.2	-177.8	-43.4	-180	0	0	0	110.6	S646 G650 A803	S646-I652 VanDerWaalsContact OG-CD1 3.29Å; S646-I652 WeakPolarHBondContact OG-CD1 3.34Å; G650-I652 VanDerWaalsContact C-N 3.29Å; G650-I652 PolarHBondContact O-N 3.21Å; I652-A803 HydrophobicContact CD1-CB 3.99Å
653	K	43.2	Very low	54	Low	189 Å²	189	110 Å²	110	82%	0.822	55%	0.548	S	S	*	.			trans	-92.8	86.7	154.5	-71.9	-166	176	-166.3	0	106.5
654	Q	35.7	Very low	51.7	Low	163 Å²	163	113.3 Å²	113.3	76%	0.762	57%	0.569	S	S	*	*			trans	-56.8	148.1	162.2	-81.8	176.5	-22.1	0	0	108.7	H656	Q654-H656 PolarHBondContact O-N 3.33Å
655	D	36.9	Very low	49.5	Very low	165 Å²	165	118.8 Å²	118.8	88%	0.882	60%	0.598	S	S	*	*			trans	-55	62.3	-173.1	-57.6	-61.5	0	0	0	115.3	E657	D655-E657 PolarHBondContact O-N 3.33Å
656	H	35.5	Very low	47.5	Very low	185 Å²	185	122.9 Å²	122.9	86%	0.856	62%	0.621	S	S	*	*			trans	-81.6	97.4	158.9	-91.9	-69.5	0	0	0	108.2	Q654	Q654-H656 PolarHBondContact O-N 3.33Å
657	E	37.9	Very low	45.5	Very low	172 Å²	172	132.4 Å²	132.4	80%	0.804	66%	0.662	S	S	*	*			trans	-3	117.6	160.8	-64	176.9	153	0	0	115.7	D655 D659	D655-E657 PolarHBondContact O-N 3.33Å; E657-D659 PolarHBondContact O-N 3.38Å
658	L	36.6	Very low	43.7	Very low	161 Å²	161	130.1 Å²	130.1	84%	0.843	67%	0.668	S	S	*	*			trans	6.5	74	148.4	-61.6	168.5	0	0	0	117.5
659	D	34.8	Very low	42.6	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	69%	0.685	S	S	*	*			trans	-108.9	80.7	150.1	-85.2	-27.4	0	0	0	108.4	E657 F661	E657-D659 PolarHBondContact O-N 3.38Å; D659-F661 PolarHBondContact O-N 2.73Å; D659-F661 VanDerWaalsContact O-N 3.09Å
660	E	38	Very low	42.1	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	70%	0.703	S	S	*	*			trans	-63.8	97	158.2	-73.7	-174.9	158.4	0	0	107.2
661	F	39.7	Very low	42.6	Very low	199 Å²	199	136.2 Å²	136.2	87%	0.873	70%	0.698	S	S	*	*			trans	167.4	73.2	152	-87.1	-64.7	0	0	0	109.2	D659	D659-F661 PolarHBondContact O-N 2.73Å; D659-F661 VanDerWaalsContact O-N 3.09Å
662	D	34.4	Very low	43.9	Very low	131 Å²	131	132.3 Å²	132.3	70%	0.701	68%	0.677	S	S	*	*			trans	-165.9	98.5	151.7	-108.8	-20.2	0	0	0	111.7	D664	D662-D664 VanDerWaalsContact C-N 3.32Å
663	N	38.2	Very low	45.5	Very low	172 Å²	172	131.9 Å²	131.9	92%	0.92	67%	0.672	S	S	*	*			trans	-87.1	9.7	-180	-97.2	-33.6	0	0	0	114
664	D	38.8	Very low	47.3	Very low	134 Å²	134	128.7 Å²	128.7	72%	0.717	66%	0.655	S	S	*	*			trans	-111.2	6.2	-172.2	-94.5	-25	0	0	0	116.2	D662 D666	D662-D664 VanDerWaalsContact C-N 3.32Å; D664-D666 PolarHBondContact O-N 3.05Å
665	N	36.8	Very low	49.8	Very low	132 Å²	132	121.1 Å²	121.1	71%	0.706	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-85.7	10.8	-176.5	-82.4	-29.1	0	0	0	116.7	K667	N665-K667 PolarHBondContact O-N 2.94Å; N665-K667 VanDerWaalsContact O-N 3.09Å
666	D	43	Very low	52.2	Low	104 Å²	104	113.5 Å²	113.5	56%	0.556	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-73.9	3.2	177.8	-138.2	26.5	0	0	0	113.2	D664 G668 R770	D664-D666 PolarHBondContact O-N 3.05Å; D666-G668 VanDerWaalsContact C-N 3.34Å; D666-G668 PolarHBondContact O-N 3.09Å; D666-R770 IonicContact OD1-NH2 2.85Å; D666-R770 PolarHBondContact OD1-NH2 3.32Å
667	K	39.1	Very low	54.4	Low	201 Å²	201	110.2 Å²	110.2	87%	0.874	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-76.8	-9.7	178.4	-73.8	-177.5	179.3	170.8	0	115	N665	N665-K667 PolarHBondContact O-N 2.94Å; N665-K667 VanDerWaalsContact O-N 3.09Å
668	G	42.8	Very low	56.7	Low	63 Å²	63	108 Å²	108	65%	0.649	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-98.3	-11.6	-173.8	0	0	0	0	0	117	D666 T670	D666-G668 VanDerWaalsContact C-N 3.34Å; D666-G668 PolarHBondContact O-N 3.09Å; G668-T670 PolarHBondContact O-N 2.9Å
669	C	50.6	Low	59	Low	59 Å²	59	100.8 Å²	100.8	40%	0.399	51%	0.505	S	S	.	.			trans	-77	101.8	-174.3	-167.5	0	0	0	0	110.7	N671	C669-N671 PolarHBondContact O-N 2.92Å; C669-N671 VanDerWaalsContact O-N 3.17Å
670	T	58.4	Low	61.3	Low	72 Å²	72	93.3 Å²	93.3	44%	0.442	47%	0.467	S	S	.	.			trans	-52.8	121.7	174.9	-36.1	0	0	0	0	109.8	G668 I672	G668-T670 PolarHBondContact O-N 2.9Å; T670-I672 PolarHBondContact O-N 3.46Å
671	N	74.8	Confident	63.7	Low	50 Å²	50	85.9 Å²	85.9	27%	0.267	43%	0.434	S	S	.	.			trans	-64.9	111.8	177.9	-178.2	-24.4	0	0	0	109.2	C669 K673 R674 W675	C669-N671 PolarHBondContact O-N 2.92Å; C669-N671 VanDerWaalsContact O-N 3.17Å; N671-K673 PolarHBondContact O-N 3.08Å; N671-K673 WeakPolarHBondContact OD1-CB 3.14Å; N671-K673 PolarHBondContact OD1-N 3.17Å; N671-K673 VanDerWaalsContact OD1-N 3.09Å; N671-R674 HydrophobicContact CB-CB 4.03Å; N671-R674 WeakPolarHBondContact O-CA 3.43Å; N671-R674 WeakPolarHBondContact O-CB 3.27Å; N671-R674 PolarHBondContact O-N 3.38Å; N671-W675 PolarHBondContact O-N 3.48Å
672	I	82	Confident	65.8	Low	17 Å²	17	78.9 Å²	78.9	9%	0.087	40%	0.404	C	S	.	.	H	α-helix	trans	-57	-35.6	-174.3	-61.8	162.9	0	0	0	112.1	M644 K645 A648 T670 W675 C676	M644-I672 HydrophobicContact CB-CD1 4.43Å; M644-I672 HydrophobicContact CB-CG1 4.1Å; K645-I672 HydrophobicContact CD-CD1 3.59Å; K645-I672 HydrophobicContact CG-CD1 3.91Å; A648-I672 HydrophobicContact CB-CD1 4.07Å; T670-I672 PolarHBondContact O-N 3.46Å; I672-W675 PolarHBondContact O-N 2.84Å; I672-C676 PolarHBondContact O-N 3.14Å; I672-C676 PolarHBondContact O-SG 2.76Å; I672-C676 VanDerWaalsContact O-SG 3.39Å
673	K	79.4	Confident	68.1	Low	73 Å²	73	74.3 Å²	74.3	32%	0.317	38%	0.378	S	S	.	.	H	α-helix	trans	-65.6	-41	175.9	-72.3	175	173.7	169	0	111.5	N671 W675 C676 R677 D765	N671-K673 PolarHBondContact O-N 3.08Å; N671-K673 WeakPolarHBondContact OD1-CB 3.14Å; N671-K673 PolarHBondContact OD1-N 3.17Å; N671-K673 VanDerWaalsContact OD1-N 3.09Å; K673-W675 VanDerWaalsContact C-N 3.35Å; K673-C676 PolarHBondContact O-N 3.35Å; K673-R677 WeakPolarHBondContact O-CG 3.2Å; K673-R677 PolarHBondContact O-N 2.98Å; K673-D765 WeakPolarHBondContact CE-OD2 3.31Å; K673-D765 IonicContact NZ-OD2 2.72Å; K673-D765 PolarHBondContact NZ-OD2 3.14Å
674	R	80.5	Confident	70.1	Confident	121 Å²	121	67.7 Å²	67.7	46%	0.457	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-39.8	176.5	-170.9	179.5	-70.4	133.1	-2.6	110.8	N671 R677 R678	N671-R674 HydrophobicContact CB-CB 4.03Å; N671-R674 WeakPolarHBondContact O-CA 3.43Å; N671-R674 WeakPolarHBondContact O-CB 3.27Å; N671-R674 PolarHBondContact O-N 3.38Å; R674-R677 PolarHBondContact O-N 3.32Å; R674-R678 WeakPolarHBondContact O-CB 3.37Å; R674-R678 PolarHBondContact O-N 3.18Å
675	W	87.7	Confident	72.3	Confident	5 Å²	5	62.5 Å²	62.5	2%	0.019	31%	0.312	C	S	.	.	H	α-helix	trans	-61.2	-51.3	172.9	176.4	89.6	0	0	0	111.5	Y624 V637 E640 W641 M644 N671 I672 K673 R677 R678 I679	Y624-W675 HydrophobicContact CE2-CZ2 4.18Å; Y624-W675 AromaticContact CZ-NE1 3.75Å; Y624-W675 PolarHBondContact OH-NE1 3.47Å; V637-W675 HydrophobicContact CG1-CH2 3.81Å; V637-W675 WeakPolarHBondContact O-CH2 3.23Å; E640-W675 HydrophobicContact CB-CZ2 4.26Å; E640-W675 HydrophobicContact CG-CZ2 4.08Å; W641-W675 HydrophobicContact CB-CH2 3.94Å; W641-W675 HydrophobicContact CB-CZ3 3.83Å; W641-W675 AromaticContact CD1-CZ3 3.84Å; W641-W675 HydrophobicContact CG-CZ3 4.22Å; M644-W675 HydrophobicContact CE-CD2 3.21Å; M644-W675 HydrophobicContact CE-CE3 3.44Å; M644-W675 VanDerWaalsContact CE-CE3 3.44Å; M644-W675 HydrophobicContact CE-CG 3.74Å; M644-W675 HydrophobicContact CE-CH2 3.7Å; M644-W675 HydrophobicContact CE-CZ2 3.51Å; M644-W675 HydrophobicContact CE-CZ3 3.69Å; M644-W675 HydrophobicContact SD-CB 4.25Å; M644-W675 HydrophobicContact SD-CD2 4Å; M644-W675 HydrophobicContact SD-CE3 4.5Å; M644-W675 HydrophobicContact SD-CG 3.86Å; N671-W675 PolarHBondContact O-N 3.48Å; I672-W675 PolarHBondContact O-N 2.84Å; K673-W675 VanDerWaalsContact C-N 3.35Å; W675-R677 VanDerWaalsContact C-N 3.28Å; W675-R677 PolarHBondContact O-N 3.46Å; W675-R678 WeakPolarHBondContact O-CB 3.16Å; W675-R678 PolarHBondContact O-N 2.93Å; W675-I679 HydrophobicContact CD2-CD1 4.21Å; W675-I679 HydrophobicContact CD2-CG1 4.47Å; W675-I679 HydrophobicContact CE3-CD1 4.08Å; W675-I679 HydrophobicContact CE3-CG1 4.49Å; W675-I679 HydrophobicContact CH2-CD1 3.38Å; W675-I679 HydrophobicContact CZ2-CD1 3.49Å; W675-I679 VanDerWaalsContact CZ2-CD1 3.49Å; W675-I679 HydrophobicContact CZ2-CG1 4.49Å; W675-I679 HydrophobicContact CZ3-CD1 3.68Å; W675-I679 WeakPolarHBondContact O-CG1 3.5Å; W675-I679 PolarHBondContact O-N 2.84Å; W675-I679 VanDerWaalsContact O-N 3.13Å
676	C	87.5	Confident	74.9	Confident	4 Å²	4	56.2 Å²	56.2	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-55.2	-42.2	176.9	-74.7	0	0	0	0	112.2	I672 K673 G680 A681	I672-C676 PolarHBondContact O-N 3.14Å; I672-C676 PolarHBondContact O-SG 2.76Å; I672-C676 VanDerWaalsContact O-SG 3.39Å; K673-C676 PolarHBondContact O-N 3.35Å; C676-G680 CarbonylContact O-C 3.55Å; C676-G680 PolarHBondContact O-N 2.91Å; C676-A681 WeakPolarHBondContact CB-O 3.43Å; C676-A681 PolarHBondContact O-N 2.82Å
677	R	81.7	Confident	76.9	Confident	117 Å²	117	51.6 Å²	51.6	44%	0.442	25%	0.254	S	S	.	.	H	α-helix	trans	-64	-42.5	175.8	-71.4	174.7	-159.3	174.8	1.9	112.6	R617 K673 R674 W675 I679 G680 E754	R617-R677 PolarHBondContact NE-O 3.21Å; K673-R677 WeakPolarHBondContact O-CG 3.2Å; K673-R677 PolarHBondContact O-N 2.98Å; R674-R677 PolarHBondContact O-N 3.32Å; W675-R677 VanDerWaalsContact C-N 3.28Å; W675-R677 PolarHBondContact O-N 3.46Å; R677-I679 VanDerWaalsContact C-N 3.34Å; R677-I679 PolarHBondContact O-N 2.86Å; R677-G680 PolarHBondContact O-N 3.38Å; R677-E754 IonicContact CZ-OE2 3.27Å; R677-E754 IonicContact NH1-OE2 2.7Å; R677-E754 PolarHBondContact NH1-OE2 3.35Å; R677-E754 IonicContact NH2-OE2 3.29Å; R677-E754 PolarHBondContact NH2-OE2 3Å
678	R	85.2	Confident	79.1	Confident	126 Å²	126	42.9 Å²	42.9	48%	0.475	22%	0.216	S	C	.	.	H	α-helix	trans	-60.2	-42.4	-179.1	-170.3	-168.2	-58.7	151.8	-0.8	111.9	A620 R674 W675	A620-R678 HydrophobicContact CB-CG 3.97Å; R674-R678 WeakPolarHBondContact O-CB 3.37Å; R674-R678 PolarHBondContact O-N 3.18Å; W675-R678 WeakPolarHBondContact O-CB 3.16Å; W675-R678 PolarHBondContact O-N 2.93Å
679	I	85.9	Confident	81.3	Confident	8 Å²	8	39.9 Å²	39.9	4%	0.041	19%	0.185	C	C	.	.	H	α-helix	trans	-90.4	-5.1	179.3	65	160.7	0	0	0	113.5	A620 Y624 V637 W675 R677 A681	A620-I679 HydrophobicContact CB-CG2 4.23Å; Y624-I679 HydrophobicContact CD2-CG2 4.39Å; Y624-I679 HydrophobicContact CE2-CG2 3.93Å; V637-I679 HydrophobicContact CG1-CD1 3.64Å; W675-I679 HydrophobicContact CD2-CD1 4.21Å; W675-I679 HydrophobicContact CD2-CG1 4.47Å; W675-I679 HydrophobicContact CE3-CD1 4.08Å; W675-I679 HydrophobicContact CE3-CG1 4.49Å; W675-I679 HydrophobicContact CH2-CD1 3.38Å; W675-I679 HydrophobicContact CZ2-CD1 3.49Å; W675-I679 VanDerWaalsContact CZ2-CD1 3.49Å; W675-I679 HydrophobicContact CZ2-CG1 4.49Å; W675-I679 HydrophobicContact CZ3-CD1 3.68Å; W675-I679 WeakPolarHBondContact O-CG1 3.5Å; W675-I679 PolarHBondContact O-N 2.84Å; W675-I679 VanDerWaalsContact O-N 3.13Å; R677-I679 VanDerWaalsContact C-N 3.34Å; R677-I679 PolarHBondContact O-N 2.86Å; I679-A681 HydrophobicContact CD1-CB 3.56Å; I679-A681 HydrophobicContact CG1-CB 3.74Å
680	G	83.5	Confident	83.2	Confident	6 Å²	6	37.2 Å²	37.2	6%	0.062	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	24.5	-176.2	0	0	0	0	0	115	L604 C676 R677	L604-G680 WeakPolarHBondContact CB-O 3.46Å; L604-G680 WeakPolarHBondContact CG-O 3.28Å; L604-G680 PolarHBondContact N-O 2.97Å; C676-G680 CarbonylContact O-C 3.55Å; C676-G680 PolarHBondContact O-N 2.91Å; R677-G680 PolarHBondContact O-N 3.38Å
681	A	87	Confident	84.5	Confident	9 Å²	9	35.2 Å²	35.2	7%	0.074	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-87.9	135.3	177.9	0	0	0	0	0	112.5	P602 L603 C676 I679 Q683	P602-A681 CarbonylContact O-C 3.59Å; P602-A681 WeakPolarHBondContact O-CA 3.32Å; L603-A681 HydrophobicContact CD2-CB 3.97Å; C676-A681 WeakPolarHBondContact CB-O 3.43Å; C676-A681 PolarHBondContact O-N 2.82Å; I679-A681 HydrophobicContact CD1-CB 3.56Å; I679-A681 HydrophobicContact CG1-CB 3.74Å; A681-Q683 PolarHBondContact O-N 3.5Å
682	Q	84	Confident	85	Confident	53 Å²	53	33 Å²	33	25%	0.248	14%	0.139	C	C	.	.			trans	-85.5	105.8	173.1	-65.2	-171.2	-24.5	0	0	110.8	P602 L604 Q684 R685 L686	P602-Q682 PolarHBondContact O-N 2.9Å; L604-Q682 HydrophobicContact CD1-CG 4.27Å; L604-Q682 HydrophobicContact CD2-CG 4.22Å; L604-Q682 HydrophobicContact CG-CG 4.04Å; Q682-Q684 PolarHBondContact O-N 3.18Å; Q682-Q684 VanDerWaalsContact O-N 3.15Å; Q682-R685 HydrophobicContact CB-CB 4.32Å; Q682-R685 HydrophobicContact CB-CG 3.84Å; Q682-R685 WeakPolarHBondContact O-CB 3.4Å; Q682-R685 PolarHBondContact O-N 2.93Å; Q682-L686 PolarHBondContact O-N 3.34Å
683	Q	84.2	Confident	85.4	Confident	35 Å²	35	33.4 Å²	33.4	16%	0.164	14%	0.14	C	C	.	.	H	α-helix	trans	-54.7	-36.9	-178.7	-168.8	-173.1	-22.4	0	0	113.3	W641 K645 A681 R685 L686 H687	W641-Q683 HydrophobicContact CZ2-CG 4.03Å; K645-Q683 VanDerWaalsContact NZ-NE2 3.13Å; A681-Q683 PolarHBondContact O-N 3.5Å; Q683-R685 VanDerWaalsContact C-N 3.26Å; Q683-R685 PolarHBondContact O-N 3.16Å; Q683-L686 PolarHBondContact O-N 2.94Å; Q683-H687 PolarHBondContact NE2-NE2 3.39Å; Q683-H687 VanDerWaalsContact NE2-NE2 3.17Å; Q683-H687 PolarHBondContact O-CD2 2.95Å; Q683-H687 PolarHBondContact O-N 3.25Å; Q683-H687 VanDerWaalsContact O-N 3.11Å
684	Q	79.2	Confident	85.8	Confident	32 Å²	32	32.1 Å²	32.1	15%	0.15	14%	0.14	C	C	.	.	H	α-helix	trans	-56.6	-41.8	176.7	178.9	-176.6	-30.5	0	0	111.8	Q682 L686 H687 E688	Q682-Q684 PolarHBondContact O-N 3.18Å; Q682-Q684 VanDerWaalsContact O-N 3.15Å; Q684-L686 VanDerWaalsContact C-N 3.33Å; Q684-L686 PolarHBondContact O-N 3.4Å; Q684-H687 WeakPolarHBondContact O-CB 3.42Å; Q684-H687 PolarHBondContact O-N 3.17Å; Q684-E688 PolarHBondContact NE2-OE1 3.42Å; Q684-E688 PolarHBondContact O-N 2.8Å
685	R	85.7	Confident	85.8	Confident	26 Å²	26	29.4 Å²	29.4	10%	0.098	13%	0.132	C	C	.	.	H	α-helix	trans	-69.7	-33.2	-177.5	-58.9	-61.7	-177.3	-178	4	111.4	A398 I599 P602 Q682 Q683 E688 M689	A398-R685 PolarHBondContact O-NH2 2.84Å; I599-R685 HydrophobicContact CD1-CB 4.36Å; I599-R685 WeakPolarHBondContact CD1-O 3.38Å; P602-R685 HydrophobicContact CB-CB 3.76Å; P602-R685 HydrophobicContact CG-CB 3.72Å; Q682-R685 HydrophobicContact CB-CB 4.32Å; Q682-R685 HydrophobicContact CB-CG 3.84Å; Q682-R685 WeakPolarHBondContact O-CB 3.4Å; Q682-R685 PolarHBondContact O-N 2.93Å; Q683-R685 VanDerWaalsContact C-N 3.26Å; Q683-R685 PolarHBondContact O-N 3.16Å; R685-E688 WeakPolarHBondContact CD-OE2 3.46Å; R685-E688 IonicContact CZ-OE2 3.54Å; R685-E688 IonicContact NH1-OE1 3.63Å; R685-E688 IonicContact NH1-OE2 4Å; R685-E688 PolarHBondContact NH1-OE2 2.72Å; R685-E688 WeakPolarHBondContact O-CB 3.28Å; R685-E688 PolarHBondContact O-N 3.32Å; R685-M689 PolarHBondContact O-N 2.91Å
686	L	90	Very high	85.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.8	-39.6	171.4	-59.2	172.9	0	0	0	111.7	P602 F638 W641 Q682 Q683 Q684 E688 M689 V690	P602-L686 HydrophobicContact CB-CD2 3.97Å; P602-L686 HydrophobicContact CB-CG 4.34Å; P602-L686 HydrophobicContact CG-CD2 4.14Å; F638-L686 HydrophobicContact CB-CD2 4.5Å; F638-L686 HydrophobicContact CD2-CD2 4.15Å; W641-L686 HydrophobicContact CB-CD1 4.04Å; W641-L686 HydrophobicContact CD2-CB 3.91Å; W641-L686 HydrophobicContact CD2-CD1 3.77Å; W641-L686 HydrophobicContact CD2-CG 4.42Å; W641-L686 HydrophobicContact CE3-CB 3.83Å; W641-L686 HydrophobicContact CE3-CD1 4.4Å; W641-L686 HydrophobicContact CG-CD1 3.57Å; W641-L686 HydrophobicContact CH2-CB 4.02Å; W641-L686 HydrophobicContact CZ2-CB 4.1Å; W641-L686 HydrophobicContact CZ3-CB 3.88Å; Q682-L686 PolarHBondContact O-N 3.34Å; Q683-L686 PolarHBondContact O-N 2.94Å; Q684-L686 VanDerWaalsContact C-N 3.33Å; Q684-L686 PolarHBondContact O-N 3.4Å; L686-E688 VanDerWaalsContact C-N 3.34Å; L686-E688 PolarHBondContact O-N 2.92Å; L686-M689 WeakPolarHBondContact O-CB 3.37Å; L686-M689 PolarHBondContact O-N 2.79Å; L686-V690 PolarHBondContact O-N 3Å
687	H	86.6	Confident	85.9	Confident	7 Å²	7	29.9 Å²	29.9	3%	0.032	14%	0.137	C	C	.	.	H	α-helix	trans	-64	-37.3	170.9	-73.8	-78.9	0	0	0	112.5	W641 Q683 Q684 M689 V690 R691 D790	W641-H687 AromaticContact CH2-CE1 3.82Å; W641-H687 AromaticContact CH2-CG 3.96Å; W641-H687 AromaticContact CH2-ND1 3.79Å; W641-H687 AromaticContact CZ2-CD2 3.95Å; W641-H687 AromaticContact CZ2-CE1 3.84Å; W641-H687 AromaticContact CZ2-NE2 3.65Å; Q683-H687 PolarHBondContact NE2-NE2 3.39Å; Q683-H687 VanDerWaalsContact NE2-NE2 3.17Å; Q683-H687 PolarHBondContact O-CD2 2.95Å; Q683-H687 PolarHBondContact O-N 3.25Å; Q683-H687 VanDerWaalsContact O-N 3.11Å; Q684-H687 WeakPolarHBondContact O-CB 3.42Å; Q684-H687 PolarHBondContact O-N 3.17Å; H687-M689 VanDerWaalsContact C-N 3.32Å; H687-V690 PolarHBondContact O-N 3.23Å; H687-R691 WeakPolarHBondContact O-CG 3.29Å; H687-R691 PolarHBondContact O-N 3.47Å; H687-R691 VanDerWaalsContact O-N 3.15Å; H687-D790 IonicContact CE1-OD1 3.63Å; H687-D790 PolarHBondContact CE1-OD1 2.79Å; H687-D790 VanDerWaalsContact CE1-OD1 3.29Å; H687-D790 IonicContact NE2-OD1 3.06Å; H687-D790 PolarHBondContact NE2-OD1 3.02Å
688	E	83.7	Confident	85.9	Confident	18 Å²	18	28.7 Å²	28.7	8%	0.084	14%	0.137	C	C	.	.	H	α-helix	trans	-63.2	-39.1	172.9	-70.8	173.7	-175.4	0	0	111.5	I599 Q684 R685 L686 R691 L692	I599-E688 HydrophobicContact CG2-CB 4.47Å; Q684-E688 PolarHBondContact NE2-OE1 3.42Å; Q684-E688 PolarHBondContact O-N 2.8Å; R685-E688 WeakPolarHBondContact CD-OE2 3.46Å; R685-E688 IonicContact CZ-OE2 3.54Å; R685-E688 IonicContact NH1-OE1 3.63Å; R685-E688 IonicContact NH1-OE2 4Å; R685-E688 PolarHBondContact NH1-OE2 2.72Å; R685-E688 WeakPolarHBondContact O-CB 3.28Å; R685-E688 PolarHBondContact O-N 3.32Å; L686-E688 VanDerWaalsContact C-N 3.34Å; L686-E688 PolarHBondContact O-N 2.92Å; E688-R691 WeakPolarHBondContact O-CB 3.44Å; E688-R691 PolarHBondContact O-N 2.81Å; E688-L692 PolarHBondContact O-N 2.81Å
689	M	89.5	Confident	85.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-45	174.9	-163.6	172.4	164.3	0	0	111.8	S592 A595 I599 V635 F638 R685 L686 H687 R691 L692 R693	S592-M689 WeakPolarHBondContact O-CE 3.48Å; A595-M689 HydrophobicContact CB-CG 3.77Å; I599-M689 HydrophobicContact CD1-CB 3.86Å; I599-M689 HydrophobicContact CD1-CG 4.3Å; V635-M689 HydrophobicContact CG2-CE 4.23Å; F638-M689 HydrophobicContact CB-CE 3.67Å; F638-M689 HydrophobicContact CB-SD 3.86Å; F638-M689 HydrophobicContact CD1-CE 3.79Å; F638-M689 HydrophobicContact CD1-SD 4.38Å; F638-M689 HydrophobicContact CD2-CB 4.15Å; F638-M689 HydrophobicContact CD2-CE 3.93Å; F638-M689 HydrophobicContact CD2-CG 3.98Å; F638-M689 HydrophobicContact CD2-SD 3.41Å; F638-M689 WeakPolarHBondContact CD2-SD 3.26Å; F638-M689 HydrophobicContact CE1-CE 4.39Å; F638-M689 HydrophobicContact CE2-CB 3.91Å; F638-M689 HydrophobicContact CE2-CG 3.93Å; F638-M689 HydrophobicContact CE2-SD 4Å; F638-M689 HydrophobicContact CG-CE 3.51Å; F638-M689 HydrophobicContact CG-SD 3.63Å; F638-M689 HydrophobicContact CZ-CG 4.41Å; R685-M689 PolarHBondContact O-N 2.91Å; L686-M689 WeakPolarHBondContact O-CB 3.37Å; L686-M689 PolarHBondContact O-N 2.79Å; H687-M689 VanDerWaalsContact C-N 3.32Å; M689-R691 VanDerWaalsContact C-N 3.34Å; M689-R691 PolarHBondContact O-N 3.19Å; M689-L692 PolarHBondContact O-N 3.23Å; M689-R693 WeakPolarHBondContact O-CB 3.35Å; M689-R693 PolarHBondContact O-N 2.94Å
690	V	90.6	Very high	85.6	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.018	12%	0.117	C	C	.	.	H	α-helix	trans	-58.6	-45.8	173.9	178.4	0	0	0	0	111.5	F638 W641 I642 L686 H687 L692 R693 S694 L793 Y797 L802	F638-V690 HydrophobicContact CE2-CG2 3.67Å; F638-V690 HydrophobicContact CZ-CG2 3.77Å; W641-V690 HydrophobicContact CH2-CG2 4.4Å; W641-V690 HydrophobicContact CZ3-CG2 3.78Å; I642-V690 HydrophobicContact CD1-CG2 3.93Å; L686-V690 PolarHBondContact O-N 3Å; H687-V690 PolarHBondContact O-N 3.23Å; V690-L692 VanDerWaalsContact C-N 3.33Å; V690-L692 PolarHBondContact O-N 3.48Å; V690-R693 PolarHBondContact O-N 3.06Å; V690-S694 WeakPolarHBondContact O-CB 3.16Å; V690-S694 PolarHBondContact O-N 2.64Å; V690-L793 HydrophobicContact CB-CD1 4.36Å; V690-L793 HydrophobicContact CG1-CD1 3.88Å; V690-L793 HydrophobicContact CG2-CD1 3.92Å; V690-Y797 HydrophobicContact CG1-CD1 4Å; V690-Y797 HydrophobicContact CG1-CD2 3.92Å; V690-Y797 HydrophobicContact CG1-CE1 4.36Å; V690-Y797 HydrophobicContact CG1-CE2 4.26Å; V690-Y797 HydrophobicContact CG1-CG 3.77Å; V690-L802 HydrophobicContact CG1-CD1 4.16Å
691	R	85.7	Confident	85.5	Confident	30 Å²	30	25.7 Å²	25.7	11%	0.113	13%	0.126	C	C	.	.	H	α-helix	trans	-61.2	-43	179	-72	169.6	175.6	175.4	0	111	F224 H687 E688 M689 Q695 E792 Y797	F224-R691 HydrophobicContact CD1-CB 4.13Å; H687-R691 WeakPolarHBondContact O-CG 3.29Å; H687-R691 PolarHBondContact O-N 3.47Å; H687-R691 VanDerWaalsContact O-N 3.15Å; E688-R691 WeakPolarHBondContact O-CB 3.44Å; E688-R691 PolarHBondContact O-N 2.81Å; M689-R691 VanDerWaalsContact C-N 3.34Å; M689-R691 PolarHBondContact O-N 3.19Å; R691-Q695 WeakPolarHBondContact O-CB 3.3Å; R691-Q695 VanDerWaalsContact O-CG 3.31Å; R691-Q695 WeakPolarHBondContact O-CG 3.43Å; R691-Q695 PolarHBondContact O-N 2.99Å; R691-E792 IonicContact CZ-OE2 3.83Å; R691-E792 IonicContact NE-OE2 3.16Å; R691-E792 IonicContact NH2-OE2 3.86Å; R691-E792 PolarHBondContact NH2-OE2 2.54Å; R691-Y797 WeakPolarHBondContact CG-OH 3.32Å
692	L	85.5	Confident	84.9	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-67.5	-47.7	177.4	-88.6	167.8	0	0	0	112.5	F224 A595 A598 I599 E688 M689 V690 S694 Q695 F696	F224-L692 HydrophobicContact CE1-CD2 3.52Å; F224-L692 HydrophobicContact CE1-CG 3.55Å; F224-L692 HydrophobicContact CZ-CD1 4.08Å; F224-L692 HydrophobicContact CZ-CD2 3.43Å; F224-L692 VanDerWaalsContact CZ-CD2 3.43Å; F224-L692 HydrophobicContact CZ-CG 3.53Å; A595-L692 HydrophobicContact CB-CB 3.87Å; A598-L692 HydrophobicContact CB-CD1 4.24Å; I599-L692 HydrophobicContact CG2-CD1 3.12Å; E688-L692 PolarHBondContact O-N 2.81Å; M689-L692 PolarHBondContact O-N 3.23Å; V690-L692 VanDerWaalsContact C-N 3.33Å; V690-L692 PolarHBondContact O-N 3.48Å; L692-S694 VanDerWaalsContact C-N 3.27Å; L692-S694 PolarHBondContact O-N 2.88Å; L692-Q695 CarbonylContact O-C 3.2Å; L692-Q695 WeakPolarHBondContact O-CA 3.28Å; L692-Q695 WeakPolarHBondContact O-CB 3.23Å; L692-Q695 PolarHBondContact O-N 2.63Å; L692-F696 HydrophobicContact CB-CZ 4.5Å; L692-F696 HydrophobicContact CD2-CE1 3.66Å; L692-F696 HydrophobicContact CD2-CE2 4.45Å; L692-F696 HydrophobicContact CD2-CZ 3.66Å; L692-F696 VanDerWaalsContact O-CG 3.3Å; L692-F696 WeakPolarHBondContact O-CG 3.46Å; L692-F696 PolarHBondContact O-N 2.86Å
693	R	90.4	Very high	84.4	Confident	25 Å²	25	27.3 Å²	27.3	9%	0.094	14%	0.136	C	C	.	.	H	α-helix	trans	-52.4	-47.9	175.1	-171.9	-170.8	171.5	-81.9	7	110.7	L591 S592 A595 M689 V690 F696 A697 L802 S805	L591-R693 HydrophobicContact CB-CG 3.77Å; S592-R693 PolarHBondContact OG-NE 3.15Å; A595-R693 HydrophobicContact CB-CB 4.06Å; M689-R693 WeakPolarHBondContact O-CB 3.35Å; M689-R693 PolarHBondContact O-N 2.94Å; V690-R693 PolarHBondContact O-N 3.06Å; R693-F696 PolarHBondContact O-N 2.87Å; R693-A697 WeakPolarHBondContact O-CB 3.46Å; R693-A697 PolarHBondContact O-N 3.23Å; R693-L802 VanDerWaalsContact CZ-CD2 3.41Å; R693-S805 PolarHBondContact NH2-OG 3.11Å
694	S	87.1	Confident	84	Confident	45 Å²	45	26 Å²	26	32%	0.315	13%	0.131	S	C	.	.	H	α-helix	trans	-67.3	-35.2	177.1	-174.5	0	0	0	0	113.1	V690 L692 Q698 Y797	V690-S694 WeakPolarHBondContact O-CB 3.16Å; V690-S694 PolarHBondContact O-N 2.64Å; L692-S694 VanDerWaalsContact C-N 3.27Å; L692-S694 PolarHBondContact O-N 2.88Å; S694-Q698 WeakPolarHBondContact O-CB 3.47Å; S694-Q698 PolarHBondContact O-N 3.43Å; S694-Y797 VanDerWaalsContact CB-CE1 3.45Å
695	Q	81.8	Confident	83.9	Confident	65 Å²	65	24.8 Å²	24.8	30%	0.304	13%	0.126	S	C	.	.	H	α-helix	trans	-69.9	-41.2	175.8	-80.8	-177	10.4	0	0	112.1	R691 L692 A697 Q698 L699	R691-Q695 WeakPolarHBondContact O-CB 3.3Å; R691-Q695 VanDerWaalsContact O-CG 3.31Å; R691-Q695 WeakPolarHBondContact O-CG 3.43Å; R691-Q695 PolarHBondContact O-N 2.99Å; L692-Q695 CarbonylContact O-C 3.2Å; L692-Q695 WeakPolarHBondContact O-CA 3.28Å; L692-Q695 WeakPolarHBondContact O-CB 3.23Å; L692-Q695 PolarHBondContact O-N 2.63Å; Q695-A697 VanDerWaalsContact C-N 3.32Å; Q695-Q698 CarbonylContact O-C 3.56Å; Q695-Q698 PolarHBondContact O-N 3.26Å; Q695-L699 WeakPolarHBondContact O-CB 3.11Å; Q695-L699 WeakPolarHBondContact O-CG 2.94Å; Q695-L699 PolarHBondContact O-N 2.93Å
696	F	87.8	Confident	83.4	Confident	1 Å²	1	25.3 Å²	25.3	0%	0.004	13%	0.13	C	C	.	.	H	α-helix	trans	-63.1	-43.6	175.2	-65.1	-13.4	0	0	0	110.3	V570 I574 L578 L591 A594 A595 A598 L692 R693 Q698 L699 L700	V570-F696 HydrophobicContact CG1-CD1 4.05Å; V570-F696 HydrophobicContact CG1-CE1 3.18Å; V570-F696 HydrophobicContact CG1-CZ 3.55Å; I574-F696 HydrophobicContact CG2-CE2 4.34Å; I574-F696 HydrophobicContact CG2-CZ 4.47Å; L578-F696 HydrophobicContact CD1-CB 4.01Å; L578-F696 HydrophobicContact CD1-CD1 4.25Å; L578-F696 HydrophobicContact CD1-CD2 4.02Å; L578-F696 HydrophobicContact CD1-CG 3.84Å; L578-F696 HydrophobicContact CD2-CB 4.14Å; L578-F696 HydrophobicContact CD2-CD2 4.27Å; L578-F696 HydrophobicContact CD2-CG 4.47Å; L591-F696 HydrophobicContact CD2-CB 3.34Å; A594-F696 HydrophobicContact CB-CD2 4.02Å; A594-F696 HydrophobicContact CB-CE2 3.94Å; A595-F696 HydrophobicContact CB-CD2 4.49Å; A595-F696 HydrophobicContact CB-CE2 4.35Å; A598-F696 HydrophobicContact CB-CE2 4.3Å; A598-F696 HydrophobicContact CB-CZ 3.97Å; L692-F696 HydrophobicContact CB-CZ 4.5Å; L692-F696 HydrophobicContact CD2-CE1 3.66Å; L692-F696 HydrophobicContact CD2-CE2 4.45Å; L692-F696 HydrophobicContact CD2-CZ 3.66Å; L692-F696 VanDerWaalsContact O-CG 3.3Å; L692-F696 WeakPolarHBondContact O-CG 3.46Å; L692-F696 PolarHBondContact O-N 2.86Å; R693-F696 PolarHBondContact O-N 2.87Å; F696-Q698 VanDerWaalsContact C-N 3.31Å; F696-Q698 PolarHBondContact O-N 3.08Å; F696-L699 HydrophobicContact CD1-CD1 4.27Å; F696-L699 PolarHBondContact O-N 2.93Å; F696-L700 WeakPolarHBondContact O-CB 3.46Å; F696-L700 VanDerWaalsContact O-CG 3.3Å; F696-L700 WeakPolarHBondContact O-CG 3.07Å; F696-L700 PolarHBondContact O-N 3.4Å
697	A	88.1	Confident	82.2	Confident	17 Å²	17	27.5 Å²	27.5	14%	0.14	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-43.2	172.5	0	0	0	0	0	111.6	L591 R693 Q695 L700 K701	L591-A697 HydrophobicContact CD1-CB 3.82Å; L591-A697 HydrophobicContact CD2-CB 4.2Å; L591-A697 VanDerWaalsContact CD2-N 3.33Å; R693-A697 WeakPolarHBondContact O-CB 3.46Å; R693-A697 PolarHBondContact O-N 3.23Å; Q695-A697 VanDerWaalsContact C-N 3.32Å; A697-L700 PolarHBondContact O-N 2.95Å; A697-K701 VanDerWaalsContact O-CG 3.32Å; A697-K701 WeakPolarHBondContact O-CG 3.38Å; A697-K701 PolarHBondContact O-N 2.88Å
698	Q	82.2	Confident	80.8	Confident	93 Å²	93	31 Å²	31	44%	0.435	17%	0.168	S	C	.	.	H	α-helix	trans	-67.4	-39.4	177.3	-170.3	61	43.4	0	0	112.2	S694 Q695 F696 L700 K701 D702	S694-Q698 WeakPolarHBondContact O-CB 3.47Å; S694-Q698 PolarHBondContact O-N 3.43Å; Q695-Q698 CarbonylContact O-C 3.56Å; Q695-Q698 PolarHBondContact O-N 3.26Å; F696-Q698 VanDerWaalsContact C-N 3.31Å; F696-Q698 PolarHBondContact O-N 3.08Å; Q698-L700 VanDerWaalsContact C-N 3.34Å; Q698-K701 CarbonylContact O-C 3.29Å; Q698-K701 WeakPolarHBondContact O-CB 3.24Å; Q698-K701 PolarHBondContact O-N 2.78Å; Q698-K701 VanDerWaalsContact O-N 3.16Å; Q698-D702 PolarHBondContact NE2-OD1 3.02Å; Q698-D702 WeakPolarHBondContact O-CB 3.42Å; Q698-D702 PolarHBondContact O-N 3.46Å
699	L	80.2	Confident	79.3	Confident	18 Å²	18	38.1 Å²	38.1	9%	0.094	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-40.4	176.3	-73.2	165.2	0	0	0	111.1	I568 P569 Q695 F696 K701 D702 S703	I568-L699 HydrophobicContact CG2-CD1 4.04Å; P569-L699 HydrophobicContact CG-CD1 4.36Å; Q695-L699 WeakPolarHBondContact O-CB 3.11Å; Q695-L699 WeakPolarHBondContact O-CG 2.94Å; Q695-L699 PolarHBondContact O-N 2.93Å; F696-L699 HydrophobicContact CD1-CD1 4.27Å; F696-L699 PolarHBondContact O-N 2.93Å; L699-K701 VanDerWaalsContact C-N 3.31Å; L699-D702 PolarHBondContact O-N 2.94Å; L699-S703 WeakPolarHBondContact O-CB 3.45Å; L699-S703 PolarHBondContact O-N 2.77Å; L699-S703 PolarHBondContact O-OG 3.29Å; L699-S703 VanDerWaalsContact O-OG 3.09Å
700	L	84	Confident	77.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-32.1	173.2	-70	178.9	0	0	0	112.3	L578 T587 L591 F696 A697 Q698 S703 G704 L705 L706	L578-L700 HydrophobicContact CB-CD1 4.42Å; L578-L700 HydrophobicContact CB-CD2 4.24Å; L578-L700 HydrophobicContact CD2-CD1 4.36Å; T587-L700 HydrophobicContact CG2-CD1 3.45Å; T587-L700 VanDerWaalsContact CG2-CD1 3.45Å; L591-L700 HydrophobicContact CD2-CD1 4.16Å; F696-L700 WeakPolarHBondContact O-CB 3.46Å; F696-L700 VanDerWaalsContact O-CG 3.3Å; F696-L700 WeakPolarHBondContact O-CG 3.07Å; F696-L700 PolarHBondContact O-N 3.4Å; A697-L700 PolarHBondContact O-N 2.95Å; Q698-L700 VanDerWaalsContact C-N 3.34Å; L700-S703 WeakPolarHBondContact CA-OG 3.3Å; L700-S703 PolarHBondContact O-OG 3.01Å; L700-G704 PolarHBondContact O-N 2.8Å; L700-L705 HydrophobicContact CB-CB 4.45Å; L700-L705 HydrophobicContact CD2-CB 4.16Å; L700-L705 HydrophobicContact CD2-CD1 3.47Å; L700-L705 VanDerWaalsContact CD2-CD1 3.47Å; L700-L705 HydrophobicContact CD2-CG 4.42Å; L700-L705 WeakPolarHBondContact O-CA 3.41Å; L700-L705 PolarHBondContact O-N 3.2Å; L700-L706 HydrophobicContact CB-CB 4.43Å; L700-L706 HydrophobicContact CB-CD1 3.55Å; L700-L706 HydrophobicContact CB-CG 3.91Å; L700-L706 HydrophobicContact CD1-CD1 4.05Å; L700-L706 HydrophobicContact CG-CD1 4.47Å; L700-L706 PolarHBondContact O-N 3.2Å
701	K	82.2	Confident	74.9	Confident	57 Å²	57	47.4 Å²	47.4	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-71.3	-46.4	171.5	-73.8	177.9	179.7	-167.4	0	111.7	A697 Q698 L699 S703 G704 L706 T711	A697-K701 VanDerWaalsContact O-CG 3.32Å; A697-K701 WeakPolarHBondContact O-CG 3.38Å; A697-K701 PolarHBondContact O-N 2.88Å; Q698-K701 CarbonylContact O-C 3.29Å; Q698-K701 WeakPolarHBondContact O-CB 3.24Å; Q698-K701 PolarHBondContact O-N 2.78Å; Q698-K701 VanDerWaalsContact O-N 3.16Å; L699-K701 VanDerWaalsContact C-N 3.31Å; K701-S703 VanDerWaalsContact C-N 3.28Å; K701-S703 PolarHBondContact O-N 2.89Å; K701-G704 PolarHBondContact O-N 3.44Å; K701-L706 HydrophobicContact CG-CB 3.7Å; K701-L706 HydrophobicContact CG-CD1 4.29Å; K701-T711 PolarHBondContact NZ-OG1 2.91Å
702	D	74	Confident	72.4	Confident	87 Å²	87	53.7 Å²	53.7	47%	0.465	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-35.2	-179.5	-70.3	-7.9	0	0	0	111.3	Q698 L699 G704	Q698-D702 PolarHBondContact NE2-OD1 3.02Å; Q698-D702 WeakPolarHBondContact O-CB 3.42Å; Q698-D702 PolarHBondContact O-N 3.46Å; L699-D702 PolarHBondContact O-N 2.94Å; D702-G704 VanDerWaalsContact C-N 3.31Å
703	S	74.3	Confident	70.2	Confident	9 Å²	9	58.6 Å²	58.6	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-73	-26.5	173.1	62.8	0	0	0	0	112.7	L699 L700 K701 C1027	L699-S703 WeakPolarHBondContact O-CB 3.45Å; L699-S703 PolarHBondContact O-N 2.77Å; L699-S703 PolarHBondContact O-OG 3.29Å; L699-S703 VanDerWaalsContact O-OG 3.09Å; L700-S703 WeakPolarHBondContact CA-OG 3.3Å; L700-S703 PolarHBondContact O-OG 3.01Å; K701-S703 VanDerWaalsContact C-N 3.28Å; K701-S703 PolarHBondContact O-N 2.89Å; S703-C1027 PolarHBondContact O-SG 2.89Å
704	G	74.5	Confident	68	Low	7 Å²	7	62.4 Å²	62.4	7%	0.072	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	9.8	-177.8	0	0	0	0	0	114.4	L700 K701 D702 R1030	L700-G704 PolarHBondContact O-N 2.8Å; K701-G704 PolarHBondContact O-N 3.44Å; D702-G704 VanDerWaalsContact C-N 3.31Å; G704-R1030 WeakPolarHBondContact O-CD 3.48Å; G704-R1030 PolarHBondContact O-NH1 3.09Å
705	L	78.1	Confident	65.9	Low	7 Å²	7	70.2 Å²	70.2	4%	0.037	38%	0.375	C	S	.	.	S	Bend	trans	-76.1	-25.7	173.8	-73.2	-176.6	0	0	0	113.7	L564 I579 L700 C1027	L564-L705 HydrophobicContact CD2-CD1 3.66Å; L564-L705 HydrophobicContact CD2-CD2 4.17Å; L564-L705 HydrophobicContact CD2-CG 4.03Å; I579-L705 HydrophobicContact CB-CD1 4.44Å; I579-L705 HydrophobicContact CG1-CD1 4.02Å; I579-L705 HydrophobicContact CG2-CD1 4.43Å; L700-L705 HydrophobicContact CB-CB 4.45Å; L700-L705 HydrophobicContact CD2-CB 4.16Å; L700-L705 HydrophobicContact CD2-CD1 3.47Å; L700-L705 VanDerWaalsContact CD2-CD1 3.47Å; L700-L705 HydrophobicContact CD2-CG 4.42Å; L700-L705 WeakPolarHBondContact O-CA 3.41Å; L700-L705 PolarHBondContact O-N 3.2Å; L705-C1027 HydrophobicContact CD2-CB 4.28Å
706	L	74.2	Confident	64.4	Low	37 Å²	37	71 Å²	71	19%	0.194	38%	0.381	C	S	.	.	S	Bend	trans	-108.3	129.3	174.4	-80.7	170.4	0	0	0	110.6	T587 L700 K701 S708	T587-L706 HydrophobicContact CG2-CD1 4.08Å; T587-L706 HydrophobicContact CG2-CD2 4.08Å; T587-L706 HydrophobicContact CG2-CG 4.33Å; L700-L706 HydrophobicContact CB-CB 4.43Å; L700-L706 HydrophobicContact CB-CD1 3.55Å; L700-L706 HydrophobicContact CB-CG 3.91Å; L700-L706 HydrophobicContact CD1-CD1 4.05Å; L700-L706 HydrophobicContact CG-CD1 4.47Å; L700-L706 PolarHBondContact O-N 3.2Å; K701-L706 HydrophobicContact CG-CB 3.7Å; K701-L706 HydrophobicContact CG-CD1 4.29Å; L706-S708 PolarHBondContact O-N 3.41Å
707	D	66.8	Low	62.7	Low	46 Å²	46	78.4 Å²	78.4	25%	0.246	42%	0.42	C	S	.	.			trans	-61.1	128.5	174.5	-82.4	-42	0	0	0	110.3	K709	D707-K709 PolarHBondContact O-N 3.36Å
708	S	56.6	Low	61.4	Low	81 Å²	81	80.6 Å²	80.6	57%	0.566	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-67.8	-19.3	179.8	57.5	0	0	0	0	114.1	L706 S710 T711	L706-S708 PolarHBondContact O-N 3.41Å; S708-S710 PolarHBondContact O-N 3.43Å; S708-T711 PolarHBondContact O-N 3.01Å; S708-T711 PolarHBondContact O-OG1 3.23Å
709	K	52.1	Low	60.7	Low	168 Å²	168	80.3 Å²	80.3	73%	0.73	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-59.2	-21.8	-170.1	-69	-168.2	173.8	-168.3	0	114.6	D707 T711	D707-K709 PolarHBondContact O-N 3.36Å; K709-T711 PolarHBondContact O-N 3.14Å
710	S	46.9	Very low	60	Low	97 Å²	97	83.2 Å²	83.2	68%	0.678	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-78.5	8.4	-176	51.1	0	0	0	0	115.4	S708	S708-S710 PolarHBondContact O-N 3.43Å
711	T	41.4	Very low	59.2	Low	100 Å²	100	88 Å²	88	61%	0.613	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-134.3	13.1	-177.6	26.7	0	0	0	0	115.9	K701 S708 K709 S713	K701-T711 PolarHBondContact NZ-OG1 2.91Å; S708-T711 PolarHBondContact O-N 3.01Å; S708-T711 PolarHBondContact O-OG1 3.23Å; K709-T711 PolarHBondContact O-N 3.14Å; T711-S713 PolarHBondContact O-N 3.13Å
712	E	33	Very low	58.8	Low	162 Å²	162	87.2 Å²	87.2	76%	0.757	47%	0.467	S	S	*	.			trans	-96	87.5	177.5	-71.2	-170.6	165.1	0	0	112.2
713	S	39.3	Very low	58.7	Low	108 Å²	108	86 Å²	86	76%	0.755	46%	0.458	S	S	*	.			trans	162.1	81.6	145.7	54.3	0	0	0	0	110.8	T711	T711-S713 PolarHBondContact O-N 3.13Å
714	D	42.9	Very low	58.5	Low	105 Å²	105	92.5 Å²	92.5	56%	0.561	49%	0.485	S	S	*	.			trans	-151.4	58.7	159.2	-122.3	-5.2	0	0	0	109.6	N716	D714-N716 PolarHBondContact O-N 3.38Å; D714-N716 PolarHBondContact OD1-ND2 3.45Å
715	K	43.1	Very low	58.5	Low	208 Å²	208	92.8 Å²	92.8	90%	0.904	49%	0.485	S	S	*	.			trans	-74.4	42.9	171.1	-70.5	-176.8	179.4	173.3	0	110.8	L717	K715-L717 PolarHBondContact O-N 3.28Å
716	N	50.2	Low	58.4	Low	82 Å²	82	92.5 Å²	92.5	44%	0.439	48%	0.484	S	S	.	.			trans	-66.6	119.9	174.4	-74.5	-27.1	0	0	0	109	D714 S718 R719	D714-N716 PolarHBondContact O-N 3.38Å; D714-N716 PolarHBondContact OD1-ND2 3.45Å; N716-S718 PolarHBondContact O-N 3.15Å; N716-S718 VanDerWaalsContact O-N 3.14Å; N716-R719 HydrophobicContact CB-CB 4.41Å; N716-R719 WeakPolarHBondContact O-CB 3.12Å; N716-R719 PolarHBondContact O-N 3.1Å
717	L	52.3	Low	58.3	Low	156 Å²	156	94.8 Å²	94.8	82%	0.817	50%	0.496	S	S	*	.	H	α-helix	trans	-51.3	-34.7	175.2	-81.5	148.3	0	0	0	111.5	K715 R719 T720 Q721	K715-L717 PolarHBondContact O-N 3.28Å; L717-R719 PolarHBondContact O-N 2.82Å; L717-T720 PolarHBondContact O-N 3.45Å; L717-Q721 PolarHBondContact O-N 2.75Å
718	S	62.1	Low	58.5	Low	63 Å²	63	96.9 Å²	96.9	44%	0.441	50%	0.501	S	S	.	.	H	α-helix	trans	-56.9	-45.6	174	60.5	0	0	0	0	112.2	N716 T720 Q721 H722	N716-S718 PolarHBondContact O-N 3.15Å; N716-S718 VanDerWaalsContact O-N 3.14Å; S718-T720 VanDerWaalsContact C-N 3.32Å; S718-T720 PolarHBondContact O-N 3.3Å; S718-Q721 WeakPolarHBondContact O-CA 3.33Å; S718-Q721 WeakPolarHBondContact O-CB 3.24Å; S718-Q721 PolarHBondContact O-N 3.28Å; S718-H722 VanDerWaalsContact C-CD2 3.45Å; S718-H722 PolarHBondContact O-CD2 2.64Å; S718-H722 PolarHBondContact O-N 3.41Å
719	R	65.9	Low	59.2	Low	87 Å²	87	93.8 Å²	93.8	33%	0.328	48%	0.48	S	S	.	.	H	α-helix	trans	-62.2	-38.5	-178	-167	174.8	164.2	80.1	6.6	111.7	N716 L717 Q721 H722 F723 L795	N716-R719 HydrophobicContact CB-CB 4.41Å; N716-R719 WeakPolarHBondContact O-CB 3.12Å; N716-R719 PolarHBondContact O-N 3.1Å; L717-R719 PolarHBondContact O-N 2.82Å; R719-Q721 VanDerWaalsContact C-N 3.34Å; R719-Q721 PolarHBondContact O-N 3.03Å; R719-H722 PolarHBondContact O-N 3.43Å; R719-F723 HydrophobicContact CG-CD2 3.94Å; R719-F723 HydrophobicContact CG-CE2 3.68Å; R719-F723 WeakPolarHBondContact O-CD2 3.13Å; R719-F723 PolarHBondContact O-N 2.84Å; R719-L795 VanDerWaalsContact CZ-O 3.32Å; R719-L795 PolarHBondContact NH1-O 3.05Å; R719-L795 PolarHBondContact NH2-O 3.21Å; R719-L795 VanDerWaalsContact NH2-O 3.14Å
720	T	66.5	Low	60.2	Low	80 Å²	80	88.4 Å²	88.4	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-63.4	-40.3	174.6	-56.7	0	0	0	0	111.7	L717 S718 F723 K724	L717-T720 PolarHBondContact O-N 3.45Å; S718-T720 VanDerWaalsContact C-N 3.32Å; S718-T720 PolarHBondContact O-N 3.3Å; T720-F723 PolarHBondContact O-N 2.93Å; T720-K724 WeakPolarHBondContact O-CG 3.42Å; T720-K724 PolarHBondContact O-N 3.31Å; T720-K724 VanDerWaalsContact O-N 3.11Å
721	Q	67.5	Low	61.1	Low	102 Å²	102	90 Å²	90	48%	0.477	45%	0.446	S	S	.	.	H	α-helix	trans	-67.3	-42.3	175.3	-173.8	166.5	-7.3	0	0	111.5	L717 S718 R719 F723 K724 N725	L717-Q721 PolarHBondContact O-N 2.75Å; S718-Q721 WeakPolarHBondContact O-CA 3.33Å; S718-Q721 WeakPolarHBondContact O-CB 3.24Å; S718-Q721 PolarHBondContact O-N 3.28Å; R719-Q721 VanDerWaalsContact C-N 3.34Å; R719-Q721 PolarHBondContact O-N 3.03Å; Q721-F723 PolarHBondContact O-N 3.36Å; Q721-K724 WeakPolarHBondContact O-CB 3.31Å; Q721-K724 PolarHBondContact O-N 2.77Å; Q721-N725 VanDerWaalsContact O-CG 3.28Å; Q721-N725 PolarHBondContact O-N 3.29Å; Q721-N725 PolarHBondContact O-ND2 3Å
722	H	72.6	Confident	62.3	Low	39 Å²	39	86.9 Å²	86.9	18%	0.181	43%	0.429	C	S	.	.	H	α-helix	trans	-62.1	-40.1	174.2	-67.5	-64.1	0	0	0	112.5	S718 R719 K724 N725 L726 W772 L773 L795	S718-H722 VanDerWaalsContact C-CD2 3.45Å; S718-H722 PolarHBondContact O-CD2 2.64Å; S718-H722 PolarHBondContact O-N 3.41Å; R719-H722 PolarHBondContact O-N 3.43Å; H722-K724 PolarHBondContact O-N 3.35Å; H722-N725 CarbonylContact O-C 3.44Å; H722-N725 WeakPolarHBondContact O-CB 3.33Å; H722-N725 PolarHBondContact O-N 3.48Å; H722-L726 WeakPolarHBondContact O-CB 3.41Å; H722-L726 PolarHBondContact O-N 3.04Å; H722-W772 AromaticContact ND1-CZ3 3.94Å; H722-L773 PolarHBondContact CE1-O 3.36Å; H722-L795 HydrophobicContact CB-CD1 4.16Å; H722-L795 HydrophobicContact CB-CD2 3.61Å; H722-L795 HydrophobicContact CB-CG 4.48Å
723	F	72.8	Confident	64	Low	63 Å²	63	83 Å²	83	28%	0.276	41%	0.411	S	S	.	.	H	α-helix	trans	-63.8	-38.8	174.4	-86.4	-64.5	0	0	0	112.7	R719 T720 Q721 N725 L726 N727 L795	R719-F723 HydrophobicContact CG-CD2 3.94Å; R719-F723 HydrophobicContact CG-CE2 3.68Å; R719-F723 WeakPolarHBondContact O-CD2 3.13Å; R719-F723 PolarHBondContact O-N 2.84Å; T720-F723 PolarHBondContact O-N 2.93Å; Q721-F723 PolarHBondContact O-N 3.36Å; F723-N725 VanDerWaalsContact C-N 3.34Å; F723-L726 HydrophobicContact CD1-CD2 4.27Å; F723-L726 PolarHBondContact O-N 2.95Å; F723-N727 WeakPolarHBondContact O-CB 3.12Å; F723-N727 VanDerWaalsContact O-CG 3.31Å; F723-N727 PolarHBondContact O-N 3.33Å; F723-N727 PolarHBondContact O-ND2 3.32Å; F723-L795 WeakPolarHBondContact CZ-O 3.27Å
724	K	70.4	Confident	65.2	Low	144 Å²	144	82.1 Å²	82.1	63%	0.626	39%	0.391	S	S	*	.	H	α-helix	trans	-62.5	-42.9	172.3	-72.5	175.2	-178.7	175.4	0	111	T720 Q721 H722 N727 Y728	T720-K724 WeakPolarHBondContact O-CG 3.42Å; T720-K724 PolarHBondContact O-N 3.31Å; T720-K724 VanDerWaalsContact O-N 3.11Å; Q721-K724 WeakPolarHBondContact O-CB 3.31Å; Q721-K724 PolarHBondContact O-N 2.77Å; H722-K724 PolarHBondContact O-N 3.35Å; K724-N727 PolarHBondContact O-N 3.47Å; K724-Y728 WeakPolarHBondContact O-CB 3.44Å; K724-Y728 PolarHBondContact O-N 3.34Å
725	N	74	Confident	66	Low	14 Å²	14	79.6 Å²	79.6	8%	0.075	38%	0.377	C	S	.	.	H	α-helix	trans	-66.1	-38.5	176.4	-67.7	-20.6	0	0	0	112.2	Q721 H722 F723 Y728 A729 W772 I781	Q721-N725 VanDerWaalsContact O-CG 3.28Å; Q721-N725 PolarHBondContact O-N 3.29Å; Q721-N725 PolarHBondContact O-ND2 3Å; H722-N725 CarbonylContact O-C 3.44Å; H722-N725 WeakPolarHBondContact O-CB 3.33Å; H722-N725 PolarHBondContact O-N 3.48Å; F723-N725 VanDerWaalsContact C-N 3.34Å; N725-Y728 CarbonylContact O-C 3.57Å; N725-Y728 WeakPolarHBondContact O-CB 3.49Å; N725-Y728 PolarHBondContact O-N 2.86Å; N725-A729 WeakPolarHBondContact O-CB 3.27Å; N725-A729 PolarHBondContact O-N 3.23Å; N725-W772 HydrophobicContact CB-CH2 3.6Å; N725-W772 HydrophobicContact CB-CZ2 3.78Å; N725-I781 HydrophobicContact CB-CD1 4.3Å; N725-I781 VanDerWaalsContact ND2-CD1 3.3Å; N725-I781 WeakPolarHBondContact ND2-CD1 3.1Å
726	L	76	Confident	66.8	Low	0 Å²	0	74.3 Å²	74.3	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65.2	-45.5	174.5	177.4	66.4	0	0	0	111.4	H722 F723 Y728 A729 R730 V788 L791 E792 L795 C796	H722-L726 WeakPolarHBondContact O-CB 3.41Å; H722-L726 PolarHBondContact O-N 3.04Å; F723-L726 HydrophobicContact CD1-CD2 4.27Å; F723-L726 PolarHBondContact O-N 2.95Å; L726-Y728 PolarHBondContact O-N 2.96Å; L726-A729 CarbonylContact O-C 3.38Å; L726-A729 WeakPolarHBondContact O-CB 3.44Å; L726-A729 PolarHBondContact O-N 3.15Å; L726-A729 VanDerWaalsContact O-N 3.08Å; L726-R730 WeakPolarHBondContact O-CB 3.49Å; L726-R730 WeakPolarHBondContact O-CG 3.5Å; L726-R730 PolarHBondContact O-N 3.44Å; L726-V788 HydrophobicContact CD1-CG1 4.41Å; L726-L791 HydrophobicContact CD1-CB 3.63Å; L726-E792 HydrophobicContact CD1-CG 3.91Å; L726-E792 HydrophobicContact CD2-CG 4.26Å; L726-L795 HydrophobicContact CB-CD1 3.83Å; L726-L795 HydrophobicContact CD1-CD1 4.29Å; L726-L795 HydrophobicContact CD2-CB 4.2Å; L726-L795 HydrophobicContact CD2-CD1 4.33Å; L726-L795 HydrophobicContact CG-CD1 4.37Å; L726-C796 WeakPolarHBondContact CD2-SG 3.32Å
727	N	72.6	Confident	67.1	Low	85 Å²	85	72.5 Å²	72.5	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-62.3	-34.7	175.5	-75.1	-27.5	0	0	0	111.3	F723 K724 R730 R731	F723-N727 WeakPolarHBondContact O-CB 3.12Å; F723-N727 VanDerWaalsContact O-CG 3.31Å; F723-N727 PolarHBondContact O-N 3.33Å; F723-N727 PolarHBondContact O-ND2 3.32Å; K724-N727 PolarHBondContact O-N 3.47Å; N727-R730 PolarHBondContact OD1-NH1 3.14Å; N727-R731 WeakPolarHBondContact O-CB 3.32Å; N727-R731 PolarHBondContact O-N 3.32Å
728	Y	69.6	Low	67.3	Low	91 Å²	91	68.8 Å²	68.8	36%	0.357	32%	0.324	S	S	.	.	H	α-helix	trans	-67.2	-42.6	170.3	178.6	-93.4	0	0	0	112.2	K724 N725 L726 R731 S732 N782	K724-Y728 WeakPolarHBondContact O-CB 3.44Å; K724-Y728 PolarHBondContact O-N 3.34Å; N725-Y728 CarbonylContact O-C 3.57Å; N725-Y728 WeakPolarHBondContact O-CB 3.49Å; N725-Y728 PolarHBondContact O-N 2.86Å; L726-Y728 PolarHBondContact O-N 2.96Å; Y728-R731 CarbonylContact O-C 3.52Å; Y728-R731 PolarHBondContact O-N 2.83Å; Y728-S732 VanDerWaalsContact O-CB 3.27Å; Y728-S732 WeakPolarHBondContact O-CB 3.31Å; Y728-S732 PolarHBondContact O-N 3.15Å; Y728-N782 WeakPolarHBondContact CE1-OD1 3.34Å
729	A	71.2	Confident	67	Low	15 Å²	15	74.7 Å²	74.7	12%	0.124	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-48.4	176	0	0	0	0	0	111.5	N725 L726 R731 S732 E733 V788 L791	N725-A729 WeakPolarHBondContact O-CB 3.27Å; N725-A729 PolarHBondContact O-N 3.23Å; L726-A729 CarbonylContact O-C 3.38Å; L726-A729 WeakPolarHBondContact O-CB 3.44Å; L726-A729 PolarHBondContact O-N 3.15Å; L726-A729 VanDerWaalsContact O-N 3.08Å; A729-R731 VanDerWaalsContact C-N 3.3Å; A729-R731 PolarHBondContact O-N 3.45Å; A729-S732 CarbonylContact O-C 3.56Å; A729-S732 WeakPolarHBondContact O-CB 3.42Å; A729-S732 PolarHBondContact O-N 3.28Å; A729-S732 VanDerWaalsContact O-N 3.11Å; A729-E733 WeakPolarHBondContact O-CB 3.35Å; A729-E733 PolarHBondContact O-N 2.83Å; A729-V788 HydrophobicContact CB-CG2 4.24Å; A729-L791 HydrophobicContact CB-CD1 3.89Å
730	R	73.4	Confident	66.9	Low	56 Å²	56	76.3 Å²	76.3	21%	0.211	34%	0.343	C	S	.	.	H	α-helix	trans	-53.2	-46.3	170.4	-75.3	171	165.6	165.8	-3.8	111.7	L726 N727 R734 V788 E792	L726-R730 WeakPolarHBondContact O-CB 3.49Å; L726-R730 WeakPolarHBondContact O-CG 3.5Å; L726-R730 PolarHBondContact O-N 3.44Å; N727-R730 PolarHBondContact OD1-NH1 3.14Å; R730-R734 WeakPolarHBondContact O-CB 3.47Å; R730-R734 WeakPolarHBondContact O-CG 3.47Å; R730-R734 PolarHBondContact O-N 3.17Å; R730-V788 HydrophobicContact CB-CG1 4.45Å; R730-V788 HydrophobicContact CG-CG1 3.59Å; R730-E792 IonicContact CZ-OE1 2.7Å; R730-E792 IonicContact NE-OE1 2.74Å; R730-E792 PolarHBondContact NE-OE1 2.94Å; R730-E792 IonicContact NH2-OE1 2.82Å; R730-E792 PolarHBondContact NH2-OE1 2.93Å; R730-E792 IonicContact NH2-OE2 3.18Å
731	R	66.6	Low	67.2	Low	129 Å²	129	79.8 Å²	79.8	49%	0.487	35%	0.347	S	S	.	.	H	α-helix	trans	-67.1	-39	178.2	-175.6	173.9	178.4	150.9	1.7	111.7	R214 N727 Y728 A729 M735	R214-R731 PolarHBondContact O-NH2 3.01Å; N727-R731 WeakPolarHBondContact O-CB 3.32Å; N727-R731 PolarHBondContact O-N 3.32Å; Y728-R731 CarbonylContact O-C 3.52Å; Y728-R731 PolarHBondContact O-N 2.83Å; A729-R731 VanDerWaalsContact C-N 3.3Å; A729-R731 PolarHBondContact O-N 3.45Å; R731-M735 WeakPolarHBondContact O-CB 3.21Å; R731-M735 WeakPolarHBondContact O-CG 3.42Å; R731-M735 PolarHBondContact O-N 3.36Å
732	S	67.1	Low	67.7	Low	35 Å²	35	80.3 Å²	80.3	25%	0.245	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-44.8	176.4	-174	0	0	0	0	111	Y728 A729 M735 K736	Y728-S732 VanDerWaalsContact O-CB 3.27Å; Y728-S732 WeakPolarHBondContact O-CB 3.31Å; Y728-S732 PolarHBondContact O-N 3.15Å; A729-S732 CarbonylContact O-C 3.56Å; A729-S732 WeakPolarHBondContact O-CB 3.42Å; A729-S732 PolarHBondContact O-N 3.28Å; A729-S732 VanDerWaalsContact O-N 3.11Å; S732-M735 CarbonylContact O-C 3.54Å; S732-M735 WeakPolarHBondContact O-CB 3.43Å; S732-M735 PolarHBondContact O-N 2.94Å; S732-M735 VanDerWaalsContact O-N 3.16Å; S732-K736 WeakPolarHBondContact O-CB 3.35Å; S732-K736 WeakPolarHBondContact O-CG 3.37Å; S732-K736 PolarHBondContact O-N 2.96Å
733	E	67.6	Low	68.1	Low	82 Å²	82	78.7 Å²	78.7	38%	0.383	35%	0.345	S	S	.	.	H	α-helix	trans	-63.2	-48.9	174.7	-173.8	-175.6	-135.5	0	0	111	A729 M735 K736 S737 V788	A729-E733 WeakPolarHBondContact O-CB 3.35Å; A729-E733 PolarHBondContact O-N 2.83Å; E733-M735 PolarHBondContact O-N 3.11Å; E733-K736 CarbonylContact O-C 3.56Å; E733-K736 WeakPolarHBondContact O-CA 3.3Å; E733-K736 PolarHBondContact O-N 3.35Å; E733-S737 WeakPolarHBondContact O-CB 3.37Å; E733-S737 PolarHBondContact O-N 3.09Å; E733-V788 HydrophobicContact CB-CG2 3.68Å; E733-V788 VanDerWaalsContact CD-CG2 3.44Å; E733-V788 HydrophobicContact CG-CG2 4.12Å; E733-V788 WeakPolarHBondContact OE2-CB 3.47Å; E733-V788 WeakPolarHBondContact OE2-CG2 3.49Å
734	R	65.3	Low	68.5	Low	89 Å²	89	78.6 Å²	78.6	34%	0.336	35%	0.35	S	S	.	.	H	α-helix	trans	-53.9	-37.2	171.8	-72.9	169.7	-174.3	179.6	1	112.1	R730 K738	R730-R734 WeakPolarHBondContact O-CB 3.47Å; R730-R734 WeakPolarHBondContact O-CG 3.47Å; R730-R734 PolarHBondContact O-N 3.17Å; R734-K738 VanDerWaalsContact O-CB 3.27Å; R734-K738 WeakPolarHBondContact O-CB 3.3Å; R734-K738 WeakPolarHBondContact O-CD 3.37Å; R734-K738 WeakPolarHBondContact O-CG 3.42Å; R734-K738 PolarHBondContact O-N 3.43Å
735	M	59.4	Low	68.8	Low	52 Å²	52	75 Å²	75	26%	0.256	34%	0.337	S	S	.	.	H	α-helix	trans	-75.2	-34.6	176.4	-72.2	-77.2	178.9	0	0	113	E213 R214 R731 S732 E733 R739	E213-M735 WeakPolarHBondContact O-CE 3.22Å; R214-M735 HydrophobicContact CB-CE 4.22Å; R214-M735 HydrophobicContact CG-CE 3.56Å; R731-M735 WeakPolarHBondContact O-CB 3.21Å; R731-M735 WeakPolarHBondContact O-CG 3.42Å; R731-M735 PolarHBondContact O-N 3.36Å; S732-M735 CarbonylContact O-C 3.54Å; S732-M735 WeakPolarHBondContact O-CB 3.43Å; S732-M735 PolarHBondContact O-N 2.94Å; S732-M735 VanDerWaalsContact O-N 3.16Å; E733-M735 PolarHBondContact O-N 3.11Å; M735-R739 PolarHBondContact O-N 3.47Å
736	K	59.6	Low	68.4	Low	97 Å²	97	81.2 Å²	81.2	42%	0.422	37%	0.366	S	S	.	.	H	α-helix	trans	-70.4	-42.4	175.2	-76.4	-179.9	-179.4	-177.4	0	111.2	S732 E733 R739 N785	S732-K736 WeakPolarHBondContact O-CB 3.35Å; S732-K736 WeakPolarHBondContact O-CG 3.37Å; S732-K736 PolarHBondContact O-N 2.96Å; E733-K736 CarbonylContact O-C 3.56Å; E733-K736 WeakPolarHBondContact O-CA 3.3Å; E733-K736 PolarHBondContact O-N 3.35Å; K736-R739 WeakPolarHBondContact O-CB 3.24Å; K736-R739 PolarHBondContact O-N 3.47Å; K736-N785 PolarHBondContact NZ-OD1 2.8Å
737	S	56.7	Low	68.1	Low	43 Å²	43	83.2 Å²	83.2	30%	0.301	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-44.9	174.5	142.6	0	0	0	0	110.4	E405 E733 R739	E405-S737 VanDerWaalsContact CD-OG 3.29Å; E405-S737 VanDerWaalsContact OE1-C 3.28Å; E405-S737 VanDerWaalsContact OE1-CA 3.31Å; E405-S737 WeakPolarHBondContact OE1-CA 3.37Å; E405-S737 WeakPolarHBondContact OE1-CB 3.41Å; E405-S737 VanDerWaalsContact OE1-O 3.06Å; E405-S737 PolarHBondContact OE1-OG 2.97Å; E405-S737 PolarHBondContact OE2-OG 3.36Å; E733-S737 WeakPolarHBondContact O-CB 3.37Å; E733-S737 PolarHBondContact O-N 3.09Å; S737-R739 PolarHBondContact O-N 2.86Å; S737-R739 VanDerWaalsContact O-N 3.08Å
738	K	55.5	Low	67.8	Low	79 Å²	79	80 Å²	80	34%	0.343	36%	0.359	S	S	.	.	H	α-helix	trans	-59.1	-23.3	172.4	-78.4	176.6	-178.1	-162	0	114.6	R734 R740	R734-K738 VanDerWaalsContact O-CB 3.27Å; R734-K738 WeakPolarHBondContact O-CB 3.3Å; R734-K738 WeakPolarHBondContact O-CD 3.37Å; R734-K738 WeakPolarHBondContact O-CG 3.42Å; R734-K738 PolarHBondContact O-N 3.43Å; K738-R740 PolarHBondContact O-N 2.68Å
739	R	56.1	Low	67.1	Low	187 Å²	187	79.5 Å²	79.5	71%	0.706	36%	0.363	S	S	*	.	S	Bend	trans	-78.9	104.1	174.2	-88.5	-174.9	167.2	-167.8	-3.5	109.1	M735 K736 S737 R741	M735-R739 PolarHBondContact O-N 3.47Å; K736-R739 WeakPolarHBondContact O-CB 3.24Å; K736-R739 PolarHBondContact O-N 3.47Å; S737-R739 PolarHBondContact O-N 2.86Å; S737-R739 VanDerWaalsContact O-N 3.08Å; R739-R741 PolarHBondContact O-N 2.92Å
740	R	65.3	Low	66.1	Low	121 Å²	121	81.7 Å²	81.7	46%	0.457	38%	0.377	S	S	.	.			trans	-48.9	113.6	165.9	-68.6	-174.9	-173.2	174.3	-1.1	109.3	V410 D432 K738	V410-R740 HydrophobicContact CG2-CB 4.26Å; D432-R740 VanDerWaalsContact CG-NH2 3.34Å; D432-R740 IonicContact OD1-NH2 2.7Å; D432-R740 IonicContact OD2-CZ 2.88Å; D432-R740 IonicContact OD2-NH1 2.77Å; D432-R740 PolarHBondContact OD2-NH1 2.74Å; D432-R740 IonicContact OD2-NH2 3.92Å; D432-R740 PolarHBondContact OD2-NH2 3.18Å; K738-R740 PolarHBondContact O-N 2.68Å
741	R	72.7	Confident	64.9	Low	152 Å²	152	83.8 Å²	83.8	57%	0.574	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-82.5	157.9	172	-62.1	-174.9	-172.5	-179.5	5.6	109.1	H409 V410 R739	H409-R741 WeakPolarHBondContact CB-O 3.21Å; V410-R741 PolarHBondContact N-O 2.96Å; V410-R741 VanDerWaalsContact N-O 3.11Å; R739-R741 PolarHBondContact O-N 2.92Å
742	L	76.7	Confident	63.6	Low	114 Å²	114	84.3 Å²	84.3	60%	0.597	40%	0.401	S	S	*	.	B	Isolated β-bridge	trans	-80.8	121.9	165.3	-162.6	73	0	0	0	106.6	V410 P412	V410-L742 CarbonylContact O-C 3.51Å; V410-L742 WeakPolarHBondContact O-CA 3.36Å; P412-L742 HydrophobicContact CG-CD2 4.47Å; P412-L742 HydrophobicContact CG-CG 4.26Å
743	L	81.9	Confident	61.8	Low	4 Å²	4	86 Å²	86	2%	0.021	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-64.5	163	171	-66.3	168.4	0	0	0	109.7	I391 L393 H409 V410 P412 K417 D747	I391-L743 HydrophobicContact CD1-CB 3.64Å; I391-L743 HydrophobicContact CD1-CD1 4.45Å; I391-L743 HydrophobicContact CG2-CD1 4.46Å; L393-L743 HydrophobicContact CD1-CD1 4.11Å; H409-L743 HydrophobicContact CB-CD1 4.12Å; H409-L743 HydrophobicContact CB-CD2 3.71Å; H409-L743 HydrophobicContact CB-CG 3.64Å; V410-L743 PolarHBondContact O-N 2.9Å; P412-L743 VanDerWaalsContact CD-O 3.28Å; P412-L743 WeakPolarHBondContact CD-O 3.5Å; P412-L743 WeakPolarHBondContact CG-O 3.26Å; K417-L743 HydrophobicContact CD-CD1 4.3Å; L743-D747 WeakPolarHBondContact CA-OD2 3.34Å; L743-D747 WeakPolarHBondContact CD2-OD2 3.26Å
744	T	80.8	Confident	60.3	Low	62 Å²	62	87.8 Å²	87.8	38%	0.38	42%	0.422	S	S	.	.			trans	-129.2	157.3	176.2	64.8	0	0	0	0	109.5	Q746 D747	T744-Q746 PolarHBondContact O-N 2.93Å; T744-Q746 VanDerWaalsContact O-N 3.14Å; T744-D747 PolarHBondContact N-OD2 2.76Å; T744-D747 VanDerWaalsContact O-CB 3.3Å; T744-D747 WeakPolarHBondContact O-CB 3.29Å; T744-D747 PolarHBondContact O-N 3.41Å; T744-D747 PolarHBondContact OG1-OD2 2.92Å
745	L	76.5	Confident	58.7	Low	67 Å²	67	87.3 Å²	87.3	35%	0.351	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-61.1	-22	174.9	-68.7	171.5	0	0	0	112.5	K388 I391 V415 D747 N748	K388-L745 HydrophobicContact CB-CD1 4.09Å; I391-L745 HydrophobicContact CG1-CD2 4.26Å; V415-L745 HydrophobicContact CG1-CD2 4.08Å; V415-L745 HydrophobicContact CG2-CD2 4.49Å; L745-D747 PolarHBondContact O-N 2.94Å; L745-N748 WeakPolarHBondContact O-CB 3.28Å; L745-N748 PolarHBondContact O-N 3.02Å
746	Q	66.8	Low	57.6	Low	145 Å²	145	93.5 Å²	93.5	68%	0.678	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-67	-19.8	173.9	-67.8	180	-11.9	0	0	113	T744 N748 L749 S750	T744-Q746 PolarHBondContact O-N 2.93Å; T744-Q746 VanDerWaalsContact O-N 3.14Å; Q746-N748 PolarHBondContact O-N 3.11Å; Q746-N748 VanDerWaalsContact O-N 3.17Å; Q746-L749 WeakPolarHBondContact O-CB 3.24Å; Q746-L749 PolarHBondContact O-N 3.18Å; Q746-S750 PolarHBondContact O-N 3.25Å
747	D	69.6	Low	56.3	Low	42 Å²	42	98.2 Å²	98.2	23%	0.225	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-62	-23.6	175.1	-68.3	-52.9	0	0	0	111.6	I391 L743 T744 L745 L749 S750	I391-D747 HydrophobicContact CG2-CB 4.4Å; L743-D747 WeakPolarHBondContact CA-OD2 3.34Å; L743-D747 WeakPolarHBondContact CD2-OD2 3.26Å; T744-D747 PolarHBondContact N-OD2 2.76Å; T744-D747 VanDerWaalsContact O-CB 3.3Å; T744-D747 WeakPolarHBondContact O-CB 3.29Å; T744-D747 PolarHBondContact O-N 3.41Å; T744-D747 PolarHBondContact OG1-OD2 2.92Å; L745-D747 PolarHBondContact O-N 2.94Å; D747-L749 VanDerWaalsContact C-N 3.33Å; D747-L749 PolarHBondContact O-N 2.7Å; D747-S750 PolarHBondContact O-OG 3.05Å
748	N	64.7	Low	55.2	Low	18 Å²	18	100.6 Å²	100.6	10%	0.096	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-66.3	-32.7	171.5	-70.4	-22.9	0	0	0	113.1	W390 I391 I392 L745 Q746	W390-N748 PolarHBondContact O-ND2 3.31Å; I391-N748 VanDerWaalsContact CA-OD1 3.28Å; I391-N748 WeakPolarHBondContact CA-OD1 3.3Å; I392-N748 PolarHBondContact N-OD1 3.36Å; L745-N748 WeakPolarHBondContact O-CB 3.28Å; L745-N748 PolarHBondContact O-N 3.02Å; Q746-N748 PolarHBondContact O-N 3.11Å; Q746-N748 VanDerWaalsContact O-N 3.17Å
749	L	56.1	Low	54.2	Low	81 Å²	81	104 Å²	104	42%	0.424	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-17.5	-175.1	-65.5	170.9	0	0	0	113.1	Q746 D747 E751 N752 S753	Q746-L749 WeakPolarHBondContact O-CB 3.24Å; Q746-L749 PolarHBondContact O-N 3.18Å; D747-L749 VanDerWaalsContact C-N 3.33Å; D747-L749 PolarHBondContact O-N 2.7Å; L749-E751 PolarHBondContact O-N 3.25Å; L749-N752 PolarHBondContact O-N 2.89Å; L749-S753 PolarHBondContact O-N 2.85Å
750	S	49.8	Very low	53.2	Low	61 Å²	61	102.8 Å²	102.8	43%	0.427	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	3.9	-164.9	61.9	0	0	0	0	116.6	Q746 D747	Q746-S750 PolarHBondContact O-N 3.25Å; D747-S750 PolarHBondContact O-OG 3.05Å
751	E	48.8	Very low	51.9	Low	99 Å²	99	106.5 Å²	106.5	46%	0.463	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-22.7	168.7	-71.7	-174	148.8	0	0	114	K381 L749	K381-E751 IonicContact NZ-OE2 3.81Å; K381-E751 PolarHBondContact NZ-OE2 2.85Å; L749-E751 PolarHBondContact O-N 3.25Å
752	N	37.7	Very low	50.7	Low	140 Å²	140	104.1 Å²	104.1	75%	0.749	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	-16.9	-172.5	-73.5	-10.8	0	0	0	115.5	L749	L749-N752 PolarHBondContact O-N 2.89Å
753	S	30.5	Very low	49.5	Very low	72 Å²	72	103 Å²	103	50%	0.503	53%	0.528	S	S	.	.			trans	-97.3	15.3	-169.8	-52.4	0	0	0	0	116.3	L749 S755	L749-S753 PolarHBondContact O-N 2.85Å; S753-S755 PolarHBondContact O-N 2.85Å
754	E	35.5	Very low	48.4	Very low	118 Å²	118	105 Å²	105	55%	0.551	54%	0.541	S	S	*	.			trans	-84.8	32.7	159.8	-69.2	-171.7	-174.7	0	0	111.3	R677 E756	R677-E754 IonicContact CZ-OE2 3.27Å; R677-E754 IonicContact NH1-OE2 2.7Å; R677-E754 PolarHBondContact NH1-OE2 3.35Å; R677-E754 IonicContact NH2-OE2 3.29Å; R677-E754 PolarHBondContact NH2-OE2 3Å; E754-E756 PolarHBondContact O-N 2.92Å
755	S	31.4	Very low	47.7	Very low	80 Å²	80	104 Å²	104	56%	0.559	53%	0.534	S	S	*	.			trans	-74.6	113.1	176.5	43	0	0	0	0	110.9	S753 K757	S753-S755 PolarHBondContact O-N 2.85Å; S755-K757 PolarHBondContact O-N 3.46Å
756	E	37.1	Very low	47.1	Very low	182 Å²	182	101.5 Å²	101.5	85%	0.85	52%	0.522	S	S	*	.	S	Bend	trans	54.7	-0.6	154	-60.3	-168.6	164.2	0	0	120.6	E754	E754-E756 PolarHBondContact O-N 2.92Å
757	K	32.4	Very low	47.1	Very low	195 Å²	195	95.7 Å²	95.7	85%	0.848	50%	0.498	S	S	*	.			trans	-103.4	27.2	177.5	-66.9	-169.4	179.5	-179.1	0	115.3	S755 D759	S755-K757 PolarHBondContact O-N 3.46Å; K757-D759 VanDerWaalsContact C-N 3.33Å; K757-D759 PolarHBondContact O-N 2.82Å
758	E	33.1	Very low	47.1	Very low	94 Å²	94	95.4 Å²	95.4	44%	0.439	49%	0.494	S	S	.	.			trans	-91.9	58.2	168.4	-70.1	-166.9	156.7	0	0	111.8
759	D	34.5	Very low	47.4	Very low	150 Å²	150	95.1 Å²	95.1	80%	0.802	49%	0.493	S	S	*	.			trans	-100.4	15.3	170.1	-91.6	-14.5	0	0	0	113.1	K757	K757-D759 VanDerWaalsContact C-N 3.33Å; K757-D759 PolarHBondContact O-N 2.82Å
760	H	34.7	Very low	48	Very low	161 Å²	161	95.9 Å²	95.9	75%	0.745	49%	0.49	S	S	*	.	S	Bend	trans	-115.8	93.8	177.6	-75.5	-50.1	0	0	0	112.5	V762	H760-V762 WeakPolarHBondContact O-CG2 3.29Å; H760-V762 PolarHBondContact O-N 2.95Å
761	H	38.5	Very low	49.1	Very low	199 Å²	199	98.1 Å²	98.1	92%	0.921	49%	0.492	S	S	*	.			trans	38.6	35.6	151.4	-80.5	-69.1	0	0	0	118.1	E763	H761-E763 PolarHBondContact O-N 2.76Å
762	V	48.1	Very low	50.3	Low	102 Å²	102	93.7 Å²	93.7	62%	0.618	47%	0.471	S	S	*	.			trans	-77.4	113.7	172.6	-177.4	0	0	0	0	107.9	H760 S764	H760-V762 WeakPolarHBondContact O-CG2 3.29Å; H760-V762 PolarHBondContact O-N 2.95Å; V762-S764 PolarHBondContact O-N 3.01Å; V762-S764 VanDerWaalsContact O-N 3.11Å
763	E	51.7	Low	51.9	Low	92 Å²	92	88.9 Å²	88.9	43%	0.43	45%	0.445	S	S	.	.			trans	-46.6	118.1	172.6	-172.3	177.6	-162	0	0	109.4	H761 S767 K768 K771	H761-E763 PolarHBondContact O-N 2.76Å; E763-S767 WeakPolarHBondContact CG-OG 3.49Å; E763-K768 HydrophobicContact CG-CG 4.02Å; E763-K768 WeakPolarHBondContact O-CE 3.38Å; E763-K768 PolarHBondContact O-NZ 2.78Å; E763-K771 IonicContact OE1-NZ 3.92Å
764	S	58.6	Low	53.7	Low	44 Å²	44	89.7 Å²	89.7	31%	0.308	45%	0.451	S	S	.	.			trans	-56.8	143.2	-177.7	-178.4	0	0	0	0	110.8	V762 S766 S767 K768	V762-S764 PolarHBondContact O-N 3.01Å; V762-S764 VanDerWaalsContact O-N 3.11Å; S764-S766 PolarHBondContact O-N 2.9Å; S764-S766 VanDerWaalsContact O-N 3.08Å; S764-S766 PolarHBondContact OG-OG 3.5Å; S764-S767 PolarHBondContact N-OG 3.45Å; S764-S767 PolarHBondContact O-N 2.91Å; S764-S767 PolarHBondContact O-OG 2.8Å; S764-K768 PolarHBondContact O-N 2.78Å; S764-K768 VanDerWaalsContact O-N 3.17Å
765	D	64.9	Low	55.2	Low	42 Å²	42	84.8 Å²	84.8	23%	0.225	43%	0.43	C	S	.	.	H	α-helix	trans	-59.5	-25.4	178.7	-72.9	-19.7	0	0	0	112.2	K673 K768 L769	K673-D765 WeakPolarHBondContact CE-OD2 3.31Å; K673-D765 IonicContact NZ-OD2 2.72Å; K673-D765 PolarHBondContact NZ-OD2 3.14Å; D765-K768 IonicContact OD1-NZ 3.79Å; D765-K768 PolarHBondContact OD1-NZ 2.8Å; D765-L769 WeakPolarHBondContact O-CB 3.45Å; D765-L769 PolarHBondContact O-N 3.22Å
766	S	64.3	Low	56.5	Low	14 Å²	14	86.2 Å²	86.2	10%	0.098	44%	0.44	C	S	.	.	H	α-helix	trans	-69.1	-39.2	174.1	60.9	0	0	0	0	113.3	S764 L769 R770	S764-S766 PolarHBondContact O-N 2.9Å; S764-S766 VanDerWaalsContact O-N 3.08Å; S764-S766 PolarHBondContact OG-OG 3.5Å; S766-L769 PolarHBondContact O-N 2.97Å; S766-R770 PolarHBondContact O-N 2.96Å
767	S	66.8	Low	57.3	Low	24 Å²	24	80.4 Å²	80.4	17%	0.168	42%	0.42	C	S	.	.	H	α-helix	trans	-71	-37.7	176.3	61.4	0	0	0	0	111.1	E763 S764 L769 R770 K771	E763-S767 WeakPolarHBondContact CG-OG 3.49Å; S764-S767 PolarHBondContact N-OG 3.45Å; S764-S767 PolarHBondContact O-N 2.91Å; S764-S767 PolarHBondContact O-OG 2.8Å; S767-L769 VanDerWaalsContact C-N 3.31Å; S767-L769 PolarHBondContact O-N 3.38Å; S767-R770 PolarHBondContact O-N 3.24Å; S767-K771 VanDerWaalsContact O-CB 3.3Å; S767-K771 WeakPolarHBondContact O-CB 3.32Å; S767-K771 PolarHBondContact O-N 3.28Å
768	K	70.3	Confident	58.5	Low	36 Å²	36	77.2 Å²	77.2	16%	0.157	40%	0.402	C	S	.	.	H	α-helix	trans	-58.9	-42.5	170.5	-63.2	177	-164.1	139.3	0	111.8	E763 S764 D765 W772 V786	E763-K768 HydrophobicContact CG-CG 4.02Å; E763-K768 WeakPolarHBondContact O-CE 3.38Å; E763-K768 PolarHBondContact O-NZ 2.78Å; S764-K768 PolarHBondContact O-N 2.78Å; S764-K768 VanDerWaalsContact O-N 3.17Å; D765-K768 IonicContact OD1-NZ 3.79Å; D765-K768 PolarHBondContact OD1-NZ 2.8Å; K768-W772 WeakPolarHBondContact O-CB 3.48Å; K768-W772 PolarHBondContact O-N 3.45Å; K768-V786 HydrophobicContact CB-CG2 3.86Å; K768-V786 WeakPolarHBondContact O-CG2 3.26Å
769	L	70.4	Confident	59.3	Low	11 Å²	11	76.6 Å²	76.6	6%	0.058	41%	0.409	C	S	.	.	H	α-helix	trans	-65.3	-48.2	177.3	178.5	66.1	0	0	0	111.7	T649 D765 S766 S767 K771 W772 L773 V786 L791 V794	T649-L769 HydrophobicContact CG2-CD2 4.35Å; D765-L769 WeakPolarHBondContact O-CB 3.45Å; D765-L769 PolarHBondContact O-N 3.22Å; S766-L769 PolarHBondContact O-N 2.97Å; S767-L769 VanDerWaalsContact C-N 3.31Å; S767-L769 PolarHBondContact O-N 3.38Å; L769-K771 VanDerWaalsContact C-N 3.31Å; L769-K771 PolarHBondContact O-N 3Å; L769-W772 WeakPolarHBondContact O-CB 3.42Å; L769-W772 PolarHBondContact O-N 3.33Å; L769-W772 VanDerWaalsContact O-N 3.11Å; L769-L773 HydrophobicContact CD1-CD1 4.27Å; L769-L773 HydrophobicContact CD1-CG 4.39Å; L769-L773 HydrophobicContact CG-CD1 4.08Å; L769-L773 WeakPolarHBondContact O-CG 3.31Å; L769-L773 PolarHBondContact O-N 3.39Å; L769-V786 HydrophobicContact CB-CG1 4.22Å; L769-V786 HydrophobicContact CD1-CG1 3.74Å; L769-L791 HydrophobicContact CD1-CD2 3.71Å; L769-V794 HydrophobicContact CD2-CG2 4.02Å
770	R	69.7	Low	60.2	Low	98 Å²	98	72.1 Å²	72.1	37%	0.37	39%	0.389	S	S	.	.	H	α-helix	trans	-56.9	-45.1	175.4	-79.5	-172.5	-78.6	177.3	-1.8	111.5	D666 S766 S767 W772 L773 S774	D666-R770 IonicContact OD1-NH2 2.85Å; D666-R770 PolarHBondContact OD1-NH2 3.32Å; S766-R770 PolarHBondContact O-N 2.96Å; S767-R770 PolarHBondContact O-N 3.24Å; R770-W772 VanDerWaalsContact C-N 3.34Å; R770-W772 PolarHBondContact O-N 3.03Å; R770-L773 PolarHBondContact O-N 3.25Å; R770-S774 PolarHBondContact O-N 3.14Å; R770-S774 PolarHBondContact O-OG 3.28Å; R770-S774 VanDerWaalsContact O-OG 3.13Å
771	K	71.7	Confident	61.2	Low	108 Å²	108	65 Å²	65	47%	0.47	36%	0.356	S	S	.	.	H	α-helix	trans	-63.6	-36	175.7	-170.6	175.3	-175.9	172.4	0	113.1	E763 S767 L769 S774 A775	E763-K771 IonicContact OE1-NZ 3.92Å; S767-K771 VanDerWaalsContact O-CB 3.3Å; S767-K771 WeakPolarHBondContact O-CB 3.32Å; S767-K771 PolarHBondContact O-N 3.28Å; L769-K771 VanDerWaalsContact C-N 3.31Å; L769-K771 PolarHBondContact O-N 3Å; K771-S774 PolarHBondContact O-OG 3.47Å; K771-A775 VanDerWaalsContact O-CB 3.29Å; K771-A775 WeakPolarHBondContact O-CB 3.37Å; K771-A775 PolarHBondContact O-N 2.9Å; K771-A775 VanDerWaalsContact O-N 3.09Å
772	W	75	Confident	62	Low	5 Å²	5	59.8 Å²	59.8	2%	0.019	34%	0.335	C	S	.	.	H	α-helix	trans	-68	-41.5	174.6	-170.6	108.2	0	0	0	111.6	H722 N725 K768 L769 R770 A775 I781 S784 V786 L791 L795	H722-W772 AromaticContact ND1-CZ3 3.94Å; N725-W772 HydrophobicContact CB-CH2 3.6Å; N725-W772 HydrophobicContact CB-CZ2 3.78Å; K768-W772 WeakPolarHBondContact O-CB 3.48Å; K768-W772 PolarHBondContact O-N 3.45Å; L769-W772 WeakPolarHBondContact O-CB 3.42Å; L769-W772 PolarHBondContact O-N 3.33Å; L769-W772 VanDerWaalsContact O-N 3.11Å; R770-W772 VanDerWaalsContact C-N 3.34Å; R770-W772 PolarHBondContact O-N 3.03Å; W772-A775 WeakPolarHBondContact O-CB 3.42Å; W772-A775 PolarHBondContact O-N 3.48Å; W772-I781 HydrophobicContact CZ2-CG2 4.27Å; W772-S784 VanDerWaalsContact CD1-OG 3.27Å; W772-V786 HydrophobicContact CB-CG2 4.01Å; W772-V786 HydrophobicContact CG-CG2 4.36Å; W772-L791 HydrophobicContact CD2-CD1 4.4Å; W772-L791 HydrophobicContact CD2-CD2 3.43Å; W772-L791 VanDerWaalsContact CD2-CD2 3.43Å; W772-L791 HydrophobicContact CE3-CD2 3.46Å; W772-L791 VanDerWaalsContact CE3-CD2 3.46Å; W772-L791 HydrophobicContact CG-CD2 3.94Å; W772-L791 HydrophobicContact CH2-CD1 4.49Å; W772-L791 HydrophobicContact CH2-CD2 4.1Å; W772-L791 HydrophobicContact CZ2-CD1 3.89Å; W772-L791 HydrophobicContact CZ2-CD2 4.06Å; W772-L791 HydrophobicContact CZ3-CD2 3.82Å; W772-L795 HydrophobicContact CH2-CD1 3.82Å; W772-L795 HydrophobicContact CZ3-CD1 3.74Å
773	L	71	Confident	62.2	Low	39 Å²	39	59.1 Å²	59.1	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-69.1	-37.9	178.8	-69	168.1	0	0	0	112	T649 H722 L769 R770 A775 V794 L795	T649-L773 HydrophobicContact CG2-CD1 3.84Å; H722-L773 PolarHBondContact CE1-O 3.36Å; L769-L773 HydrophobicContact CD1-CD1 4.27Å; L769-L773 HydrophobicContact CD1-CG 4.39Å; L769-L773 HydrophobicContact CG-CD1 4.08Å; L769-L773 WeakPolarHBondContact O-CG 3.31Å; L769-L773 PolarHBondContact O-N 3.39Å; R770-L773 PolarHBondContact O-N 3.25Å; L773-A775 VanDerWaalsContact C-N 3.32Å; L773-V794 HydrophobicContact CD1-CG1 3.96Å; L773-V794 HydrophobicContact CD2-CG1 4.16Å; L773-L795 HydrophobicContact CD2-CD2 3.88Å
774	S	68.8	Low	62.5	Low	90 Å²	90	55.5 Å²	55.5	63%	0.629	32%	0.32	S	S	*	.	H	α-helix	trans	-80.1	-11.4	176	65	0	0	0	0	113.9	R770 K771 S776	R770-S774 PolarHBondContact O-N 3.14Å; R770-S774 PolarHBondContact O-OG 3.28Å; R770-S774 VanDerWaalsContact O-OG 3.13Å; K771-S774 PolarHBondContact O-OG 3.47Å; S774-S776 PolarHBondContact O-N 2.96Å
775	A	66.8	Low	62.8	Low	14 Å²	14	58.8 Å²	58.8	12%	0.116	33%	0.334	C	S	.	.			trans	-68.2	104.7	-179.5	0	0	0	0	0	112	K771 W772 L773 S777 I781	K771-A775 VanDerWaalsContact O-CB 3.29Å; K771-A775 WeakPolarHBondContact O-CB 3.37Å; K771-A775 PolarHBondContact O-N 2.9Å; K771-A775 VanDerWaalsContact O-N 3.09Å; W772-A775 WeakPolarHBondContact O-CB 3.42Å; W772-A775 PolarHBondContact O-N 3.48Å; L773-A775 VanDerWaalsContact C-N 3.32Å; A775-S777 VanDerWaalsContact C-N 3.34Å; A775-I781 HydrophobicContact CB-CG1 3.85Å
776	S	57.3	Low	63.1	Low	110 Å²	110	57.6 Å²	57.6	77%	0.769	33%	0.328	S	S	*	.			trans	-72.4	-26.2	172	-67.6	0	0	0	0	113.1	S774	S774-S776 PolarHBondContact O-N 2.96Å
777	S	54.8	Low	63.5	Low	61 Å²	61	59 Å²	59	43%	0.427	34%	0.337	S	S	.	.	S	Bend	trans	-103.9	137.2	-177.2	-177.7	0	0	0	0	113.1	A775 S779 S780	A775-S777 VanDerWaalsContact C-N 3.34Å; S777-S779 PolarHBondContact O-N 3.29Å; S777-S779 VanDerWaalsContact O-N 3.15Å; S777-S779 PolarHBondContact OG-OG 2.57Å; S777-S779 VanDerWaalsContact OG-OG 3.04Å; S777-S780 PolarHBondContact O-N 3.46Å
778	R	56.6	Low	63.8	Low	127 Å²	127	58.3 Å²	58.3	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-22.4	177.4	-70.8	179.2	69.2	172.8	5.8	114.1
779	S	50.6	Low	64	Low	82 Å²	82	59.4 Å²	59.4	57%	0.573	34%	0.337	S	S	*	.	H	α-helix	trans	-69.8	-43.9	178.4	48.9	0	0	0	0	111.6	S777 I781 N782	S777-S779 PolarHBondContact O-N 3.29Å; S777-S779 VanDerWaalsContact O-N 3.15Å; S777-S779 PolarHBondContact OG-OG 2.57Å; S777-S779 VanDerWaalsContact OG-OG 3.04Å; S779-I781 VanDerWaalsContact C-N 3.28Å; S779-I781 PolarHBondContact O-N 3.03Å; S779-N782 PolarHBondContact O-N 2.5Å
780	S	52.8	Low	64.3	Low	55 Å²	55	59.3 Å²	59.3	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-65.9	-29.7	178.2	-56.9	0	0	0	0	113	S777 N782 S783	S777-S780 PolarHBondContact O-N 3.46Å; S780-N782 VanDerWaalsContact C-N 3.31Å; S780-N782 PolarHBondContact O-N 2.67Å; S780-S783 PolarHBondContact O-N 3.16Å; S780-S783 PolarHBondContact O-OG 3.18Å
781	I	56.1	Low	64.4	Low	12 Å²	12	54.7 Å²	54.7	6%	0.062	32%	0.32	C	S	.	.	H	α-helix	trans	-64.8	-31.5	179.4	-73	175.2	0	0	0	112.9	N725 W772 A775 S779 S784	N725-I781 HydrophobicContact CB-CD1 4.3Å; N725-I781 VanDerWaalsContact ND2-CD1 3.3Å; N725-I781 WeakPolarHBondContact ND2-CD1 3.1Å; W772-I781 HydrophobicContact CZ2-CG2 4.27Å; A775-I781 HydrophobicContact CB-CG1 3.85Å; S779-I781 VanDerWaalsContact C-N 3.28Å; S779-I781 PolarHBondContact O-N 3.03Å; I781-S784 PolarHBondContact O-OG 3.39Å
782	N	55.7	Low	64.5	Low	90 Å²	90	50.5 Å²	50.5	48%	0.481	30%	0.302	S	S	.	.	H	α-helix	trans	-78.8	-23.2	-177.4	-82.6	-15.5	0	0	0	113.3	Y728 S779 S780	Y728-N782 WeakPolarHBondContact CE1-OD1 3.34Å; S779-N782 PolarHBondContact O-N 2.5Å; S780-N782 VanDerWaalsContact C-N 3.31Å; S780-N782 PolarHBondContact O-N 2.67Å
783	S	52.1	Low	64.7	Low	88 Å²	88	50.4 Å²	50.4	62%	0.615	30%	0.301	S	S	*	.	H	α-helix	trans	-83.3	-29.3	-176.9	58.2	0	0	0	0	112.9	S780 N785	S780-S783 PolarHBondContact O-N 3.16Å; S780-S783 PolarHBondContact O-OG 3.18Å; S783-N785 PolarHBondContact O-N 3.31Å
784	S	58.7	Low	64.9	Low	15 Å²	15	49.4 Å²	49.4	11%	0.105	30%	0.297	C	S	.	.	S	Bend	trans	-78.6	103.4	174.7	52	0	0	0	0	110.5	W772 I781 V786	W772-S784 VanDerWaalsContact CD1-OG 3.27Å; I781-S784 PolarHBondContact O-OG 3.39Å; S784-V786 PolarHBondContact O-N 3.09Å
785	N	65	Low	65	Low	114 Å²	114	45.7 Å²	45.7	61%	0.61	27%	0.27	S	S	*	.			trans	-72.5	65.4	172.8	-87.1	-30.5	0	0	0	111.1	K736 S783	K736-N785 PolarHBondContact NZ-OD1 2.8Å; S783-N785 PolarHBondContact O-N 3.31Å
786	V	70.4	Confident	65.2	Low	16 Å²	16	46.7 Å²	46.7	10%	0.097	28%	0.276	C	S	.	.			trans	-82.5	131.4	175.7	-174.5	0	0	0	0	109.6	K768 L769 W772 S784 V788 D790 L791	K768-V786 HydrophobicContact CB-CG2 3.86Å; K768-V786 WeakPolarHBondContact O-CG2 3.26Å; L769-V786 HydrophobicContact CB-CG1 4.22Å; L769-V786 HydrophobicContact CD1-CG1 3.74Å; W772-V786 HydrophobicContact CB-CG2 4.01Å; W772-V786 HydrophobicContact CG-CG2 4.36Å; S784-V786 PolarHBondContact O-N 3.09Å; V786-V788 PolarHBondContact O-N 2.97Å; V786-D790 HydrophobicContact CG1-CB 4.44Å; V786-L791 HydrophobicContact CB-CD1 4.46Å; V786-L791 HydrophobicContact CB-CD2 4.35Å; V786-L791 HydrophobicContact CB-CG 4.31Å; V786-L791 HydrophobicContact CG1-CD1 4.5Å; V786-L791 HydrophobicContact CG1-CD2 3.88Å; V786-L791 HydrophobicContact CG1-CG 3.83Å
787	P	72.1	Confident	66.2	Low	44 Å²	44	43.5 Å²	43.5	29%	0.286	25%	0.247	S	C	.	.			trans	-57.2	134.9	174	-23.4	33.8	0	0	0	111.7	Q789 D790 L791	P787-Q789 PolarHBondContact O-N 3.14Å; P787-D790 PolarHBondContact O-N 2.77Å; P787-D790 VanDerWaalsContact O-N 3.11Å; P787-L791 PolarHBondContact O-N 3.31Å
788	V	74.2	Confident	67.2	Low	9 Å²	9	45 Å²	45	6%	0.055	25%	0.25	C	S	.	.	H	α-helix	trans	-61.8	-31.2	-179.5	173.5	0	0	0	0	111.7	L726 A729 R730 E733 V786 D790 L791 E792	L726-V788 HydrophobicContact CD1-CG1 4.41Å; A729-V788 HydrophobicContact CB-CG2 4.24Å; R730-V788 HydrophobicContact CB-CG1 4.45Å; R730-V788 HydrophobicContact CG-CG1 3.59Å; E733-V788 HydrophobicContact CB-CG2 3.68Å; E733-V788 VanDerWaalsContact CD-CG2 3.44Å; E733-V788 HydrophobicContact CG-CG2 4.12Å; E733-V788 WeakPolarHBondContact OE2-CB 3.47Å; E733-V788 WeakPolarHBondContact OE2-CG2 3.49Å; V786-V788 PolarHBondContact O-N 2.97Å; V788-D790 VanDerWaalsContact C-N 3.31Å; V788-D790 PolarHBondContact O-N 3.35Å; V788-L791 PolarHBondContact O-N 2.75Å; V788-E792 HydrophobicContact CG1-CG 4.19Å; V788-E792 WeakPolarHBondContact O-CB 3.48Å; V788-E792 VanDerWaalsContact O-CG 3.31Å; V788-E792 WeakPolarHBondContact O-CG 3.07Å; V788-E792 PolarHBondContact O-N 3.23Å
789	Q	74.8	Confident	68.2	Low	59 Å²	59	39 Å²	39	28%	0.276	23%	0.228	S	C	.	.	H	α-helix	trans	-63.2	-36	177.6	-62.9	170.5	7.8	0	0	112.5	P787 L793	P787-Q789 PolarHBondContact O-N 3.14Å; Q789-L793 WeakPolarHBondContact O-CB 3.44Å; Q789-L793 PolarHBondContact O-N 3.41Å
790	D	75.4	Confident	69.4	Low	10 Å²	10	37.2 Å²	37.2	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-73.8	-39.4	175.7	-73.1	-30.2	0	0	0	111.3	K645 H687 V786 P787 V788 E792 L793 V794	K645-D790 IonicContact NZ-OD1 3.45Å; K645-D790 PolarHBondContact NZ-OD1 2.91Å; K645-D790 IonicContact NZ-OD2 3.39Å; K645-D790 PolarHBondContact NZ-OD2 3.11Å; H687-D790 IonicContact CE1-OD1 3.63Å; H687-D790 PolarHBondContact CE1-OD1 2.79Å; H687-D790 VanDerWaalsContact CE1-OD1 3.29Å; H687-D790 IonicContact NE2-OD1 3.06Å; H687-D790 PolarHBondContact NE2-OD1 3.02Å; V786-D790 HydrophobicContact CG1-CB 4.44Å; P787-D790 PolarHBondContact O-N 2.77Å; P787-D790 VanDerWaalsContact O-N 3.11Å; V788-D790 VanDerWaalsContact C-N 3.31Å; V788-D790 PolarHBondContact O-N 3.35Å; D790-E792 VanDerWaalsContact C-N 3.33Å; D790-E792 PolarHBondContact O-N 3Å; D790-L793 WeakPolarHBondContact O-CB 3.2Å; D790-L793 PolarHBondContact O-N 3Å; D790-V794 PolarHBondContact O-N 2.96Å
791	L	73.5	Confident	70.7	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-42.6	171.6	-64.7	173.7	0	0	0	111.4	L726 A729 L769 W772 V786 P787 V788 L793 L795	L726-L791 HydrophobicContact CD1-CB 3.63Å; A729-L791 HydrophobicContact CB-CD1 3.89Å; L769-L791 HydrophobicContact CD1-CD2 3.71Å; W772-L791 HydrophobicContact CD2-CD1 4.4Å; W772-L791 HydrophobicContact CD2-CD2 3.43Å; W772-L791 VanDerWaalsContact CD2-CD2 3.43Å; W772-L791 HydrophobicContact CE3-CD2 3.46Å; W772-L791 VanDerWaalsContact CE3-CD2 3.46Å; W772-L791 HydrophobicContact CG-CD2 3.94Å; W772-L791 HydrophobicContact CH2-CD1 4.49Å; W772-L791 HydrophobicContact CH2-CD2 4.1Å; W772-L791 HydrophobicContact CZ2-CD1 3.89Å; W772-L791 HydrophobicContact CZ2-CD2 4.06Å; W772-L791 HydrophobicContact CZ3-CD2 3.82Å; V786-L791 HydrophobicContact CB-CD1 4.46Å; V786-L791 HydrophobicContact CB-CD2 4.35Å; V786-L791 HydrophobicContact CB-CG 4.31Å; V786-L791 HydrophobicContact CG1-CD1 4.5Å; V786-L791 HydrophobicContact CG1-CD2 3.88Å; V786-L791 HydrophobicContact CG1-CG 3.83Å; P787-L791 PolarHBondContact O-N 3.31Å; V788-L791 PolarHBondContact O-N 2.75Å; L791-L793 VanDerWaalsContact C-N 3.34Å; L791-L795 HydrophobicContact CB-CD1 4.42Å; L791-L795 WeakPolarHBondContact O-CB 3.43Å; L791-L795 WeakPolarHBondContact O-CG 3.21Å; L791-L795 PolarHBondContact O-N 3.01Å
792	E	73.9	Confident	72	Confident	19 Å²	19	37.2 Å²	37.2	9%	0.089	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-42.4	174.4	-75.6	-174	168.1	0	0	111.8	R691 L726 R730 V788 D790 V794 L795 C796 Y797	R691-E792 IonicContact CZ-OE2 3.83Å; R691-E792 IonicContact NE-OE2 3.16Å; R691-E792 IonicContact NH2-OE2 3.86Å; R691-E792 PolarHBondContact NH2-OE2 2.54Å; L726-E792 HydrophobicContact CD1-CG 3.91Å; L726-E792 HydrophobicContact CD2-CG 4.26Å; R730-E792 IonicContact CZ-OE1 2.7Å; R730-E792 IonicContact NE-OE1 2.74Å; R730-E792 PolarHBondContact NE-OE1 2.94Å; R730-E792 IonicContact NH2-OE1 2.82Å; R730-E792 PolarHBondContact NH2-OE1 2.93Å; R730-E792 IonicContact NH2-OE2 3.18Å; V788-E792 HydrophobicContact CG1-CG 4.19Å; V788-E792 WeakPolarHBondContact O-CB 3.48Å; V788-E792 VanDerWaalsContact O-CG 3.31Å; V788-E792 WeakPolarHBondContact O-CG 3.07Å; V788-E792 PolarHBondContact O-N 3.23Å; D790-E792 VanDerWaalsContact C-N 3.33Å; D790-E792 PolarHBondContact O-N 3Å; E792-V794 VanDerWaalsContact C-N 3.34Å; E792-V794 PolarHBondContact O-N 2.94Å; E792-L795 PolarHBondContact O-N 2.89Å; E792-C796 WeakPolarHBondContact O-CA 3.46Å; E792-C796 WeakPolarHBondContact O-CB 3.38Å; E792-C796 PolarHBondContact O-N 3.21Å; E792-Y797 VanDerWaalsContact O-CD2 3.26Å; E792-Y797 WeakPolarHBondContact O-CD2 3.45Å
793	L	78.9	Confident	73.2	Confident	3 Å²	3	33 Å²	33	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-56.1	-49.4	178.7	-178.1	59.3	0	0	0	110.9	W641 K645 V690 Q789 D790 L791 Y797 L799	W641-L793 HydrophobicContact CH2-CD2 3.85Å; W641-L793 HydrophobicContact CZ2-CD2 4.36Å; W641-L793 HydrophobicContact CZ3-CD2 4.42Å; K645-L793 HydrophobicContact CB-CD2 4.23Å; K645-L793 HydrophobicContact CD-CD2 3.93Å; K645-L793 HydrophobicContact CG-CD2 4Å; V690-L793 HydrophobicContact CB-CD1 4.36Å; V690-L793 HydrophobicContact CG1-CD1 3.88Å; V690-L793 HydrophobicContact CG2-CD1 3.92Å; Q789-L793 WeakPolarHBondContact O-CB 3.44Å; Q789-L793 PolarHBondContact O-N 3.41Å; D790-L793 WeakPolarHBondContact O-CB 3.2Å; D790-L793 PolarHBondContact O-N 3Å; L791-L793 VanDerWaalsContact C-N 3.34Å; L793-Y797 WeakPolarHBondContact O-CB 3.19Å; L793-Y797 PolarHBondContact O-N 3.21Å; L793-Y797 VanDerWaalsContact O-O 3.14Å; L793-L799 HydrophobicContact CD1-CD1 3.55Å; L793-L799 HydrophobicContact CD2-CD1 4.06Å; L793-L799 HydrophobicContact CG-CD1 3.51Å
794	V	74.4	Confident	74.7	Confident	19 Å²	19	34.6 Å²	34.6	12%	0.115	19%	0.191	C	C	.	.	H	α-helix	trans	-75.8	-38.1	-178.3	178.1	0	0	0	0	113	T649 L651 L769 L773 D790 E792 L799	T649-V794 HydrophobicContact CG2-CG1 4.04Å; T649-V794 HydrophobicContact CG2-CG2 3.86Å; L651-V794 HydrophobicContact CD1-CG1 4.38Å; L769-V794 HydrophobicContact CD2-CG2 4.02Å; L773-V794 HydrophobicContact CD1-CG1 3.96Å; L773-V794 HydrophobicContact CD2-CG1 4.16Å; D790-V794 PolarHBondContact O-N 2.96Å; E792-V794 VanDerWaalsContact C-N 3.34Å; E792-V794 PolarHBondContact O-N 2.94Å; V794-L799 HydrophobicContact CG2-CD2 4.3Å
795	L	70.2	Confident	75.9	Confident	11 Å²	11	34.3 Å²	34.3	6%	0.058	19%	0.189	C	C	.	.	H	α-helix	trans	-91.5	-39.7	-170.6	-62.3	174.9	0	0	0	113.1	R719 H722 F723 L726 W772 L773 L791 E792	R719-L795 VanDerWaalsContact CZ-O 3.32Å; R719-L795 PolarHBondContact NH1-O 3.05Å; R719-L795 PolarHBondContact NH2-O 3.21Å; R719-L795 VanDerWaalsContact NH2-O 3.14Å; H722-L795 HydrophobicContact CB-CD1 4.16Å; H722-L795 HydrophobicContact CB-CD2 3.61Å; H722-L795 HydrophobicContact CB-CG 4.48Å; F723-L795 WeakPolarHBondContact CZ-O 3.27Å; L726-L795 HydrophobicContact CB-CD1 3.83Å; L726-L795 HydrophobicContact CD1-CD1 4.29Å; L726-L795 HydrophobicContact CD2-CB 4.2Å; L726-L795 HydrophobicContact CD2-CD1 4.33Å; L726-L795 HydrophobicContact CG-CD1 4.37Å; W772-L795 HydrophobicContact CH2-CD1 3.82Å; W772-L795 HydrophobicContact CZ3-CD1 3.74Å; L773-L795 HydrophobicContact CD2-CD2 3.88Å; L791-L795 HydrophobicContact CB-CD1 4.42Å; L791-L795 WeakPolarHBondContact O-CB 3.43Å; L791-L795 WeakPolarHBondContact O-CG 3.21Å; L791-L795 PolarHBondContact O-N 3.01Å; E792-L795 PolarHBondContact O-N 2.89Å
796	C	72.4	Confident	76.8	Confident	35 Å²	35	28.9 Å²	28.9	24%	0.236	16%	0.16	C	C	.	.	H	α-helix	trans	-83.3	-29.9	-178.9	-59.9	0	0	0	0	111.9	L726 E792	L726-C796 WeakPolarHBondContact CD2-SG 3.32Å; E792-C796 WeakPolarHBondContact O-CA 3.46Å; E792-C796 WeakPolarHBondContact O-CB 3.38Å; E792-C796 PolarHBondContact O-N 3.21Å
797	Y	77.3	Confident	77.5	Confident	44 Å²	44	31.4 Å²	31.4	17%	0.173	17%	0.173	C	C	.	.	S	Bend	trans	-117.5	141.6	-174.4	-48.3	-80.7	0	0	0	110.4	V690 R691 S694 E792 L793 L799	V690-Y797 HydrophobicContact CG1-CD1 4Å; V690-Y797 HydrophobicContact CG1-CD2 3.92Å; V690-Y797 HydrophobicContact CG1-CE1 4.36Å; V690-Y797 HydrophobicContact CG1-CE2 4.26Å; V690-Y797 HydrophobicContact CG1-CG 3.77Å; R691-Y797 WeakPolarHBondContact CG-OH 3.32Å; S694-Y797 VanDerWaalsContact CB-CE1 3.45Å; E792-Y797 VanDerWaalsContact O-CD2 3.26Å; E792-Y797 WeakPolarHBondContact O-CD2 3.45Å; L793-Y797 WeakPolarHBondContact O-CB 3.19Å; L793-Y797 PolarHBondContact O-N 3.21Å; L793-Y797 VanDerWaalsContact O-O 3.14Å; Y797-L799 PolarHBondContact O-N 3.41Å; Y797-L799 VanDerWaalsContact O-N 3.09Å
798	N	76.8	Confident	78	Confident	91 Å²	91	34.5 Å²	34.5	49%	0.487	19%	0.186	S	C	.	.			trans	-78.3	97	176.4	-174.9	-20	0	0	0	108.8	S800 S801 L802	N798-S800 VanDerWaalsContact C-N 3.28Å; N798-S800 PolarHBondContact O-N 2.66Å; N798-S800 PolarHBondContact OD1-N 2.67Å; N798-S800 VanDerWaalsContact OD1-N 3.12Å; N798-S800 PolarHBondContact OD1-OG 3.11Å; N798-S801 PolarHBondContact O-N 3.22Å; N798-S801 PolarHBondContact OD1-N 3.1Å; N798-L802 WeakPolarHBondContact O-CG 3.5Å; N798-L802 PolarHBondContact O-N 3.26Å
799	L	77.7	Confident	78.4	Confident	3 Å²	3	35 Å²	35	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-31.8	-177.7	-142.9	65.5	0	0	0	112.6	K645 L793 V794 Y797 L802 A803	K645-L799 HydrophobicContact CB-CD2 4.29Å; L793-L799 HydrophobicContact CD1-CD1 3.55Å; L793-L799 HydrophobicContact CD2-CD1 4.06Å; L793-L799 HydrophobicContact CG-CD1 3.51Å; V794-L799 HydrophobicContact CG2-CD2 4.3Å; Y797-L799 PolarHBondContact O-N 3.41Å; Y797-L799 VanDerWaalsContact O-N 3.09Å; L799-L802 HydrophobicContact CD1-CD1 4.1Å; L799-L802 PolarHBondContact O-N 3.41Å; L799-A803 WeakPolarHBondContact O-CB 3.41Å; L799-A803 PolarHBondContact O-N 2.97Å
800	S	75.8	Confident	78.7	Confident	43 Å²	43	36.4 Å²	36.4	30%	0.301	19%	0.194	S	C	.	.	H	α-helix	trans	-66.3	-43.9	175.1	69.3	0	0	0	0	111.5	N798 L802 A803 Q804	N798-S800 VanDerWaalsContact C-N 3.28Å; N798-S800 PolarHBondContact O-N 2.66Å; N798-S800 PolarHBondContact OD1-N 2.67Å; N798-S800 VanDerWaalsContact OD1-N 3.12Å; N798-S800 PolarHBondContact OD1-OG 3.11Å; S800-L802 VanDerWaalsContact C-N 3.32Å; S800-L802 PolarHBondContact O-N 3.05Å; S800-A803 PolarHBondContact O-N 3.27Å; S800-Q804 WeakPolarHBondContact O-CB 3.28Å; S800-Q804 VanDerWaalsContact O-CG 3.28Å; S800-Q804 WeakPolarHBondContact O-CG 3.38Å; S800-Q804 PolarHBondContact O-N 2.94Å
801	S	78.5	Confident	79.2	Confident	55 Å²	55	42.3 Å²	42.3	39%	0.385	23%	0.226	S	C	.	.	H	α-helix	trans	-65.2	-35.8	174.7	175.4	0	0	0	0	112.1	N798 S805	N798-S801 PolarHBondContact O-N 3.22Å; N798-S801 PolarHBondContact OD1-N 3.1Å; S801-S805 VanDerWaalsContact O-CB 3.29Å; S801-S805 WeakPolarHBondContact O-CB 3.5Å; S801-S805 PolarHBondContact O-N 3.13Å
802	L	83.3	Confident	79.8	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.063	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-44.6	173.7	-72.8	169.3	0	0	0	111.7	I642 V690 R693 N798 L799 S800 S805 A806	I642-L802 HydrophobicContact CD1-CD1 4.39Å; I642-L802 HydrophobicContact CG2-CB 3.78Å; V690-L802 HydrophobicContact CG1-CD1 4.16Å; R693-L802 VanDerWaalsContact CZ-CD2 3.41Å; N798-L802 WeakPolarHBondContact O-CG 3.5Å; N798-L802 PolarHBondContact O-N 3.26Å; L799-L802 HydrophobicContact CD1-CD1 4.1Å; L799-L802 PolarHBondContact O-N 3.41Å; S800-L802 VanDerWaalsContact C-N 3.32Å; S800-L802 PolarHBondContact O-N 3.05Å; L802-S805 WeakPolarHBondContact O-CB 3.38Å; L802-S805 PolarHBondContact O-N 3.24Å; L802-A806 WeakPolarHBondContact O-CB 3.4Å; L802-A806 PolarHBondContact O-N 3.38Å
803	A	82.9	Confident	80.4	Confident	3 Å²	3	46.6 Å²	46.6	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-39.6	177.5	0	0	0	0	0	112.3	I642 I652 L799 S800 A806 N807	I642-A803 HydrophobicContact CG2-CB 4.34Å; I652-A803 HydrophobicContact CD1-CB 3.99Å; L799-A803 WeakPolarHBondContact O-CB 3.41Å; L799-A803 PolarHBondContact O-N 2.97Å; S800-A803 PolarHBondContact O-N 3.27Å; A803-A806 WeakPolarHBondContact O-CB 3.42Å; A803-A806 PolarHBondContact O-N 2.79Å; A803-N807 PolarHBondContact O-N 2.94Å
804	Q	82.5	Confident	80.8	Confident	121 Å²	121	51.8 Å²	51.8	57%	0.565	28%	0.276	S	S	*	.	H	α-helix	trans	-60.9	-45.5	171.2	-73.9	170.3	-6.7	0	0	111.2	S800 A806 N807 I808	S800-Q804 WeakPolarHBondContact O-CB 3.28Å; S800-Q804 VanDerWaalsContact O-CG 3.28Å; S800-Q804 WeakPolarHBondContact O-CG 3.38Å; S800-Q804 PolarHBondContact O-N 2.94Å; Q804-A806 VanDerWaalsContact C-N 3.29Å; Q804-A806 PolarHBondContact O-N 3.29Å; Q804-N807 PolarHBondContact O-N 3.35Å; Q804-I808 VanDerWaalsContact O-CG1 3.27Å; Q804-I808 WeakPolarHBondContact O-CG1 3.27Å; Q804-I808 PolarHBondContact O-N 2.86Å
805	S	83.1	Confident	81.3	Confident	8 Å²	8	53 Å²	53	6%	0.056	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-39.1	175.3	-179.8	0	0	0	0	112	R693 S801 L802 Q809	R693-S805 PolarHBondContact NH2-OG 3.11Å; S801-S805 VanDerWaalsContact O-CB 3.29Å; S801-S805 WeakPolarHBondContact O-CB 3.5Å; S801-S805 PolarHBondContact O-N 3.13Å; L802-S805 WeakPolarHBondContact O-CB 3.38Å; L802-S805 PolarHBondContact O-N 3.24Å; S805-Q809 WeakPolarHBondContact O-CB 3.47Å; S805-Q809 WeakPolarHBondContact O-CG 3.42Å; S805-Q809 PolarHBondContact O-N 2.67Å; S805-Q809 PolarHBondContact O-NE2 2.98Å; S805-Q809 PolarHBondContact OG-NE2 3.5Å
806	A	84.8	Confident	82.1	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-66.6	-44.3	176.1	0	0	0	0	0	111.7	D639 L802 A803 Q804 I808 Q809 Q810	D639-A806 HydrophobicContact CB-CB 3.69Å; L802-A806 WeakPolarHBondContact O-CB 3.4Å; L802-A806 PolarHBondContact O-N 3.38Å; A803-A806 WeakPolarHBondContact O-CB 3.42Å; A803-A806 PolarHBondContact O-N 2.79Å; Q804-A806 VanDerWaalsContact C-N 3.29Å; Q804-A806 PolarHBondContact O-N 3.29Å; A806-I808 PolarHBondContact O-N 3.31Å; A806-Q809 WeakPolarHBondContact O-CB 3.47Å; A806-Q809 PolarHBondContact O-N 3.01Å; A806-Q809 VanDerWaalsContact O-N 3.14Å; A806-Q810 PolarHBondContact O-N 2.95Å
807	N	85.1	Confident	82.9	Confident	69 Å²	69	55.1 Å²	55.1	37%	0.369	30%	0.296	S	S	.	.	H	α-helix	trans	-62	-42.1	175.9	-73.7	-14.8	0	0	0	112	A803 Q804 Q809 Q810 N811	A803-N807 PolarHBondContact O-N 2.94Å; Q804-N807 PolarHBondContact O-N 3.35Å; N807-Q809 VanDerWaalsContact C-N 3.29Å; N807-Q809 PolarHBondContact O-N 3.32Å; N807-Q810 PolarHBondContact O-N 3.34Å; N807-N811 WeakPolarHBondContact O-CB 3.43Å; N807-N811 PolarHBondContact O-N 3.16Å
808	I	81.9	Confident	83.5	Confident	108 Å²	108	54.5 Å²	54.5	55%	0.554	30%	0.295	S	S	*	.	H	α-helix	trans	-62.8	-39.1	175.2	-66.3	163.4	0	0	0	110.5	Q804 A806 N811 M812	Q804-I808 VanDerWaalsContact O-CG1 3.27Å; Q804-I808 WeakPolarHBondContact O-CG1 3.27Å; Q804-I808 PolarHBondContact O-N 2.86Å; A806-I808 PolarHBondContact O-N 3.31Å; I808-N811 CarbonylContact O-C 3.37Å; I808-N811 PolarHBondContact O-N 3.48Å; I808-M812 WeakPolarHBondContact O-CG 3.28Å; I808-M812 PolarHBondContact O-N 3.18Å
809	Q	82.7	Confident	84.1	Confident	21 Å²	21	50.7 Å²	50.7	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-41.1	177.6	-78	168.3	48.2	0	0	112.2	N588 P589 S592 D639 S805 A806 N807 N811 M812	N588-Q809 PolarHBondContact O-NE2 3.34Å; P589-Q809 HydrophobicContact CB-CG 4.03Å; S592-Q809 PolarHBondContact OG-OE1 2.72Å; D639-Q809 WeakPolarHBondContact OD2-CB 3.5Å; D639-Q809 PolarHBondContact OD2-OE1 3.37Å; S805-Q809 WeakPolarHBondContact O-CB 3.47Å; S805-Q809 WeakPolarHBondContact O-CG 3.42Å; S805-Q809 PolarHBondContact O-N 2.67Å; S805-Q809 PolarHBondContact O-NE2 2.98Å; S805-Q809 PolarHBondContact OG-NE2 3.5Å; A806-Q809 WeakPolarHBondContact O-CB 3.47Å; A806-Q809 PolarHBondContact O-N 3.01Å; A806-Q809 VanDerWaalsContact O-N 3.14Å; N807-Q809 VanDerWaalsContact C-N 3.29Å; N807-Q809 PolarHBondContact O-N 3.32Å; Q809-N811 VanDerWaalsContact C-N 3.31Å; Q809-N811 PolarHBondContact O-N 2.88Å; Q809-M812 HydrophobicContact CG-CE 4.26Å; Q809-M812 WeakPolarHBondContact O-CG 3.33Å; Q809-M812 PolarHBondContact O-N 3Å
810	Q	81.1	Confident	84.8	Confident	87 Å²	87	50.8 Å²	50.8	41%	0.407	28%	0.275	S	S	.	.	H	α-helix	trans	-67.8	-30.4	175.2	-71.1	-172.3	-9.4	0	0	113	A806 N807	A806-Q810 PolarHBondContact O-N 2.95Å; N807-Q810 PolarHBondContact O-N 3.34Å
811	N	85.4	Confident	85.6	Confident	134 Å²	134	49 Å²	49	72%	0.717	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	15.4	179.9	-66.4	-16	0	0	0	113.6	N807 I808 Q809 T813	N807-N811 WeakPolarHBondContact O-CB 3.43Å; N807-N811 PolarHBondContact O-N 3.16Å; I808-N811 CarbonylContact O-C 3.37Å; I808-N811 PolarHBondContact O-N 3.48Å; Q809-N811 VanDerWaalsContact C-N 3.31Å; Q809-N811 PolarHBondContact O-N 2.88Å; N811-T813 PolarHBondContact O-N 3.05Å
812	M	86.4	Confident	86.2	Confident	33 Å²	33	46.5 Å²	46.5	16%	0.163	25%	0.245	C	C	.	.			trans	-63.7	136.4	178.4	-79.6	-166.3	169.6	0	0	111.7	P589 I808 Q809 D816 L817 L820	P589-M812 HydrophobicContact CB-CE 3.79Å; P589-M812 HydrophobicContact CB-SD 4.44Å; P589-M812 HydrophobicContact CG-CE 3.61Å; I808-M812 WeakPolarHBondContact O-CG 3.28Å; I808-M812 PolarHBondContact O-N 3.18Å; Q809-M812 HydrophobicContact CG-CE 4.26Å; Q809-M812 WeakPolarHBondContact O-CG 3.33Å; Q809-M812 PolarHBondContact O-N 3Å; M812-D816 HydrophobicContact CB-CB 4.05Å; M812-D816 HydrophobicContact CG-CB 4.19Å; M812-D816 HydrophobicContact SD-CB 4.28Å; M812-L817 HydrophobicContact CB-CD2 4.34Å; M812-L817 HydrophobicContact CB-CG 4.21Å; M812-L820 HydrophobicContact SD-CD2 4.24Å
813	T	88.1	Confident	86.6	Confident	77 Å²	77	46 Å²	46	47%	0.472	24%	0.242	S	C	.	.			trans	-71.2	163.5	174.2	70.7	0	0	0	0	110.5	N811 A815 D816 L817	N811-T813 PolarHBondContact O-N 3.05Å; T813-A815 PolarHBondContact O-N 3.14Å; T813-A815 PolarHBondContact OG1-N 3.14Å; T813-D816 WeakPolarHBondContact CB-OD2 3.5Å; T813-D816 PolarHBondContact N-OD2 2.96Å; T813-D816 WeakPolarHBondContact O-CB 3.44Å; T813-D816 PolarHBondContact O-N 3.35Å; T813-D816 VanDerWaalsContact O-N 3.13Å; T813-D816 PolarHBondContact OG1-N 2.82Å; T813-D816 PolarHBondContact OG1-OD2 3.46Å; T813-L817 WeakPolarHBondContact O-CG 3.18Å; T813-L817 PolarHBondContact O-N 2.86Å
814	Q	85.7	Confident	87	Confident	113 Å²	113	45.9 Å²	45.9	53%	0.528	24%	0.241	S	C	.	.	H	α-helix	trans	-58	-35.7	173.1	-177.4	65	0.8	0	0	111.8	L817 Q818	Q814-L817 PolarHBondContact O-N 3.05Å; Q814-Q818 VanDerWaalsContact O-CG 3.31Å; Q814-Q818 WeakPolarHBondContact O-CG 3.17Å; Q814-Q818 PolarHBondContact O-N 3.07Å
815	A	85.2	Confident	87.5	Confident	44 Å²	44	40.1 Å²	40.1	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-64.6	-42.6	176.5	0	0	0	0	0	111.6	T813 L817 Q818 L819 A1080	T813-A815 PolarHBondContact O-N 3.14Å; T813-A815 PolarHBondContact OG1-N 3.14Å; A815-L817 VanDerWaalsContact C-N 3.34Å; A815-L817 PolarHBondContact O-N 3.13Å; A815-Q818 PolarHBondContact O-N 3.06Å; A815-L819 PolarHBondContact O-N 2.76Å; A815-A1080 HydrophobicContact CB-CB 4.43Å
816	D	88	Confident	87.8	Confident	57 Å²	57	39.8 Å²	39.8	31%	0.305	21%	0.212	S	C	.	.	H	α-helix	trans	-62.4	-41.9	176.5	-60.4	-46.7	0	0	0	111.5	M812 T813 Q818 L819 L820	M812-D816 HydrophobicContact CB-CB 4.05Å; M812-D816 HydrophobicContact CG-CB 4.19Å; M812-D816 HydrophobicContact SD-CB 4.28Å; T813-D816 WeakPolarHBondContact CB-OD2 3.5Å; T813-D816 PolarHBondContact N-OD2 2.96Å; T813-D816 WeakPolarHBondContact O-CB 3.44Å; T813-D816 PolarHBondContact O-N 3.35Å; T813-D816 VanDerWaalsContact O-N 3.13Å; T813-D816 PolarHBondContact OG1-N 2.82Å; T813-D816 PolarHBondContact OG1-OD2 3.46Å; D816-Q818 VanDerWaalsContact C-N 3.34Å; D816-Q818 PolarHBondContact O-N 2.74Å; D816-L819 PolarHBondContact O-N 3Å; D816-L820 VanDerWaalsContact O-CB 3.25Å; D816-L820 WeakPolarHBondContact O-CB 3.38Å; D816-L820 PolarHBondContact O-N 3.45Å
817	L	89.3	Confident	88	Confident	33 Å²	33	39.7 Å²	39.7	17%	0.173	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-38.2	176.8	-70.4	168.4	0	0	0	112.1	F632 M812 T813 Q814 A815 L820 K821	F632-L817 HydrophobicContact CE1-CD2 4.22Å; M812-L817 HydrophobicContact CB-CD2 4.34Å; M812-L817 HydrophobicContact CB-CG 4.21Å; T813-L817 WeakPolarHBondContact O-CG 3.18Å; T813-L817 PolarHBondContact O-N 2.86Å; Q814-L817 PolarHBondContact O-N 3.05Å; A815-L817 VanDerWaalsContact C-N 3.34Å; A815-L817 PolarHBondContact O-N 3.13Å; L817-L820 PolarHBondContact O-N 2.7Å; L817-K821 WeakPolarHBondContact O-CG 3.37Å; L817-K821 PolarHBondContact O-N 2.88Å
818	Q	89.2	Confident	88.3	Confident	32 Å²	32	36.5 Å²	36.5	15%	0.15	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-43	174.6	-67.1	-60.9	-23.9	0	0	111.7	Q814 A815 D816 L820 K821 V822 L1083	Q814-Q818 VanDerWaalsContact O-CG 3.31Å; Q814-Q818 WeakPolarHBondContact O-CG 3.17Å; Q814-Q818 PolarHBondContact O-N 3.07Å; A815-Q818 PolarHBondContact O-N 3.06Å; D816-Q818 VanDerWaalsContact C-N 3.34Å; D816-Q818 PolarHBondContact O-N 2.74Å; Q818-L820 VanDerWaalsContact C-N 3.28Å; Q818-L820 PolarHBondContact O-N 3.44Å; Q818-K821 WeakPolarHBondContact O-CB 3.37Å; Q818-K821 PolarHBondContact O-N 2.83Å; Q818-V822 PolarHBondContact O-N 2.97Å; Q818-L1083 HydrophobicContact CB-CB 4.21Å; Q818-L1083 HydrophobicContact CB-CD1 3.88Å
819	L	90.1	Very high	88.7	Confident	11 Å²	11	31.7 Å²	31.7	6%	0.058	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-39.2	175.3	-169.1	64.9	0	0	0	111.2	L584 L586 A815 D816 V822 V823 L1079	L584-L819 HydrophobicContact CD1-CD1 3.67Å; L584-L819 HydrophobicContact CD1-CG 4.03Å; L586-L819 HydrophobicContact CD1-CB 3.97Å; L586-L819 HydrophobicContact CD1-CD2 3.8Å; L586-L819 HydrophobicContact CD1-CG 3.63Å; L586-L819 HydrophobicContact CG-CD2 4.34Å; A815-L819 PolarHBondContact O-N 2.76Å; D816-L819 PolarHBondContact O-N 3Å; L819-V822 WeakPolarHBondContact O-CB 3.5Å; L819-V822 PolarHBondContact O-N 2.75Å; L819-V823 PolarHBondContact O-N 2.93Å; L819-L1079 HydrophobicContact CD1-CB 3.72Å; L819-L1079 HydrophobicContact CD1-CD1 3.83Å; L819-L1079 HydrophobicContact CD1-CG 4.43Å
820	L	92.2	Very high	88.9	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-46.9	174.4	-173.7	57.1	0	0	0	111	L586 P589 V590 L593 F632 M812 D816 L817 Q818 V822 V823 L824	L586-L820 HydrophobicContact CD1-CB 4.28Å; L586-L820 HydrophobicContact CD1-CD1 4.46Å; P589-L820 HydrophobicContact CB-CD1 4.11Å; P589-L820 HydrophobicContact CB-CD2 4.02Å; P589-L820 HydrophobicContact CG-CD1 4.07Å; V590-L820 HydrophobicContact CG2-CD1 3.37Å; L593-L820 HydrophobicContact CD1-CD1 3.95Å; L593-L820 HydrophobicContact CD1-CD2 3.85Å; L593-L820 HydrophobicContact CD1-CG 4Å; F632-L820 HydrophobicContact CE1-CD2 3.86Å; F632-L820 HydrophobicContact CE1-CG 4.42Å; F632-L820 HydrophobicContact CZ-CD2 4.38Å; F632-L820 HydrophobicContact CZ-CG 4.46Å; M812-L820 HydrophobicContact SD-CD2 4.24Å; D816-L820 VanDerWaalsContact O-CB 3.25Å; D816-L820 WeakPolarHBondContact O-CB 3.38Å; D816-L820 PolarHBondContact O-N 3.45Å; L817-L820 PolarHBondContact O-N 2.7Å; Q818-L820 VanDerWaalsContact C-N 3.28Å; Q818-L820 PolarHBondContact O-N 3.44Å; L820-V822 VanDerWaalsContact C-N 3.27Å; L820-V822 PolarHBondContact O-N 3.16Å; L820-V823 WeakPolarHBondContact O-CB 3.34Å; L820-V823 PolarHBondContact O-N 3.41Å; L820-L824 HydrophobicContact CG-CD1 4.47Å; L820-L824 VanDerWaalsContact O-CG 3.3Å; L820-L824 WeakPolarHBondContact O-CG 3.24Å; L820-L824 PolarHBondContact O-N 3.49Å
821	K	92.5	Very high	89.3	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-57.1	-39.8	173.3	-76.1	173.3	-178.8	179.5	0	112.3	H628 F632 L817 Q818 V823 L824 A825 R963 V964	H628-K821 PolarHBondContact CE1-NZ 2.89Å; H628-K821 PolarHBondContact ND1-NZ 2.87Å; H628-K821 VanDerWaalsContact ND1-NZ 3.12Å; F632-K821 HydrophobicContact CZ-CG 4.24Å; L817-K821 WeakPolarHBondContact O-CG 3.37Å; L817-K821 PolarHBondContact O-N 2.88Å; Q818-K821 WeakPolarHBondContact O-CB 3.37Å; Q818-K821 PolarHBondContact O-N 2.83Å; K821-V823 PolarHBondContact O-N 3.38Å; K821-L824 PolarHBondContact O-N 2.85Å; K821-A825 WeakPolarHBondContact O-CB 3.27Å; K821-A825 PolarHBondContact O-N 3.16Å; K821-R963 WeakPolarHBondContact CD-O 3.34Å; K821-R963 WeakPolarHBondContact CE-O 3.35Å; K821-V964 HydrophobicContact CB-CG1 4.36Å
822	V	89.8	Confident	89.6	Confident	4 Å²	4	24.2 Å²	24.2	2%	0.024	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-43.7	174.3	166.5	0	0	0	0	111.2	Q818 L819 L820 A825 G826 L972 Y973 L1083	Q818-V822 PolarHBondContact O-N 2.97Å; L819-V822 WeakPolarHBondContact O-CB 3.5Å; L819-V822 PolarHBondContact O-N 2.75Å; L820-V822 VanDerWaalsContact C-N 3.27Å; L820-V822 PolarHBondContact O-N 3.16Å; V822-A825 PolarHBondContact O-N 3.04Å; V822-G826 PolarHBondContact O-N 2.84Å; V822-L972 HydrophobicContact CG1-CD1 4.17Å; V822-L972 HydrophobicContact CG2-CD1 4.17Å; V822-Y973 HydrophobicContact CG1-CE2 4.17Å; V822-Y973 WeakPolarHBondContact CG1-OH 3.36Å; V822-Y973 WeakPolarHBondContact O-CE2 3.42Å; V822-Y973 PolarHBondContact O-OH 3.34Å; V822-L1083 HydrophobicContact CB-CD1 4.46Å; V822-L1083 HydrophobicContact CG2-CD1 3.45Å; V822-L1083 VanDerWaalsContact CG2-CD1 3.45Å; V822-L1083 HydrophobicContact CG2-CD2 3.72Å; V822-L1083 HydrophobicContact CG2-CG 4.16Å
823	V	91.7	Very high	90	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.3	-46.5	175.7	174.5	0	0	0	0	111.7	M577 M580 A581 L584 L586 V590 L819 L820 K821 A825 G826 G827	M577-V823 HydrophobicContact CG-CG1 4.49Å; M580-V823 HydrophobicContact CB-CG1 3.89Å; A581-V823 HydrophobicContact CB-CG1 3.94Å; L584-V823 HydrophobicContact CB-CG2 4.25Å; L584-V823 HydrophobicContact CD1-CG2 3.42Å; L584-V823 VanDerWaalsContact CD1-CG2 3.42Å; L584-V823 HydrophobicContact CG-CG2 4.22Å; L586-V823 HydrophobicContact CD1-CG2 4.11Å; V590-V823 HydrophobicContact CG2-CG1 3.89Å; L819-V823 PolarHBondContact O-N 2.93Å; L820-V823 WeakPolarHBondContact O-CB 3.34Å; L820-V823 PolarHBondContact O-N 3.41Å; K821-V823 PolarHBondContact O-N 3.38Å; V823-A825 VanDerWaalsContact C-N 3.34Å; V823-G826 PolarHBondContact O-N 3.48Å; V823-G827 PolarHBondContact O-N 3.11Å; V823-G827 VanDerWaalsContact O-N 3.09Å
824	L	93	Very high	90.3	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-62.4	-44.5	179.2	-59	176	0	0	0	110.8	M577 L593 M597 F632 L820 K821 G826 G827 M828 I962	M577-L824 HydrophobicContact CE-CB 4.34Å; M577-L824 HydrophobicContact CE-CD2 3.66Å; M577-L824 HydrophobicContact CG-CD2 3.73Å; M577-L824 HydrophobicContact SD-CD2 3.25Å; M577-L824 WeakPolarHBondContact SD-CD2 3.1Å; L593-L824 HydrophobicContact CB-CD2 4.43Å; L593-L824 HydrophobicContact CD1-CD1 3.84Å; L593-L824 HydrophobicContact CD1-CD2 3.98Å; L593-L824 HydrophobicContact CD1-CG 4.42Å; M597-L824 HydrophobicContact CE-CD2 4.42Å; F632-L824 HydrophobicContact CE2-CD1 3.72Å; F632-L824 HydrophobicContact CZ-CD1 3.59Å; L820-L824 HydrophobicContact CG-CD1 4.47Å; L820-L824 VanDerWaalsContact O-CG 3.3Å; L820-L824 WeakPolarHBondContact O-CG 3.24Å; L820-L824 PolarHBondContact O-N 3.49Å; K821-L824 PolarHBondContact O-N 2.85Å; L824-G826 PolarHBondContact O-N 3.44Å; L824-G827 PolarHBondContact O-N 3.43Å; L824-G827 VanDerWaalsContact O-N 3.11Å; L824-M828 WeakPolarHBondContact O-CG 3.47Å; L824-M828 PolarHBondContact O-N 3.15Å; L824-I962 HydrophobicContact CB-CD1 4.19Å; L824-I962 HydrophobicContact CD1-CD1 3.69Å; L824-I962 HydrophobicContact CG-CD1 4.45Å
825	A	92.1	Very high	90.6	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-61.8	-41.6	177.2	0	0	0	0	0	112.4	K821 V822 V823 G827 M828 Y829 M946 V964 T969 Y973	K821-A825 WeakPolarHBondContact O-CB 3.27Å; K821-A825 PolarHBondContact O-N 3.16Å; V822-A825 PolarHBondContact O-N 3.04Å; V823-A825 VanDerWaalsContact C-N 3.34Å; A825-G827 PolarHBondContact O-N 3.24Å; A825-M828 PolarHBondContact O-N 3Å; A825-Y829 WeakPolarHBondContact O-CB 3.36Å; A825-Y829 PolarHBondContact O-N 2.75Å; A825-M946 WeakPolarHBondContact CA-SD 3.49Å; A825-M946 HydrophobicContact CB-CG 4.44Å; A825-M946 HydrophobicContact CB-SD 3.44Å; A825-M946 WeakPolarHBondContact CB-SD 3.25Å; A825-V964 HydrophobicContact CB-CG1 4.42Å; A825-T969 HydrophobicContact CB-CG2 3.89Å; A825-Y973 HydrophobicContact CB-CD2 4.12Å; A825-Y973 HydrophobicContact CB-CE2 3.84Å
826	G	89.8	Confident	90.9	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.6	-30.5	175	0	0	0	0	0	113.3	R576 V822 V823 L824	R576-G826 WeakPolarHBondContact CD-O 3.19Å; R576-G826 PolarHBondContact NE-O 2.78Å; R576-G826 PolarHBondContact NH1-O 2.9Å; V822-G826 PolarHBondContact O-N 2.84Å; V823-G826 PolarHBondContact O-N 3.48Å; L824-G826 PolarHBondContact O-N 3.44Å
827	G	89.6	Confident	90.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-73.2	-41.4	173.1	0	0	0	0	0	113.7	S573 V823 L824 A825	S573-G827 VanDerWaalsContact CA-O 3.28Å; S573-G827 WeakPolarHBondContact CA-O 3.35Å; S573-G827 WeakPolarHBondContact CB-O 3.35Å; V823-G827 PolarHBondContact O-N 3.11Å; V823-G827 VanDerWaalsContact O-N 3.09Å; L824-G827 PolarHBondContact O-N 3.43Å; L824-G827 VanDerWaalsContact O-N 3.11Å; A825-G827 PolarHBondContact O-N 3.24Å
828	M	90.3	Very high	90.5	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-91.2	-22.9	-172.2	-62.7	168.4	74.2	0	0	113.7	M577 L824 A825 Q831 M946 Y947 L948 I962	M577-M828 HydrophobicContact CE-CG 3.96Å; M577-M828 HydrophobicContact CE-SD 4.14Å; L824-M828 WeakPolarHBondContact O-CG 3.47Å; L824-M828 PolarHBondContact O-N 3.15Å; A825-M828 PolarHBondContact O-N 3Å; M828-Q831 WeakPolarHBondContact O-CB 3.48Å; M828-Q831 VanDerWaalsContact O-CG 3.25Å; M828-Q831 WeakPolarHBondContact O-CG 3.46Å; M828-Q831 PolarHBondContact O-N 3.12Å; M828-Q831 PolarHBondContact O-OE1 3.23Å; M828-M946 HydrophobicContact CB-CE 4.15Å; M828-M946 HydrophobicContact CB-SD 4.43Å; M828-M946 HydrophobicContact CE-CB 4.08Å; M828-M946 HydrophobicContact SD-CB 4.28Å; M828-Y947 VanDerWaalsContact CE-O 3.3Å; M828-Y947 WeakPolarHBondContact CE-O 3.49Å; M828-L948 HydrophobicContact CE-CB 4.14Å; M828-I962 HydrophobicContact SD-CD1 3.89Å
829	Y	89.6	Confident	90.4	Very high	8 Å²	8	17 Å²	17	3%	0.031	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	129.3	177.6	178.4	-83.2	0	0	0	110.6	R576 A825 Y973 C974 R975 D989	R576-Y829 PolarHBondContact NH1-O 2.65Å; A825-Y829 WeakPolarHBondContact O-CB 3.36Å; A825-Y829 PolarHBondContact O-N 2.75Å; Y829-Y973 WeakPolarHBondContact CE1-O 3.35Å; Y829-Y973 VanDerWaalsContact CZ-O 3.29Å; Y829-C974 WeakPolarHBondContact OH-CA 3.39Å; Y829-R975 HydrophobicContact CE1-CG 4.15Å; Y829-R975 PolarHBondContact OH-N 3.33Å; Y829-D989 PolarHBondContact OH-OD1 3.27Å; Y829-D989 VanDerWaalsContact OH-OD1 3.12Å; Y829-D989 PolarHBondContact OH-OD2 2.92Å
830	P	87.3	Confident	90	Very high	39 Å²	39	18.8 Å²	18.8	25%	0.253	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	cis	-97.5	21.3	23	38.3	-37.9	0	0	0	117	L832	P830-L832 VanDerWaalsContact C-N 3.35Å; P830-L832 PolarHBondContact O-N 3.3Å
831	Q	89.8	Confident	89.4	Confident	42 Å²	42	26.6 Å²	26.6	20%	0.196	16%	0.159	C	C	.	.			trans	-77.4	78.2	-176.7	-57.7	170.6	-53.2	0	0	112.2	S573 M828 M946 Y947 L948	S573-Q831 PolarHBondContact OG-OE1 3.17Å; M828-Q831 WeakPolarHBondContact O-CB 3.48Å; M828-Q831 VanDerWaalsContact O-CG 3.25Å; M828-Q831 WeakPolarHBondContact O-CG 3.46Å; M828-Q831 PolarHBondContact O-N 3.12Å; M828-Q831 PolarHBondContact O-OE1 3.23Å; Q831-M946 WeakPolarHBondContact O-CA 3.32Å; Q831-M946 WeakPolarHBondContact O-CE 3.3Å; Q831-Y947 HydrophobicContact CB-CD1 4.42Å; Q831-Y947 HydrophobicContact CB-CD2 4.16Å; Q831-Y947 HydrophobicContact CB-CE1 4.19Å; Q831-Y947 HydrophobicContact CB-CE2 3.9Å; Q831-Y947 HydrophobicContact CB-CG 4.42Å; Q831-Y947 WeakPolarHBondContact CB-O 3.47Å; Q831-Y947 HydrophobicContact CG-CE2 4.39Å; Q831-Y947 WeakPolarHBondContact O-CD1 3.13Å; Q831-Y947 PolarHBondContact O-N 3.39Å; Q831-Y947 PolarHBondContact OE1-O 2.84Å; Q831-L948 PolarHBondContact NE2-O 2.83Å; Q831-L948 PolarHBondContact OE1-O 3.36Å
832	L	92.9	Very high	88.8	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	139	-174.1	-167.7	68.8	0	0	0	112.2	P830 L944 M946 L970 W991 L992	P830-L832 VanDerWaalsContact C-N 3.35Å; P830-L832 PolarHBondContact O-N 3.3Å; L832-L944 HydrophobicContact CD1-CB 3.77Å; L832-L944 HydrophobicContact CD1-CD1 4.06Å; L832-L944 HydrophobicContact CD2-CD1 3.79Å; L832-L944 HydrophobicContact CG-CB 4.46Å; L832-L944 HydrophobicContact CG-CD1 4.19Å; L832-M946 HydrophobicContact CB-CE 4.21Å; L832-M946 HydrophobicContact CD1-CE 4.01Å; L832-M946 HydrophobicContact CD1-CG 4.02Å; L832-M946 HydrophobicContact CD1-SD 4.33Å; L832-L970 HydrophobicContact CD2-CD2 3.57Å; L832-W991 HydrophobicContact CB-CZ2 4.31Å; L832-W991 HydrophobicContact CD2-CZ2 4.15Å; L832-W991 HydrophobicContact CG-CZ2 4.45Å; L832-L992 HydrophobicContact CD2-CD1 3.95Å
833	A	94.6	Very high	88.3	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139.1	177.5	0	0	0	0	0	111.3	F858 H859 T860 L945 Y947 L958	A833-F858 HydrophobicContact CB-CB 4.39Å; A833-H859 WeakPolarHBondContact CA-O 3.24Å; A833-T860 HydrophobicContact CB-CG2 4.16Å; A833-L945 HydrophobicContact CB-CB 4.32Å; A833-L945 PolarHBondContact N-O 3.48Å; A833-L945 PolarHBondContact O-N 2.72Å; A833-Y947 HydrophobicContact CB-CD1 4Å; A833-Y947 HydrophobicContact CB-CE1 4.09Å; A833-L958 HydrophobicContact CB-CD1 3.78Å; A833-L958 HydrophobicContact CB-CD2 4.18Å
834	I	94.2	Very high	87.4	Confident	16 Å²	16	34.4 Å²	34.4	8%	0.082	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.1	174.7	-172.2	169.9	0	0	0	110.2	F858 H859 L944 W991 L992 I1093 R1095	I834-F858 CarbonylContact O-C 3.6Å; I834-F858 VanDerWaalsContact O-CA 3.25Å; I834-F858 WeakPolarHBondContact O-CA 3.33Å; I834-H859 HydrophobicContact CG2-CB 4.08Å; I834-H859 PolarHBondContact N-O 3.15Å; I834-H859 PolarHBondContact O-N 3.06Å; I834-L944 HydrophobicContact CB-CD2 3.87Å; I834-L944 HydrophobicContact CD1-CD2 4.21Å; I834-L944 HydrophobicContact CG1-CD2 3.8Å; I834-W991 HydrophobicContact CG2-CH2 4.35Å; I834-W991 HydrophobicContact CG2-CZ3 4.02Å; I834-L992 HydrophobicContact CB-CD2 4.39Å; I834-L992 HydrophobicContact CD1-CD2 3.85Å; I834-L992 HydrophobicContact CG2-CD2 4.18Å; I834-I1093 HydrophobicContact CD1-CB 4.41Å; I834-I1093 HydrophobicContact CD1-CG2 3.44Å; I834-I1093 VanDerWaalsContact CD1-CG2 3.44Å; I834-R1095 HydrophobicContact CG2-CB 4.37Å
835	G	91.9	Very high	86.1	Confident	30 Å²	30	37 Å²	37	31%	0.309	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	143.8	174.2	0	0	0	0	0	112.1
836	D	90.6	Very high	84.5	Confident	28 Å²	28	41 Å²	41	15%	0.15	24%	0.236	C	C	.	.			trans	-65.5	141.9	169.3	-169.5	-83	0	0	0	110.6	A838 N839 V857 H859	D836-A838 PolarHBondContact O-N 2.72Å; D836-A838 VanDerWaalsContact O-N 3.16Å; D836-A838 WeakPolarHBondContact OD1-CB 3.28Å; D836-A838 PolarHBondContact OD1-N 3.09Å; D836-N839 PolarHBondContact N-ND2 3.49Å; D836-N839 VanDerWaalsContact O-CB 3.22Å; D836-N839 WeakPolarHBondContact O-CB 3.37Å; D836-N839 PolarHBondContact O-N 3.3Å; D836-V857 HydrophobicContact CB-CB 4.26Å; D836-V857 HydrophobicContact CB-CG1 4.16Å; D836-V857 VanDerWaalsContact CB-O 3.25Å; D836-V857 WeakPolarHBondContact CB-O 3.43Å; D836-V857 PolarHBondContact N-O 2.72Å; D836-H859 IonicContact OD2-CD2 2.88Å; D836-H859 IonicContact OD2-CE1 3.38Å; D836-H859 IonicContact OD2-NE2 2.74Å; D836-H859 PolarHBondContact OD2-NE2 3.42Å
837	S	83.8	Confident	82.6	Confident	122 Å²	122	44.9 Å²	44.9	85%	0.853	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.6	179.6	51.9	0	0	0	0	112.9	N839	S837-N839 VanDerWaalsContact C-N 3.27Å; S837-N839 PolarHBondContact O-N 3.42Å
838	A	85.6	Confident	80.3	Confident	37 Å²	37	46.6 Å²	46.6	31%	0.306	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.1	176	0	0	0	0	0	113.5	D836 A840 Y841 R842	D836-A838 PolarHBondContact O-N 2.72Å; D836-A838 VanDerWaalsContact O-N 3.16Å; D836-A838 WeakPolarHBondContact OD1-CB 3.28Å; D836-A838 PolarHBondContact OD1-N 3.09Å; A838-A840 VanDerWaalsContact C-N 3.28Å; A838-A840 PolarHBondContact O-N 3.12Å; A838-Y841 WeakPolarHBondContact O-CB 3.2Å; A838-Y841 PolarHBondContact O-N 2.92Å; A838-Y841 VanDerWaalsContact O-N 3.09Å; A838-R842 WeakPolarHBondContact O-CG 3.27Å; A838-R842 PolarHBondContact O-N 3.42Å
839	N	86.8	Confident	77.9	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.027	34%	0.342	C	S	.	.	H	α-helix	trans	-59.9	-37.6	-178.5	-78.3	-13.5	0	0	0	113	D836 S837 Y841 R842 V843 M856 V857 F882	D836-N839 PolarHBondContact N-ND2 3.49Å; D836-N839 VanDerWaalsContact O-CB 3.22Å; D836-N839 WeakPolarHBondContact O-CB 3.37Å; D836-N839 PolarHBondContact O-N 3.3Å; S837-N839 VanDerWaalsContact C-N 3.27Å; S837-N839 PolarHBondContact O-N 3.42Å; N839-Y841 VanDerWaalsContact C-N 3.26Å; N839-Y841 PolarHBondContact O-N 3.47Å; N839-R842 PolarHBondContact O-N 3.4Å; N839-V843 WeakPolarHBondContact O-CG2 3.34Å; N839-V843 PolarHBondContact O-N 2.87Å; N839-M856 WeakPolarHBondContact OD1-CA 3.48Å; N839-V857 PolarHBondContact ND2-O 3.22Å; N839-V857 PolarHBondContact OD1-N 2.84Å; N839-V857 PolarHBondContact OD1-O 3.08Å; N839-F882 HydrophobicContact CB-CE1 4.04Å; N839-F882 HydrophobicContact CB-CZ 4Å
840	A	81.1	Confident	75.5	Confident	47 Å²	47	57.8 Å²	57.8	39%	0.388	37%	0.372	S	S	.	.	H	α-helix	trans	-58.9	-41.8	176.5	0	0	0	0	0	111.2	A838 A844 F882	A838-A840 VanDerWaalsContact C-N 3.28Å; A838-A840 PolarHBondContact O-N 3.12Å; A840-A844 WeakPolarHBondContact O-CB 3.23Å; A840-A844 PolarHBondContact O-N 3.13Å; A840-A844 VanDerWaalsContact O-N 3.15Å; A840-F882 HydrophobicContact CB-CD1 4.28Å; A840-F882 HydrophobicContact CB-CE1 3.89Å; A840-F882 HydrophobicContact CB-CZ 4.48Å
841	Y	80.5	Confident	73.2	Confident	170 Å²	170	57.6 Å²	57.6	67%	0.667	38%	0.377	S	S	*	.	H	α-helix	trans	-69.6	-39.9	175.7	179.3	-99.1	0	0	0	112.4	A838 N839 N845	A838-Y841 WeakPolarHBondContact O-CB 3.2Å; A838-Y841 PolarHBondContact O-N 2.92Å; A838-Y841 VanDerWaalsContact O-N 3.09Å; N839-Y841 VanDerWaalsContact C-N 3.26Å; N839-Y841 PolarHBondContact O-N 3.47Å; Y841-N845 WeakPolarHBondContact CD1-ND2 3.35Å; Y841-N845 WeakPolarHBondContact CD2-ND2 3.22Å; Y841-N845 WeakPolarHBondContact CE1-ND2 3.33Å; Y841-N845 WeakPolarHBondContact CE2-ND2 3.42Å; Y841-N845 PolarHBondContact O-N 2.93Å; Y841-N845 PolarHBondContact O-ND2 3.46Å; Y841-N845 PolarHBondContact OH-ND2 2.97Å
842	R	80.7	Confident	71	Confident	72 Å²	72	60 Å²	60	27%	0.272	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-44.5	178.2	-68.2	173.4	-169.4	-144.6	6.7	111.9	A838 N839 N845 A854 E855	A838-R842 WeakPolarHBondContact O-CG 3.27Å; A838-R842 PolarHBondContact O-N 3.42Å; N839-R842 PolarHBondContact O-N 3.4Å; R842-N845 PolarHBondContact O-N 3.19Å; R842-A854 HydrophobicContact CB-CB 4.2Å; R842-A854 WeakPolarHBondContact O-CB 3.31Å; R842-E855 WeakPolarHBondContact CD-O 3.36Å; R842-E855 PolarHBondContact NH1-O 2.89Å; R842-E855 VanDerWaalsContact NH1-O 3.15Å
843	V	77.7	Confident	69	Low	19 Å²	19	62.5 Å²	62.5	12%	0.115	43%	0.43	C	S	.	.	H	α-helix	trans	-68.6	-44.6	-179.6	174	0	0	0	0	110.9	N839 N845 R846 M856 P878 F882	N839-V843 WeakPolarHBondContact O-CG2 3.34Å; N839-V843 PolarHBondContact O-N 2.87Å; V843-N845 PolarHBondContact O-N 3.21Å; V843-R846 WeakPolarHBondContact O-CB 3.36Å; V843-R846 PolarHBondContact O-N 2.74Å; V843-R846 VanDerWaalsContact O-N 3.15Å; V843-M856 HydrophobicContact CG2-CG 3.66Å; V843-M856 HydrophobicContact CG2-SD 3.71Å; V843-P878 HydrophobicContact CG1-CB 4.05Å; V843-P878 HydrophobicContact CG1-CG 3.67Å; V843-P878 HydrophobicContact CG2-CB 3.9Å; V843-P878 HydrophobicContact CG2-CG 4.3Å; V843-F882 HydrophobicContact CB-CE2 4.22Å; V843-F882 HydrophobicContact CB-CZ 4.37Å; V843-F882 HydrophobicContact CG1-CE2 4.35Å; V843-F882 HydrophobicContact CG2-CE2 3.95Å; V843-F882 HydrophobicContact CG2-CZ 3.94Å
844	A	73.1	Confident	67.4	Low	81 Å²	81	63.8 Å²	63.8	67%	0.669	44%	0.441	S	S	*	.	H	α-helix	trans	-58.8	-33.2	177.8	0	0	0	0	0	113.1	A840 R846	A840-A844 WeakPolarHBondContact O-CB 3.23Å; A840-A844 PolarHBondContact O-N 3.13Å; A840-A844 VanDerWaalsContact O-N 3.15Å; A844-R846 PolarHBondContact O-N 3.35Å
845	N	65.8	Low	66.5	Low	56 Å²	56	67.6 Å²	67.6	30%	0.299	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-86.5	4.8	-179.1	-72.2	-37.9	0	0	0	115.1	Y841 R842 V843 G847 G848	Y841-N845 WeakPolarHBondContact CD1-ND2 3.35Å; Y841-N845 WeakPolarHBondContact CD2-ND2 3.22Å; Y841-N845 WeakPolarHBondContact CE1-ND2 3.33Å; Y841-N845 WeakPolarHBondContact CE2-ND2 3.42Å; Y841-N845 PolarHBondContact O-N 2.93Å; Y841-N845 PolarHBondContact O-ND2 3.46Å; Y841-N845 PolarHBondContact OH-ND2 2.97Å; R842-N845 PolarHBondContact O-N 3.19Å; V843-N845 PolarHBondContact O-N 3.21Å; N845-G847 PolarHBondContact O-N 2.94Å; N845-G848 PolarHBondContact O-N 2.77Å
846	R	59.1	Low	66.4	Low	83 Å²	83	66.6 Å²	66.6	31%	0.313	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-55	-23.2	175.6	-94.8	-171.1	175.5	-176.4	1	113.7	V843 A844 V875	V843-R846 WeakPolarHBondContact O-CB 3.36Å; V843-R846 PolarHBondContact O-N 2.74Å; V843-R846 VanDerWaalsContact O-N 3.15Å; A844-R846 PolarHBondContact O-N 3.35Å; R846-V875 PolarHBondContact NH1-O 3.01Å; R846-V875 PolarHBondContact NH2-O 2.86Å
847	G	48.8	Very low	66.4	Low	82 Å²	82	65.9 Å²	65.9	85%	0.845	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-96.2	-1	176.4	0	0	0	0	0	115.9	N845	N845-G847 PolarHBondContact O-N 2.94Å
848	G	41.9	Very low	66.9	Low	37 Å²	37	60.3 Å²	60.3	38%	0.381	40%	0.403	S	S	.	.	S	Bend	trans	-84.8	178.8	179.9	0	0	0	0	0	113.6	N845 A850 G851	N845-G848 PolarHBondContact O-N 2.77Å; G848-A850 PolarHBondContact O-N 3.31Å; G848-G851 PolarHBondContact O-N 2.65Å
849	T	39.4	Very low	67.3	Low	165 Å²	165	59 Å²	59	100%	1.012	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-13.3	176.3	51	0	0	0	0	114.4	G851	T849-G851 PolarHBondContact O-N 2.99Å
850	A	40.5	Very low	67.6	Low	79 Å²	79	58.9 Å²	58.9	65%	0.653	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-3.6	173.6	0	0	0	0	0	114.3	G848	G848-A850 PolarHBondContact O-N 3.31Å
851	G	39.4	Very low	67.9	Low	34 Å²	34	62 Å²	62	35%	0.351	40%	0.395	S	S	.	.			trans	75.1	169.5	175.2	0	0	0	0	0	113.9	G848 T849 G853	G848-G851 PolarHBondContact O-N 2.65Å; T849-G851 PolarHBondContact O-N 2.99Å; G851-G853 PolarHBondContact O-N 3.23Å
852	A	43.3	Very low	68.2	Low	93 Å²	93	57.7 Å²	57.7	77%	0.769	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	25.9	-176.1	0	0	0	0	0	115.1
853	G	50.1	Low	68.5	Low	56 Å²	56	57.5 Å²	57.5	58%	0.577	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.4	7.5	-165.7	0	0	0	0	0	116.5	G851 E855	G851-G853 PolarHBondContact O-N 3.23Å; G853-E855 PolarHBondContact O-N 3.33Å
854	A	60.2	Low	69.1	Low	27 Å²	27	57.4 Å²	57.4	22%	0.223	39%	0.387	C	S	.	.			trans	-68.8	99.7	176.1	0	0	0	0	0	110.5	R842	R842-A854 HydrophobicContact CB-CB 4.2Å; R842-A854 WeakPolarHBondContact O-CB 3.31Å
855	E	77.1	Confident	69.9	Low	96 Å²	96	60.3 Å²	60.3	45%	0.449	39%	0.385	S	S	.	.			trans	-79.5	136.7	-179.6	-68	176.8	161.8	0	0	111.9	R842 G853 K955	R842-E855 WeakPolarHBondContact CD-O 3.36Å; R842-E855 PolarHBondContact NH1-O 2.89Å; R842-E855 VanDerWaalsContact NH1-O 3.15Å; G853-E855 PolarHBondContact O-N 3.33Å; E855-K955 IonicContact OE1-NZ 3.88Å; E855-K955 PolarHBondContact OE1-NZ 3.02Å; E855-K955 IonicContact OE2-NZ 3.47Å; E855-K955 PolarHBondContact OE2-NZ 3.04Å
856	M	88.6	Confident	71.2	Confident	10 Å²	10	57.6 Å²	57.6	5%	0.049	37%	0.371	C	S	.	.			trans	-68.6	141.5	171.6	-65.6	-169.6	-62	0	0	110.5	N839 V843 F858 L868 F874 P878 L881 F882	N839-M856 WeakPolarHBondContact OD1-CA 3.48Å; V843-M856 HydrophobicContact CG2-CG 3.66Å; V843-M856 HydrophobicContact CG2-SD 3.71Å; M856-F858 HydrophobicContact CB-CE2 3.69Å; M856-F858 HydrophobicContact CB-CZ 4.27Å; M856-F858 HydrophobicContact CE-CE2 4.39Å; M856-F858 HydrophobicContact CE-CZ 4.28Å; M856-L868 HydrophobicContact CE-CD1 3.51Å; M856-F874 VanDerWaalsContact CE-O 3.24Å; M856-F874 WeakPolarHBondContact CE-O 3.36Å; M856-P878 HydrophobicContact CE-CB 3.71Å; M856-P878 HydrophobicContact SD-CB 3.58Å; M856-P878 VanDerWaalsContact SD-CB 3.58Å; M856-L881 HydrophobicContact CE-CD1 3.98Å; M856-L881 HydrophobicContact SD-CD1 4.48Å; M856-F882 HydrophobicContact SD-CZ 4.43Å
857	V	91.6	Very high	72.8	Confident	12 Å²	12	54.1 Å²	54.1	7%	0.073	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	141	178.4	163.9	0	0	0	0	110.6	D836 N839 F865 V866 T867	D836-V857 HydrophobicContact CB-CB 4.26Å; D836-V857 HydrophobicContact CB-CG1 4.16Å; D836-V857 VanDerWaalsContact CB-O 3.25Å; D836-V857 WeakPolarHBondContact CB-O 3.43Å; D836-V857 PolarHBondContact N-O 2.72Å; N839-V857 PolarHBondContact ND2-O 3.22Å; N839-V857 PolarHBondContact OD1-N 2.84Å; N839-V857 PolarHBondContact OD1-O 3.08Å; V857-F865 HydrophobicContact CG1-CB 4.3Å; V857-F865 HydrophobicContact CG1-CD1 3.97Å; V857-V866 CarbonylContact C-O 3.58Å; V857-V866 WeakPolarHBondContact CA-O 3.37Å; V857-T867 HydrophobicContact CG2-CG2 4.16Å
858	F	94.6	Very high	74.8	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.022	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161.8	-177.4	-65.8	-93.9	0	0	0	110.2	A833 I834 M856 F865 V866 L868 L881 L945 L958	A833-F858 HydrophobicContact CB-CB 4.39Å; I834-F858 CarbonylContact O-C 3.6Å; I834-F858 VanDerWaalsContact O-CA 3.25Å; I834-F858 WeakPolarHBondContact O-CA 3.33Å; M856-F858 HydrophobicContact CB-CE2 3.69Å; M856-F858 HydrophobicContact CB-CZ 4.27Å; M856-F858 HydrophobicContact CE-CE2 4.39Å; M856-F858 HydrophobicContact CE-CZ 4.28Å; F858-F865 PolarHBondContact O-N 2.73Å; F858-V866 PolarHBondContact N-O 2.97Å; F858-V866 PolarHBondContact O-N 3.32Å; F858-L868 HydrophobicContact CD2-CG 4.11Å; F858-L868 HydrophobicContact CE2-CD1 3.7Å; F858-L868 HydrophobicContact CE2-CD2 4.17Å; F858-L868 HydrophobicContact CE2-CG 3.57Å; F858-L868 HydrophobicContact CZ-CD1 4.05Å; F858-L868 HydrophobicContact CZ-CG 4.25Å; F858-L881 HydrophobicContact CE1-CD1 4.18Å; F858-L881 HydrophobicContact CZ-CD1 3.73Å; F858-L945 HydrophobicContact CD1-CD1 3.86Å; F858-L945 HydrophobicContact CE1-CD1 3.37Å; F858-L945 HydrophobicContact CE1-CG 4.12Å; F858-L945 HydrophobicContact CE2-CD1 4.42Å; F858-L945 HydrophobicContact CZ-CD1 3.7Å; F858-L958 HydrophobicContact CB-CD1 3.92Å; F858-L958 HydrophobicContact CD2-CD1 4.32Å; F858-L958 HydrophobicContact CG-CD1 4.01Å
859	H	94.1	Very high	76.9	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.046	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.5	179	-57.3	-72.5	0	0	0	110.1	A833 I834 D836 G864 F865 R1095	A833-H859 WeakPolarHBondContact CA-O 3.24Å; I834-H859 HydrophobicContact CG2-CB 4.08Å; I834-H859 PolarHBondContact N-O 3.15Å; I834-H859 PolarHBondContact O-N 3.06Å; D836-H859 IonicContact OD2-CD2 2.88Å; D836-H859 IonicContact OD2-CE1 3.38Å; D836-H859 IonicContact OD2-NE2 2.74Å; D836-H859 PolarHBondContact OD2-NE2 3.42Å; H859-G864 VanDerWaalsContact ND1-CA 3.34Å; H859-G864 WeakPolarHBondContact ND1-CA 3.28Å; H859-F865 AromaticContact CE1-CD1 3.74Å; H859-F865 AromaticContact CE1-CE1 3.79Å; H859-F865 AromaticContact CE1-CG 3.95Å; H859-F865 PolarHBondContact CE1-N 3.02Å; H859-F865 PolarHBondContact ND1-N 3.38Å; H859-R1095 PolarHBondContact CE1-NH1 3.06Å; H859-R1095 PolarHBondContact ND1-NH1 3.27Å
860	T	92.5	Very high	79	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	168.4	170.3	71.3	0	0	0	0	108.9	A833 N862 K863 Y947 L958	A833-T860 HydrophobicContact CB-CG2 4.16Å; T860-N862 VanDerWaalsContact C-N 3.27Å; T860-N862 PolarHBondContact O-N 3.36Å; T860-K863 PolarHBondContact N-O 3.18Å; T860-K863 WeakPolarHBondContact OG1-CA 3.39Å; T860-K863 PolarHBondContact OG1-N 3.43Å; T860-K863 PolarHBondContact OG1-O 3.3Å; T860-Y947 HydrophobicContact CG2-CE1 3.72Å; T860-L958 HydrophobicContact CG2-CD2 4.3Å
861	K	87.4	Confident	80.9	Confident	114 Å²	114	44 Å²	44	50%	0.496	26%	0.259	S	S	.	.	S	Bend	trans	-54.9	-42.4	175.8	-178.6	168.2	176.5	160.3	0	112.6	D989 W991	K861-D989 PolarHBondContact NZ-O 3.05Å; K861-W991 HydrophobicContact CB-CD2 3.9Å; K861-W991 HydrophobicContact CB-CE3 4.26Å; K861-W991 HydrophobicContact CB-CG 4.2Å; K861-W991 HydrophobicContact CB-CZ2 4.45Å; K861-W991 HydrophobicContact CD-CG 4.22Å; K861-W991 HydrophobicContact CG-CB 4.4Å; K861-W991 HydrophobicContact CG-CD2 4.3Å; K861-W991 HydrophobicContact CG-CG 4.06Å
862	N	86.1	Confident	83.3	Confident	79 Å²	79	42.4 Å²	42.4	42%	0.422	24%	0.243	S	C	.	.	S	Bend	trans	-95.3	-24.9	-173.2	-71.3	63.9	0	0	0	113.6	K451 T860	K451-N862 WeakPolarHBondContact O-CB 3.42Å; K451-N862 PolarHBondContact O-ND2 2.99Å; K451-N862 VanDerWaalsContact O-ND2 3.07Å; T860-N862 VanDerWaalsContact C-N 3.27Å; T860-N862 PolarHBondContact O-N 3.36Å
863	K	88.1	Confident	85.4	Confident	68 Å²	68	38 Å²	38	30%	0.296	21%	0.206	S	C	.	.			trans	-140.7	119.8	-175.1	-173.5	71.1	174.4	-168.6	0	111	A452 T860 V866 L950	A452-K863 HydrophobicContact CB-CB 4.3Å; A452-K863 HydrophobicContact CB-CD 4.19Å; A452-K863 HydrophobicContact CB-CG 4.5Å; T860-K863 PolarHBondContact N-O 3.18Å; T860-K863 WeakPolarHBondContact OG1-CA 3.39Å; T860-K863 PolarHBondContact OG1-N 3.43Å; T860-K863 PolarHBondContact OG1-O 3.3Å; K863-V866 HydrophobicContact CB-CG2 4.32Å; K863-V866 HydrophobicContact CG-CG2 3.86Å; K863-L950 HydrophobicContact CB-CD2 4.24Å; K863-L950 HydrophobicContact CG-CD2 4.45Å
864	G	89.2	Confident	87.3	Confident	17 Å²	17	35.4 Å²	35.4	18%	0.175	18%	0.179	C	C	.	.			trans	-87.9	168.8	169.8	0	0	0	0	0	112.7	H859	H859-G864 VanDerWaalsContact ND1-CA 3.34Å; H859-G864 WeakPolarHBondContact ND1-CA 3.28Å
865	F	90.9	Very high	88.5	Confident	141 Å²	141	35.8 Å²	35.8	62%	0.618	18%	0.178	S	C	*	.	S	Bend	trans	59.8	45.5	174	-54.2	-81.6	0	0	0	114.4	V857 F858 H859	V857-F865 HydrophobicContact CG1-CB 4.3Å; V857-F865 HydrophobicContact CG1-CD1 3.97Å; F858-F865 PolarHBondContact O-N 2.73Å; H859-F865 AromaticContact CE1-CD1 3.74Å; H859-F865 AromaticContact CE1-CE1 3.79Å; H859-F865 AromaticContact CE1-CG 3.95Å; H859-F865 PolarHBondContact CE1-N 3.02Å; H859-F865 PolarHBondContact ND1-N 3.38Å
866	V	92.5	Very high	88.7	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	148.3	177.5	-176.9	0	0	0	0	110.2	V857 F858 K863 L950 P956 L958	V857-V866 CarbonylContact C-O 3.58Å; V857-V866 WeakPolarHBondContact CA-O 3.37Å; F858-V866 PolarHBondContact N-O 2.97Å; F858-V866 PolarHBondContact O-N 3.32Å; K863-V866 HydrophobicContact CB-CG2 4.32Å; K863-V866 HydrophobicContact CG-CG2 3.86Å; V866-L950 HydrophobicContact CB-CD1 4.4Å; V866-L950 HydrophobicContact CG1-CD1 3.39Å; V866-L950 HydrophobicContact CG2-CD1 4.1Å; V866-P956 HydrophobicContact CG1-CB 4.22Å; V866-P956 WeakPolarHBondContact CG1-O 3.45Å; V866-P956 HydrophobicContact CG2-CB 4.28Å; V866-P956 HydrophobicContact CG2-CG 4.36Å; V866-L958 HydrophobicContact CG1-CD2 3.9Å; V866-L958 HydrophobicContact CG1-CG 3.7Å
867	T	92.1	Very high	88.5	Confident	9 Å²	9	37.5 Å²	37.5	6%	0.055	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	163.6	177.1	56.4	0	0	0	0	111.7	V857 K955 P956 F957 L958	V857-T867 HydrophobicContact CG2-CG2 4.16Å; T867-K955 HydrophobicContact CG2-CD 4.33Å; T867-K955 WeakPolarHBondContact OG1-CE 3.41Å; T867-P956 PolarHBondContact N-O 3.24Å; T867-P956 PolarHBondContact OG1-O 2.88Å; T867-P956 VanDerWaalsContact OG1-O 3.06Å; T867-F957 CarbonylContact O-C 3.59Å; T867-F957 VanDerWaalsContact O-CA 3.23Å; T867-F957 WeakPolarHBondContact O-CA 3.45Å; T867-F957 VanDerWaalsContact OG1-CD1 3.24Å; T867-F957 WeakPolarHBondContact OG1-CD1 3.46Å; T867-F957 WeakPolarHBondContact OG1-CE1 3.37Å; T867-L958 PolarHBondContact O-N 3.45Å
868	L	90.8	Very high	88.2	Confident	10 Å²	10	37.3 Å²	37.3	5%	0.052	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	145.7	169.7	-69.5	167.2	0	0	0	110.2	M856 F858 D872 F874 V875 L945 F957 L958 T961	M856-L868 HydrophobicContact CE-CD1 3.51Å; F858-L868 HydrophobicContact CD2-CG 4.11Å; F858-L868 HydrophobicContact CE2-CD1 3.7Å; F858-L868 HydrophobicContact CE2-CD2 4.17Å; F858-L868 HydrophobicContact CE2-CG 3.57Å; F858-L868 HydrophobicContact CZ-CD1 4.05Å; F858-L868 HydrophobicContact CZ-CG 4.25Å; L868-D872 HydrophobicContact CB-CB 4.33Å; L868-F874 HydrophobicContact CD1-CB 3.69Å; L868-V875 HydrophobicContact CB-CG2 3.61Å; L868-V875 HydrophobicContact CD1-CG2 4.06Å; L868-L945 HydrophobicContact CD2-CD1 3.82Å; L868-F957 WeakPolarHBondContact O-CD1 3.41Å; L868-L958 HydrophobicContact CD2-CB 4.31Å; L868-L958 HydrophobicContact CD2-CD1 4.14Å; L868-T961 HydrophobicContact CD2-CG2 3.88Å
869	H	87.5	Confident	87.7	Confident	63 Å²	63	42.6 Å²	42.6	29%	0.292	21%	0.21	S	C	.	.			trans	-57.6	140.2	171.5	-174.9	-91.5	0	0	0	110.4	N871 D872 V875 F957 L958	H869-N871 PolarHBondContact CE1-ND2 2.97Å; H869-N871 PolarHBondContact ND1-N 2.91Å; H869-N871 PolarHBondContact O-N 2.82Å; H869-N871 VanDerWaalsContact O-N 3.08Å; H869-D872 WeakPolarHBondContact O-CB 3.38Å; H869-D872 PolarHBondContact O-N 2.85Å; H869-V875 WeakPolarHBondContact O-CG2 3.34Å; H869-F957 HydrophobicContact CB-CB 4.35Å; H869-L958 WeakPolarHBondContact CB-O 3.39Å; H869-L958 PolarHBondContact N-O 3.19Å
870	P	82.4	Confident	87.3	Confident	43 Å²	43	43.8 Å²	43.8	28%	0.279	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-34	-173.9	-28.5	35.5	0	0	0	114.5	Y606 D872 F957	Y606-P870 WeakPolarHBondContact CE1-O 3.3Å; Y606-P870 WeakPolarHBondContact OH-CB 3.47Å; Y606-P870 PolarHBondContact OH-O 2.98Å; P870-D872 VanDerWaalsContact C-N 3.27Å; P870-D872 PolarHBondContact O-N 2.54Å; P870-F957 HydrophobicContact CG-CE1 4.35Å
871	N	81.6	Confident	87.1	Confident	36 Å²	36	44.7 Å²	44.7	19%	0.193	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-7.1	179.1	-60.8	-25	0	0	0	115	P605 Y606 H869 R876	P605-N871 VanDerWaalsContact CA-ND2 3.35Å; P605-N871 WeakPolarHBondContact CA-ND2 3.26Å; P605-N871 VanDerWaalsContact CB-ND2 3.34Å; P605-N871 WeakPolarHBondContact CB-ND2 3.4Å; Y606-N871 WeakPolarHBondContact CD1-OD1 3.44Å; Y606-N871 HydrophobicContact CE1-CB 4.36Å; Y606-N871 WeakPolarHBondContact CE1-OD1 3.32Å; H869-N871 PolarHBondContact CE1-ND2 2.97Å; H869-N871 PolarHBondContact ND1-N 2.91Å; H869-N871 PolarHBondContact O-N 2.82Å; H869-N871 VanDerWaalsContact O-N 3.08Å; N871-R876 PolarHBondContact O-NH1 3.26Å
872	D	88	Confident	87	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.			trans	-66.9	138.4	-175.1	-169.4	-65.2	0	0	0	111.4	D630 L868 H869 P870 F874 V875 R876 T961	D630-D872 WeakPolarHBondContact OD1-CA 3.43Å; D630-D872 WeakPolarHBondContact OD2-CA 3.36Å; L868-D872 HydrophobicContact CB-CB 4.33Å; H869-D872 WeakPolarHBondContact O-CB 3.38Å; H869-D872 PolarHBondContact O-N 2.85Å; P870-D872 VanDerWaalsContact C-N 3.27Å; P870-D872 PolarHBondContact O-N 2.54Å; D872-F874 PolarHBondContact O-N 3.28Å; D872-F874 WeakPolarHBondContact OD1-CB 3.2Å; D872-F874 WeakPolarHBondContact OD1-CD2 3.03Å; D872-F874 PolarHBondContact OD1-N 3.09Å; D872-V875 HydrophobicContact CB-CG2 4.24Å; D872-V875 WeakPolarHBondContact O-CB 2.88Å; D872-V875 PolarHBondContact O-N 2.9Å; D872-V875 VanDerWaalsContact O-N 3.1Å; D872-R876 PolarHBondContact O-NH1 3Å; D872-T961 PolarHBondContact OD1-OG1 3Å; D872-T961 WeakPolarHBondContact OD2-CB 3.43Å; D872-T961 WeakPolarHBondContact OD2-CG2 3.3Å; D872-T961 PolarHBondContact OD2-OG1 2.71Å
873	V	87.6	Confident	86.7	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-58	-33.1	-178.7	70.2	0	0	0	0	112.4	E625 D630 V875 R876 K877	E625-V873 HydrophobicContact CB-CG2 4.22Å; E625-V873 HydrophobicContact CG-CG2 4.39Å; D630-V873 PolarHBondContact OD1-N 3.35Å; V873-V875 VanDerWaalsContact C-N 3.25Å; V873-V875 PolarHBondContact O-N 2.88Å; V873-R876 PolarHBondContact O-N 3.44Å; V873-K877 PolarHBondContact O-N 3.16Å
874	F	90.1	Very high	85.8	Confident	1 Å²	1	44.3 Å²	44.3	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-73	-17.1	-179.2	-58.8	-55.7	0	0	0	113.1	D627 M856 L868 D872 R876 K877 P878 L881 L945 T961 R963	D627-F874 WeakPolarHBondContact O-CE1 3.37Å; M856-F874 VanDerWaalsContact CE-O 3.24Å; M856-F874 WeakPolarHBondContact CE-O 3.36Å; L868-F874 HydrophobicContact CD1-CB 3.69Å; D872-F874 PolarHBondContact O-N 3.28Å; D872-F874 WeakPolarHBondContact OD1-CB 3.2Å; D872-F874 WeakPolarHBondContact OD1-CD2 3.03Å; D872-F874 PolarHBondContact OD1-N 3.09Å; F874-R876 VanDerWaalsContact C-N 3.26Å; F874-K877 CarbonylContact O-C 3.54Å; F874-P878 VanDerWaalsContact O-CA 3.31Å; F874-P878 WeakPolarHBondContact O-CA 3.42Å; F874-L881 HydrophobicContact CB-CD1 3.9Å; F874-L881 HydrophobicContact CB-CG 4.39Å; F874-L881 HydrophobicContact CD1-CD1 4.38Å; F874-L881 HydrophobicContact CD1-CD2 3.68Å; F874-L881 HydrophobicContact CD1-CG 4.01Å; F874-L881 HydrophobicContact CD2-CD2 4.46Å; F874-L881 HydrophobicContact CE1-CD2 3.81Å; F874-L881 HydrophobicContact CG-CD1 4.1Å; F874-L881 HydrophobicContact CG-CD2 4.03Å; F874-L881 HydrophobicContact CG-CG 4.25Å; F874-L881 HydrophobicContact CZ-CD2 4.27Å; F874-L945 HydrophobicContact CD2-CD2 3.96Å; F874-L945 HydrophobicContact CE2-CD2 3.62Å; F874-L945 HydrophobicContact CZ-CD2 4.13Å; F874-T961 WeakPolarHBondContact CD2-OG1 3.47Å; F874-T961 WeakPolarHBondContact CE2-OG1 3.25Å; F874-R963 HydrophobicContact CE1-CB 4.22Å; F874-R963 HydrophobicContact CE1-CG 4.21Å; F874-R963 HydrophobicContact CZ-CB 3.8Å; F874-R963 HydrophobicContact CZ-CG 3.99Å
875	V	85.9	Confident	84.3	Confident	34 Å²	34	53.4 Å²	53.4	21%	0.206	25%	0.252	C	S	.	.	H	α-helix	trans	-68.2	-31.8	169.7	177.7	0	0	0	0	110.8	R846 L868 H869 D872 V873	R846-V875 PolarHBondContact NH1-O 3.01Å; R846-V875 PolarHBondContact NH2-O 2.86Å; L868-V875 HydrophobicContact CB-CG2 3.61Å; L868-V875 HydrophobicContact CD1-CG2 4.06Å; H869-V875 WeakPolarHBondContact O-CG2 3.34Å; D872-V875 HydrophobicContact CB-CG2 4.24Å; D872-V875 WeakPolarHBondContact O-CB 2.88Å; D872-V875 PolarHBondContact O-N 2.9Å; D872-V875 VanDerWaalsContact O-N 3.1Å; V873-V875 VanDerWaalsContact C-N 3.25Å; V873-V875 PolarHBondContact O-N 2.88Å
876	R	81.4	Confident	82	Confident	69 Å²	69	53.8 Å²	53.8	26%	0.26	26%	0.261	S	S	.	.	H	α-helix	trans	-88.1	-39.5	179.5	-64.2	-172.3	-66.4	-76.8	5.3	112.4	E625 N871 D872 V873 F874 P878	E625-R876 IonicContact OE1-CZ 3.86Å; E625-R876 IonicContact OE1-NE 3.66Å; E625-R876 PolarHBondContact OE1-NE 3.24Å; E625-R876 IonicContact OE1-NH2 3.19Å; E625-R876 PolarHBondContact OE1-NH2 3.28Å; N871-R876 PolarHBondContact O-NH1 3.26Å; D872-R876 PolarHBondContact O-NH1 3Å; V873-R876 PolarHBondContact O-N 3.44Å; F874-R876 VanDerWaalsContact C-N 3.26Å; R876-P878 VanDerWaalsContact O-CD 3.24Å; R876-P878 WeakPolarHBondContact O-CD 3.49Å
877	K	84.1	Confident	79.2	Confident	74 Å²	74	61 Å²	61	32%	0.322	30%	0.299	S	S	.	.			trans	-117.6	66.9	179.2	-62.5	179.5	-175.9	168	0	111.3	E625 V873 F874 D879 V880	E625-K877 VanDerWaalsContact OE2-CE 3.29Å; E625-K877 WeakPolarHBondContact OE2-CE 3.36Å; E625-K877 IonicContact OE2-NZ 3.52Å; E625-K877 PolarHBondContact OE2-NZ 3.02Å; V873-K877 PolarHBondContact O-N 3.16Å; F874-K877 CarbonylContact O-C 3.54Å; K877-D879 VanDerWaalsContact C-N 3.26Å; K877-D879 PolarHBondContact O-N 3.44Å; K877-V880 HydrophobicContact CB-CG2 4.04Å
878	P	85.3	Confident	76.4	Confident	7 Å²	7	69 Å²	69	5%	0.045	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-67.8	-26.5	-177.3	29.2	-36.3	0	0	0	112.9	V843 M856 F874 R876 V880 L881 F882	V843-P878 HydrophobicContact CG1-CB 4.05Å; V843-P878 HydrophobicContact CG1-CG 3.67Å; V843-P878 HydrophobicContact CG2-CB 3.9Å; V843-P878 HydrophobicContact CG2-CG 4.3Å; M856-P878 HydrophobicContact CE-CB 3.71Å; M856-P878 HydrophobicContact SD-CB 3.58Å; M856-P878 VanDerWaalsContact SD-CB 3.58Å; F874-P878 VanDerWaalsContact O-CA 3.31Å; F874-P878 WeakPolarHBondContact O-CA 3.42Å; R876-P878 VanDerWaalsContact O-CD 3.24Å; R876-P878 WeakPolarHBondContact O-CD 3.49Å; P878-V880 PolarHBondContact O-N 3.47Å; P878-V880 VanDerWaalsContact O-N 3.09Å; P878-L881 PolarHBondContact O-N 2.94Å; P878-F882 WeakPolarHBondContact O-CD2 3.35Å; P878-F882 WeakPolarHBondContact O-CE2 3.47Å
879	D	84.1	Confident	73.4	Confident	117 Å²	117	78 Å²	78	63%	0.626	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-56.9	-29.8	-176.2	-57.4	-37.5	0	0	0	112.7	K877 L881 F882	K877-D879 VanDerWaalsContact C-N 3.26Å; K877-D879 PolarHBondContact O-N 3.44Å; D879-L881 PolarHBondContact O-N 3.25Å; D879-F882 PolarHBondContact O-N 3.44Å
880	V	86.4	Confident	70.7	Confident	34 Å²	34	85.5 Å²	85.5	21%	0.206	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-67.3	-17.3	-178.7	-171.6	0	0	0	0	113.1	D627 K877 P878	D627-V880 HydrophobicContact CB-CG1 3.97Å; D627-V880 HydrophobicContact CB-CG2 4.24Å; K877-V880 HydrophobicContact CB-CG2 4.04Å; P878-V880 PolarHBondContact O-N 3.47Å; P878-V880 VanDerWaalsContact O-N 3.09Å
881	L	87.9	Confident	68.3	Low	22 Å²	22	90.1 Å²	90.1	12%	0.115	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-90.8	-11.4	179.2	-60.7	-175.5	0	0	0	113.5	M856 F858 F874 P878 D879 L945 R963	M856-L881 HydrophobicContact CE-CD1 3.98Å; M856-L881 HydrophobicContact SD-CD1 4.48Å; F858-L881 HydrophobicContact CE1-CD1 4.18Å; F858-L881 HydrophobicContact CZ-CD1 3.73Å; F874-L881 HydrophobicContact CB-CD1 3.9Å; F874-L881 HydrophobicContact CB-CG 4.39Å; F874-L881 HydrophobicContact CD1-CD1 4.38Å; F874-L881 HydrophobicContact CD1-CD2 3.68Å; F874-L881 HydrophobicContact CD1-CG 4.01Å; F874-L881 HydrophobicContact CD2-CD2 4.46Å; F874-L881 HydrophobicContact CE1-CD2 3.81Å; F874-L881 HydrophobicContact CG-CD1 4.1Å; F874-L881 HydrophobicContact CG-CD2 4.03Å; F874-L881 HydrophobicContact CG-CG 4.25Å; F874-L881 HydrophobicContact CZ-CD2 4.27Å; P878-L881 PolarHBondContact O-N 2.94Å; D879-L881 PolarHBondContact O-N 3.25Å; L881-L945 HydrophobicContact CD1-CD1 4.2Å; L881-L945 HydrophobicContact CD2-CD2 3.69Å; L881-L945 HydrophobicContact CD2-CG 4.38Å; L881-R963 HydrophobicContact CD2-CB 4.2Å
882	F	86	Confident	65.8	Low	60 Å²	60	95.2 Å²	95.2	26%	0.263	45%	0.447	S	S	.	.	S	Bend	trans	-96	144.3	178.1	-58.9	-72.9	0	0	0	110.3	N839 A840 V843 M856 P878 D879 E884	N839-F882 HydrophobicContact CB-CE1 4.04Å; N839-F882 HydrophobicContact CB-CZ 4Å; A840-F882 HydrophobicContact CB-CD1 4.28Å; A840-F882 HydrophobicContact CB-CE1 3.89Å; A840-F882 HydrophobicContact CB-CZ 4.48Å; V843-F882 HydrophobicContact CB-CE2 4.22Å; V843-F882 HydrophobicContact CB-CZ 4.37Å; V843-F882 HydrophobicContact CG1-CE2 4.35Å; V843-F882 HydrophobicContact CG2-CE2 3.95Å; V843-F882 HydrophobicContact CG2-CZ 3.94Å; M856-F882 HydrophobicContact SD-CZ 4.43Å; P878-F882 WeakPolarHBondContact O-CD2 3.35Å; P878-F882 WeakPolarHBondContact O-CE2 3.47Å; D879-F882 PolarHBondContact O-N 3.44Å; F882-E884 PolarHBondContact O-N 3.48Å
883	P	79.2	Confident	63.1	Low	39 Å²	39	102.2 Å²	102.2	25%	0.253	48%	0.484	S	S	.	.			trans	-50.8	137.9	169.9	-28.6	36.7	0	0	0	111.6	R885 A939 D941	P883-R885 PolarHBondContact O-N 3.2Å; P883-A939 HydrophobicContact CB-CB 3.62Å; P883-A939 HydrophobicContact CG-CB 3.85Å; P883-D941 WeakPolarHBondContact CA-OD1 3.15Å; P883-D941 VanDerWaalsContact CB-OD1 3.31Å; P883-D941 WeakPolarHBondContact CB-OD1 3.26Å
884	E	69.1	Low	60.3	Low	153 Å²	153	110.7 Å²	110.7	72%	0.715	52%	0.523	S	S	*	.			trans	-63.9	107.8	172.6	-74.3	-166	-177.6	0	0	109	F882 N886 D941	F882-E884 PolarHBondContact O-N 3.48Å; E884-N886 PolarHBondContact O-N 3.5Å; E884-D941 PolarHBondContact N-OD2 2.91Å
885	R	58.7	Low	57.4	Low	209 Å²	209	115.9 Å²	115.9	79%	0.789	56%	0.557	S	S	*	*			trans	-62.6	125.6	165.7	-72.4	-178.6	174.9	169.1	-1.6	106.5	P883 L887	P883-R885 PolarHBondContact O-N 3.2Å; R885-L887 HydrophobicContact CB-CD1 4.26Å; R885-L887 PolarHBondContact O-N 3.19Å
886	N	41.2	Very low	54.7	Low	149 Å²	149	121.9 Å²	121.9	80%	0.797	59%	0.588	S	S	*	*			trans	-54.8	62.6	177.7	-76.3	-30.8	0	0	0	113.8	E884 K888	E884-N886 PolarHBondContact O-N 3.5Å; N886-K888 VanDerWaalsContact C-N 3.35Å; N886-K888 PolarHBondContact O-N 3.14Å
887	L	33.8	Very low	52	Low	151 Å²	151	125.1 Å²	125.1	79%	0.791	62%	0.615	S	S	*	*			trans	-99.7	51.9	178.7	-85.3	160.8	0	0	0	109.1	R885	R885-L887 HydrophobicContact CB-CD1 4.26Å; R885-L887 PolarHBondContact O-N 3.19Å
888	K	33.1	Very low	49.2	Very low	176 Å²	176	126 Å²	126	77%	0.765	63%	0.631	S	S	*	*			trans	-140.4	79.5	165.3	-72.1	-174.6	-177.4	158.6	0	110.5	N886 R890	N886-K888 VanDerWaalsContact C-N 3.35Å; N886-K888 PolarHBondContact O-N 3.14Å; K888-R890 PolarHBondContact O-N 3.12Å
889	K	29.2	Very low	46.3	Very low	201 Å²	201	135.3 Å²	135.3	87%	0.874	67%	0.67	S	S	*	*			trans	-59.2	93.5	136.6	-79.3	-171.8	177.4	-175.2	0	105.7	N891	K889-N891 PolarHBondContact O-N 2.77Å
890	R	29.8	Very low	43.5	Very low	219 Å²	219	135.9 Å²	135.9	83%	0.826	68%	0.678	S	S	*	*			trans	-61.1	92.4	166	-126.4	176.5	166.7	170.9	-5.4	105.2	K888 N892	K888-R890 PolarHBondContact O-N 3.12Å; R890-N892 VanDerWaalsContact C-N 3.34Å; R890-N892 PolarHBondContact O-N 3.03Å
891	N	31.7	Very low	40.4	Very low	140 Å²	140	142.5 Å²	142.5	75%	0.749	71%	0.706	S	S	*	*			trans	-59.8	106.3	165.2	-88.7	-8.8	0	0	0	105.9	K889 N893	K889-N891 PolarHBondContact O-N 2.77Å; N891-N893 PolarHBondContact O-N 3.08Å
892	N	28.9	Very low	37.4	Very low	144 Å²	144	151.4 Å²	151.4	77%	0.77	74%	0.744	S	S	*	*			trans	-61.9	80.2	171.1	-76.6	-22.7	0	0	0	109	R890	R890-N892 VanDerWaalsContact C-N 3.34Å; R890-N892 PolarHBondContact O-N 3.03Å
893	N	32.2	Very low	34.4	Very low	147 Å²	147	153.5 Å²	153.5	79%	0.786	77%	0.767	S	S	*	*			trans	-114.8	96.2	155.7	-80.1	-16.9	0	0	0	106.2	N891	N891-N893 PolarHBondContact O-N 3.08Å
894	H	29	Very low	31.7	Very low	179 Å²	179	160.2 Å²	160.2	83%	0.829	80%	0.795	S	S	*	*			trans	-41.1	122.2	171.3	-105.3	-86	0	0	0	110.4	N896	H894-N896 PolarHBondContact O-N 3.24Å
895	P	29	Very low	29.5	Very low	109 Å²	109	159.6 Å²	159.6	71%	0.708	80%	0.801	S	S	*	*			trans	-74.8	110.5	172.5	30.4	-29.5	0	0	0	107.2	V897	P895-V897 PolarHBondContact O-N 3.43Å
896	N	27.9	Very low	27.8	Very low	161 Å²	161	154.6 Å²	154.6	86%	0.861	80%	0.798	S	S	*	*			trans	-59.2	101.7	169.8	-91.4	-27.1	0	0	0	109.2	H894 S898	H894-N896 PolarHBondContact O-N 3.24Å; N896-S898 PolarHBondContact O-N 3.35Å
897	V	25.9	Very low	26.9	Very low	136 Å²	136	155.2 Å²	155.2	82%	0.824	80%	0.801	S	S	*	*			trans	-63.7	99	164.9	175.8	0	0	0	0	107.3	P895	P895-V897 PolarHBondContact O-N 3.43Å
898	S	24.4	Very low	26.4	Very low	94 Å²	94	152.8 Å²	152.8	66%	0.657	80%	0.796	S	S	*	*			trans	158.6	113.3	144.9	49.6	0	0	0	0	110.1	N896	N896-S898 PolarHBondContact O-N 3.35Å
899	K	25	Very low	26.1	Very low	201 Å²	201	151.9 Å²	151.9	87%	0.874	80%	0.8	S	S	*	*				171.1	100.4	118.2	-91.5	165.6	-176.6	175.6	0	109.7	Q901	K899-Q901 PolarHBondContact O-N 3.26Å
900	V	25.7	Very low	25.9	Very low	129 Å²	129	151.6 Å²	151.6	78%	0.782	80%	0.799	S	S	*	*			trans	-45.4	123.3	153.4	169.8	0	0	0	0	109.4
901	Q	21.5	Very low	25.8	Very low	173 Å²	173	148.9 Å²	148.9	81%	0.808	80%	0.8	S	S	*	*			trans	35.6	100.9	150	-64	171.6	-13.4	0	0	117.4	K899	K899-Q901 PolarHBondContact O-N 3.26Å
902	K	25.1	Very low	25.5	Very low	210 Å²	210	146.7 Å²	146.7	91%	0.913	80%	0.796	S	S	*	*			trans	-134	118.3	136.7	-79.1	-167	177.6	177.7	0	110.3
903	S	22.2	Very low	25.3	Very low	104 Å²	104	148.3 Å²	148.3	73%	0.727	80%	0.797	S	S	*	*			trans	-49.6	139	170.8	45.8	0	0	0	0	113.8
904	Q	21.7	Very low	25.1	Very low	180 Å²	180	149 Å²	149	84%	0.841	80%	0.795	S	S	*	*			trans	49.1	107	141.2	-59.5	179.5	3.6	0	0	117.7
905	T	23.8	Very low	24.9	Very low	140 Å²	140	144.9 Å²	144.9	86%	0.859	79%	0.787	S	S	*	*				-173.6	128.5	117.3	37.4	0	0	0	0	109.8
906	S	21.7	Very low	25	Very low	103 Å²	103	151.5 Å²	151.5	72%	0.72	80%	0.797	S	S	*	*			trans	-40	137.6	163	49	0	0	0	0	113.8
907	L	24	Very low	25.1	Very low	162 Å²	162	150 Å²	150	85%	0.848	79%	0.789	S	S	*	*				-179.6	128	121.1	-93.2	147.7	0	0	0	110.1
908	S	22	Very low	25.4	Very low	100 Å²	100	151.3 Å²	151.3	70%	0.699	79%	0.792	S	S	*	*			trans	-49.7	137.2	168.7	49.4	0	0	0	0	113.3
909	N	27.4	Very low	25.6	Very low	157 Å²	157	153.8 Å²	153.8	84%	0.84	80%	0.797	S	S	*	*			trans	-154.6	111.8	135.6	-116	-12.2	0	0	0	111.6
910	K	24.2	Very low	26.1	Very low	195 Å²	195	153.4 Å²	153.4	85%	0.848	80%	0.796	S	S	*	*			trans	-62.6	131.7	158.1	-69.6	172.2	173.7	176.4	0	106.9
911	N	28.2	Very low	26.3	Very low	162 Å²	162	154.7 Å²	154.7	87%	0.866	80%	0.799	S	S	*	*			trans	-152.9	136.4	141.7	-97.1	-20.1	0	0	0	111.1
912	S	25.3	Very low	26.8	Very low	94 Å²	94	153.8 Å²	153.8	66%	0.657	80%	0.799	S	S	*	*			trans	-98.3	144.7	-162.4	46.5	0	0	0	0	111.5
913	K	24.9	Very low	27	Very low	179 Å²	179	152.7 Å²	152.7	78%	0.778	80%	0.797	S	S	*	*			trans	76	145.9	132.5	-76.9	-179.6	175	-176.3	0	120.9
914	Q	27.9	Very low	27.2	Very low	160 Å²	160	156.3 Å²	156.3	75%	0.748	80%	0.803	S	S	*	*			trans	80.3	94.7	153.5	-88.8	136.6	-24.7	0	0	116.7
915	S	25.9	Very low	27.5	Very low	94 Å²	94	154 Å²	154	66%	0.657	80%	0.801	S	S	*	*				69	106.4	69	77	0	0	0	0	112.4
916	R	30	Very low	27.7	Very low	248 Å²	248	155.7 Å²	155.7	94%	0.936	80%	0.799	S	S	*	*			trans	-132.4	126.2	156.9	-78.5	-172.4	177.5	177	-1.3	107.6
917	D	29.4	Very low	28.1	Very low	130 Å²	130	158.6 Å²	158.6	70%	0.695	80%	0.802	S	S	*	*			trans	-67.1	144.3	178.7	-45.7	-64.2	0	0	0	109.9
918	D	32.5	Very low	28.4	Very low	163 Å²	163	159 Å²	159	87%	0.872	80%	0.799	S	S	*	*			trans	-152.7	107.5	150.8	-88.6	-37.1	0	0	0	107
919	D	30	Very low	29	Very low	145 Å²	145	160.9 Å²	160.9	78%	0.775	80%	0.801	S	S	*	*			trans	-64	128.3	177.2	-66.8	-50.8	0	0	0	110.7
920	F	34	Very low	29.4	Very low	194 Å²	194	159.9 Å²	159.9	85%	0.851	79%	0.794	S	S	*	*			trans	-133.6	106.9	157.9	-98.3	-87.6	0	0	0	108.3	D922	F920-D922 PolarHBondContact O-N 3.14Å
921	D	30	Very low	30.2	Very low	155 Å²	155	155.5 Å²	155.5	83%	0.829	79%	0.786	S	S	*	*			trans	-64.3	118.2	168.9	-65.7	-52.9	0	0	0	109.3
922	D	32.5	Very low	31.3	Very low	154 Å²	154	156 Å²	156	82%	0.824	78%	0.783	S	S	*	*			trans	-137.7	133.8	162.1	-93	-35.8	0	0	0	109.4	F920	F920-D922 PolarHBondContact O-N 3.14Å
923	E	29.7	Very low	33.3	Very low	187 Å²	187	157.9 Å²	157.9	87%	0.874	79%	0.791	S	S	*	*			trans	-61.9	134	-157.9	-67.9	169.8	139.5	0	0	114.4	T925	E923-T925 PolarHBondContact O-N 3.35Å; E923-T925 VanDerWaalsContact O-N 3.12Å
924	Q	26.4	Very low	35.7	Very low	181 Å²	181	151.7 Å²	151.7	85%	0.846	77%	0.765	S	S	*	*			trans	-63.2	105.3	177.9	-68.1	169.9	-6	0	0	110.6
925	T	27.8	Very low	37.9	Very low	131 Å²	131	147.1 Å²	147.1	80%	0.804	75%	0.75	S	S	*	*			trans	-82.7	107.5	158.1	9.1	0	0	0	0	107.1	E923 E927	E923-T925 PolarHBondContact O-N 3.35Å; E923-T925 VanDerWaalsContact O-N 3.12Å; T925-E927 PolarHBondContact O-N 3.31Å
926	E	29.1	Very low	40.3	Very low	176 Å²	176	148.8 Å²	148.8	82%	0.822	76%	0.761	S	S	*	*			trans	-65.7	88.2	178.3	-65.3	-179.4	158.6	0	0	110.1	E928	E926-E928 PolarHBondContact O-N 2.82Å
927	E	28.7	Very low	42.7	Very low	164 Å²	164	139.3 Å²	139.3	77%	0.766	74%	0.741	S	S	*	*			trans	-77.8	95.3	165.4	-75.7	-171.8	169.6	0	0	109.5	T925 N929	T925-E927 PolarHBondContact O-N 3.31Å; E927-N929 VanDerWaalsContact C-N 3.3Å; E927-N929 PolarHBondContact O-N 3.15Å
928	E	30.5	Very low	45.3	Very low	170 Å²	170	135.1 Å²	135.1	79%	0.794	72%	0.716	S	S	*	*			trans	-62.5	84.7	167.9	-72.6	-172.3	149	0	0	111	E926 I930	E926-E928 PolarHBondContact O-N 2.82Å; E928-I930 PolarHBondContact O-N 2.66Å
929	N	35.4	Very low	47.9	Very low	139 Å²	139	127.9 Å²	127.9	74%	0.743	68%	0.68	S	S	*	*			trans	-81.2	84.1	166.1	-87.8	-66.7	0	0	0	109.9	E927 P931	E927-N929 VanDerWaalsContact C-N 3.3Å; E927-N929 PolarHBondContact O-N 3.15Å; N929-P931 VanDerWaalsContact O-CD 3.31Å; N929-P931 WeakPolarHBondContact O-CD 3.31Å
930	I	34.6	Very low	50.5	Low	136 Å²	136	125.4 Å²	125.4	70%	0.697	66%	0.66	S	S	*	*			trans	-84.2	111.1	165.4	-54.5	174	0	0	0	107.3	E928 E932	E928-I930 PolarHBondContact O-N 2.66Å; I930-E932 PolarHBondContact O-N 3.39Å; I930-E932 VanDerWaalsContact O-N 3.14Å
931	P	41.5	Very low	53	Low	104 Å²	104	118.3 Å²	118.3	68%	0.675	63%	0.631	S	S	*	*			trans	-72.8	110	172.7	28.5	-26.6	0	0	0	107.7	N929 V933	N929-P931 VanDerWaalsContact O-CD 3.31Å; N929-P931 WeakPolarHBondContact O-CD 3.31Å; P931-V933 PolarHBondContact O-N 3.47Å
932	E	51.8	Low	55.9	Low	173 Å²	173	112.5 Å²	112.5	81%	0.808	60%	0.599	S	S	*	*			trans	-54.4	99.5	170.9	-98.3	-177.2	154.8	0	0	109.6	I930 L934	I930-E932 PolarHBondContact O-N 3.39Å; I930-E932 VanDerWaalsContact O-N 3.14Å; E932-L934 PolarHBondContact O-N 3.26Å
933	V	67.4	Low	58.7	Low	133 Å²	133	107.1 Å²	107.1	81%	0.806	57%	0.569	S	S	*	*			trans	-76	105.6	170.9	-179.5	0	0	0	0	106.4	P931	P931-V933 PolarHBondContact O-N 3.47Å
934	L	74.9	Confident	61.7	Low	48 Å²	48	98.4 Å²	98.4	25%	0.251	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-54.4	143.2	174.3	-73.3	173.6	0	0	0	110.8	E932 Y940 L997 A1090	E932-L934 PolarHBondContact O-N 3.26Å; L934-Y940 HydrophobicContact CD1-CD2 4.14Å; L934-Y940 HydrophobicContact CD1-CE2 3.68Å; L934-Y940 HydrophobicContact CD2-CE2 4.49Å; L934-L997 HydrophobicContact CD2-CD1 4.13Å; L934-A1090 HydrophobicContact CD1-CB 4.29Å; L934-A1090 HydrophobicContact CD2-CB 3.74Å
935	P	74.8	Confident	65	Low	64 Å²	64	90 Å²	90	42%	0.416	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-56.5	148.8	174.7	-20.6	30.6	0	0	0	111.8	G937 F938 L997	P935-G937 PolarHBondContact O-N 3.34Å; P935-F938 HydrophobicContact CB-CD2 3.72Å; P935-F938 HydrophobicContact CB-CE2 4.1Å; P935-F938 HydrophobicContact CB-CG 4.47Å; P935-F938 HydrophobicContact CG-CD2 4.31Å; P935-F938 WeakPolarHBondContact O-CB 3.47Å; P935-F938 PolarHBondContact O-N 2.94Å; P935-L997 HydrophobicContact CG-CD1 4.24Å; P935-L997 HydrophobicContact CG-CD2 4.36Å
936	S	75	Confident	68.2	Low	129 Å²	129	83.8 Å²	83.8	90%	0.902	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	125.3	-178	-175.4	0	0	0	0	111.7
937	G	79.9	Confident	71.3	Confident	49 Å²	49	76.3 Å²	76.3	51%	0.505	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-6.8	179.3	0	0	0	0	0	115.5	P935 H942 S1092	P935-G937 PolarHBondContact O-N 3.34Å; G937-H942 PolarHBondContact O-CE1 3.32Å; G937-H942 PolarHBondContact O-NE2 3.41Å; G937-S1092 VanDerWaalsContact O-CB 3.29Å; G937-S1092 WeakPolarHBondContact O-CB 3.42Å
938	F	85.5	Confident	74.2	Confident	42 Å²	42	68.7 Å²	68.7	18%	0.184	38%	0.38	C	S	.	.			trans	-88.3	134.7	173.8	-73.2	-103.1	0	0	0	111.4	P935 R995 L997 Y1091 S1092	P935-F938 HydrophobicContact CB-CD2 3.72Å; P935-F938 HydrophobicContact CB-CE2 4.1Å; P935-F938 HydrophobicContact CB-CG 4.47Å; P935-F938 HydrophobicContact CG-CD2 4.31Å; P935-F938 WeakPolarHBondContact O-CB 3.47Å; P935-F938 PolarHBondContact O-N 2.94Å; F938-R995 HydrophobicContact CE1-CB 4.25Å; F938-R995 WeakPolarHBondContact CE1-O 3.46Å; F938-R995 HydrophobicContact CZ-CB 4.18Å; F938-L997 HydrophobicContact CB-CD1 4.34Å; F938-L997 HydrophobicContact CD1-CD1 3.66Å; F938-L997 HydrophobicContact CD1-CD2 4.03Å; F938-L997 HydrophobicContact CD1-CG 3.53Å; F938-L997 HydrophobicContact CE1-CD1 4.16Å; F938-L997 HydrophobicContact CE1-CD2 3.65Å; F938-L997 HydrophobicContact CE1-CG 3.54Å; F938-L997 HydrophobicContact CG-CD1 4.06Å; F938-L997 HydrophobicContact CG-CG 4.35Å; F938-L997 HydrophobicContact CZ-CD2 3.96Å; F938-L997 HydrophobicContact CZ-CG 4.34Å; F938-Y1091 WeakPolarHBondContact CA-O 3.42Å; F938-Y1091 VanDerWaalsContact CD1-C 3.47Å; F938-S1092 WeakPolarHBondContact CZ-OG 3.42Å
939	A	86.5	Confident	77	Confident	12 Å²	12	61.9 Å²	61.9	10%	0.099	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-149.8	165.9	172.6	0	0	0	0	0	111.1	P883 H942 Y1091	P883-A939 HydrophobicContact CB-CB 3.62Å; P883-A939 HydrophobicContact CG-CB 3.85Å; A939-H942 PolarHBondContact N-NE2 3.3Å; A939-Y1091 PolarHBondContact N-O 3.03Å; A939-Y1091 PolarHBondContact O-N 2.95Å
940	Y	85.2	Confident	79.7	Confident	92 Å²	92	55.4 Å²	55.4	36%	0.361	31%	0.314	S	S	.	.	S	Bend	trans	-87.9	-22.4	177.6	-64	-81.1	0	0	0	112.5	L934 G1089 A1090	L934-Y940 HydrophobicContact CD1-CD2 4.14Å; L934-Y940 HydrophobicContact CD1-CE2 3.68Å; L934-Y940 HydrophobicContact CD2-CE2 4.49Å; Y940-G1089 VanDerWaalsContact CD1-C 3.45Å; Y940-A1090 HydrophobicContact CD1-CB 3.94Å; Y940-A1090 HydrophobicContact CE1-CB 3.55Å; Y940-A1090 HydrophobicContact CE2-CB 4.18Å; Y940-A1090 HydrophobicContact CG-CB 4.39Å
941	D	86.5	Confident	82.3	Confident	45 Å²	45	51.7 Å²	51.7	24%	0.241	29%	0.294	C	S	.	.			trans	-126.6	29.9	-161.2	67.4	-33.3	0	0	0	113.5	P883 E884 Q943	P883-D941 WeakPolarHBondContact CA-OD1 3.15Å; P883-D941 VanDerWaalsContact CB-OD1 3.31Å; P883-D941 WeakPolarHBondContact CB-OD1 3.26Å; E884-D941 PolarHBondContact N-OD2 2.91Å; D941-Q943 PolarHBondContact O-N 3.31Å; D941-Q943 PolarHBondContact O-NE2 2.96Å
942	H	89.6	Confident	84.6	Confident	33 Å²	33	48.3 Å²	48.3	15%	0.153	27%	0.27	C	S	.	.			trans	-50.8	134.8	174.2	-72.7	-75.4	0	0	0	111.8	G937 A939 A966 Y1091 I1093	G937-H942 PolarHBondContact O-CE1 3.32Å; G937-H942 PolarHBondContact O-NE2 3.41Å; A939-H942 PolarHBondContact N-NE2 3.3Å; H942-A966 HydrophobicContact CB-CB 3.99Å; H942-A966 WeakPolarHBondContact O-CB 3.48Å; H942-A966 PolarHBondContact O-N 3Å; H942-Y1091 HydrophobicContact CB-CE2 3.68Å; H942-Y1091 AromaticContact CD2-CD2 3.71Å; H942-Y1091 AromaticContact CD2-CE2 3.49Å; H942-Y1091 VanDerWaalsContact CD2-CE2 3.49Å; H942-Y1091 WeakPolarHBondContact CD2-CE2 3.41Å; H942-Y1091 PolarHBondContact CD2-O 3.4Å; H942-Y1091 AromaticContact CG-CE2 3.92Å; H942-Y1091 PolarHBondContact NE2-O 3.08Å; H942-I1093 HydrophobicContact CB-CD1 4.31Å
943	Q	91.2	Very high	86.1	Confident	42 Å²	42	43 Å²	43	20%	0.196	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.4	-180	-57.8	-60.9	-49.4	0	0	110.5	D941 V964	D941-Q943 PolarHBondContact O-N 3.31Å; D941-Q943 PolarHBondContact O-NE2 2.96Å; Q943-V964 PolarHBondContact OE1-O 2.87Å
944	L	94	Very high	86.7	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	160.1	166.6	-64.4	174.4	0	0	0	109.7	L832 I834 R963 V964 A966 L970 L992	L832-L944 HydrophobicContact CD1-CB 3.77Å; L832-L944 HydrophobicContact CD1-CD1 4.06Å; L832-L944 HydrophobicContact CD2-CD1 3.79Å; L832-L944 HydrophobicContact CG-CB 4.46Å; L832-L944 HydrophobicContact CG-CD1 4.19Å; I834-L944 HydrophobicContact CB-CD2 3.87Å; I834-L944 HydrophobicContact CD1-CD2 4.21Å; I834-L944 HydrophobicContact CG1-CD2 3.8Å; L944-R963 WeakPolarHBondContact O-CA 3.44Å; L944-V964 HydrophobicContact CB-CG2 4.21Å; L944-V964 PolarHBondContact N-O 2.98Å; L944-V964 PolarHBondContact O-N 2.83Å; L944-A966 HydrophobicContact CD1-CB 3.74Å; L944-A966 HydrophobicContact CD2-CB 4.47Å; L944-A966 HydrophobicContact CG-CB 3.58Å; L944-L970 HydrophobicContact CD1-CD1 4.05Å; L944-L970 HydrophobicContact CD1-CD2 4.11Å; L944-L970 HydrophobicContact CD1-CG 4.02Å; L944-L992 HydrophobicContact CD1-CD1 4.49Å
945	L	95	Very high	87.3	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.016	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.5	173.8	-69.7	-175.4	0	0	0	110.1	A833 F858 L868 F874 L881 L958 I962 R963	A833-L945 HydrophobicContact CB-CB 4.32Å; A833-L945 PolarHBondContact N-O 3.48Å; A833-L945 PolarHBondContact O-N 2.72Å; F858-L945 HydrophobicContact CD1-CD1 3.86Å; F858-L945 HydrophobicContact CE1-CD1 3.37Å; F858-L945 HydrophobicContact CE1-CG 4.12Å; F858-L945 HydrophobicContact CE2-CD1 4.42Å; F858-L945 HydrophobicContact CZ-CD1 3.7Å; L868-L945 HydrophobicContact CD2-CD1 3.82Å; F874-L945 HydrophobicContact CD2-CD2 3.96Å; F874-L945 HydrophobicContact CE2-CD2 3.62Å; F874-L945 HydrophobicContact CZ-CD2 4.13Å; L881-L945 HydrophobicContact CD1-CD1 4.2Å; L881-L945 HydrophobicContact CD2-CD2 3.69Å; L881-L945 HydrophobicContact CD2-CG 4.38Å; L945-L958 HydrophobicContact CD1-CD1 4.43Å; L945-I962 WeakPolarHBondContact CA-O 3.47Å; L945-R963 HydrophobicContact CD2-CB 4.12Å
946	M	95	Very high	88.1	Confident	1 Å²	1	41 Å²	41	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	143.5	160.9	-59	-124.2	64.3	0	0	108.3	A825 M828 Q831 L832 T961 I962 V964 T969	A825-M946 WeakPolarHBondContact CA-SD 3.49Å; A825-M946 HydrophobicContact CB-CG 4.44Å; A825-M946 HydrophobicContact CB-SD 3.44Å; A825-M946 WeakPolarHBondContact CB-SD 3.25Å; M828-M946 HydrophobicContact CB-CE 4.15Å; M828-M946 HydrophobicContact CB-SD 4.43Å; M828-M946 HydrophobicContact CE-CB 4.08Å; M828-M946 HydrophobicContact SD-CB 4.28Å; Q831-M946 WeakPolarHBondContact O-CA 3.32Å; Q831-M946 WeakPolarHBondContact O-CE 3.3Å; L832-M946 HydrophobicContact CB-CE 4.21Å; L832-M946 HydrophobicContact CD1-CE 4.01Å; L832-M946 HydrophobicContact CD1-CG 4.02Å; L832-M946 HydrophobicContact CD1-SD 4.33Å; M946-T961 CarbonylContact O-C 3.59Å; M946-T961 VanDerWaalsContact O-CA 3.26Å; M946-T961 WeakPolarHBondContact O-CA 3.43Å; M946-I962 PolarHBondContact N-O 2.95Å; M946-I962 PolarHBondContact O-N 3.35Å; M946-V964 HydrophobicContact CG-CB 4.43Å; M946-V964 HydrophobicContact CG-CG1 3.9Å; M946-V964 HydrophobicContact CG-CG2 3.62Å; M946-T969 HydrophobicContact SD-CG2 4.36Å
947	Y	94.1	Very high	89	Confident	20 Å²	20	35.5 Å²	35.5	8%	0.078	19%	0.193	C	C	.	.			trans	-136.3	147.1	-179.8	62.9	-89.9	0	0	0	110	M828 Q831 A833 T860 L950 L958	M828-Y947 VanDerWaalsContact CE-O 3.3Å; M828-Y947 WeakPolarHBondContact CE-O 3.49Å; Q831-Y947 HydrophobicContact CB-CD1 4.42Å; Q831-Y947 HydrophobicContact CB-CD2 4.16Å; Q831-Y947 HydrophobicContact CB-CE1 4.19Å; Q831-Y947 HydrophobicContact CB-CE2 3.9Å; Q831-Y947 HydrophobicContact CB-CG 4.42Å; Q831-Y947 WeakPolarHBondContact CB-O 3.47Å; Q831-Y947 HydrophobicContact CG-CE2 4.39Å; Q831-Y947 WeakPolarHBondContact O-CD1 3.13Å; Q831-Y947 PolarHBondContact O-N 3.39Å; Q831-Y947 PolarHBondContact OE1-O 2.84Å; A833-Y947 HydrophobicContact CB-CD1 4Å; A833-Y947 HydrophobicContact CB-CE1 4.09Å; T860-Y947 HydrophobicContact CG2-CE1 3.72Å; Y947-L950 HydrophobicContact CE2-CB 4.1Å; Y947-L958 HydrophobicContact CD1-CD2 3.6Å; Y947-L958 HydrophobicContact CD2-CD2 4.06Å; Y947-L958 HydrophobicContact CE1-CD2 3.99Å; Y947-L958 HydrophobicContact CE2-CD2 4.43Å; Y947-L958 HydrophobicContact CG-CD2 3.63Å
948	L	90.2	Very high	89.6	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.021	17%	0.169	C	C	.	.	S	Bend	trans	-81.9	-40.8	-178.8	-174.1	67.9	0	0	0	111.2	I574 M597 M828 Q831 V959 N960	I574-L948 HydrophobicContact CD1-CD2 4.47Å; I574-L948 HydrophobicContact CG1-CD1 4.23Å; M597-L948 HydrophobicContact CB-CD2 4.05Å; M828-L948 HydrophobicContact CE-CB 4.14Å; Q831-L948 PolarHBondContact NE2-O 2.83Å; Q831-L948 PolarHBondContact OE1-O 3.36Å; L948-V959 PolarHBondContact N-O 3.5Å; L948-V959 VanDerWaalsContact N-O 3.15Å; L948-N960 HydrophobicContact CB-CB 3.85Å; L948-N960 HydrophobicContact CD2-CB 4.47Å
949	D	88.6	Confident	89.8	Confident	26 Å²	26	32.6 Å²	32.6	14%	0.139	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.7	-175	-94.8	-23.6	0	0	0	110.8	R455 V959	R455-D949 IonicContact CZ-OD1 2.72Å; R455-D949 IonicContact CZ-OD2 3.24Å; R455-D949 IonicContact NE-OD2 2.95Å; R455-D949 IonicContact NH1-OD1 2.73Å; R455-D949 IonicContact NH1-OD2 2.95Å; R455-D949 PolarHBondContact NH1-OD2 2.97Å; D949-V959 HydrophobicContact CB-CB 4.47Å; D949-V959 PolarHBondContact O-N 2.97Å
950	L	91.3	Very high	90	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.016	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.4	167.4	-170.1	70.8	0	0	0	107.5	M454 R455 K863 V866 Y947 L958	M454-L950 HydrophobicContact CB-CB 4.32Å; M454-L950 HydrophobicContact CB-CD2 3.82Å; M454-L950 HydrophobicContact CB-CG 4.12Å; M454-L950 HydrophobicContact CG-CB 3.97Å; M454-L950 HydrophobicContact CG-CD2 3.77Å; M454-L950 HydrophobicContact CG-CG 3.59Å; M454-L950 VanDerWaalsContact CG-O 3.3Å; M454-L950 WeakPolarHBondContact CG-O 3.15Å; M454-L950 HydrophobicContact SD-CB 4.49Å; M454-L950 HydrophobicContact SD-CD1 4.4Å; M454-L950 HydrophobicContact SD-CD2 3.52Å; M454-L950 VanDerWaalsContact SD-CD2 3.52Å; M454-L950 HydrophobicContact SD-CG 3.48Å; M454-L950 WeakPolarHBondContact SD-CG 3.42Å; R455-L950 PolarHBondContact N-O 3.13Å; K863-L950 HydrophobicContact CB-CD2 4.24Å; K863-L950 HydrophobicContact CG-CD2 4.45Å; V866-L950 HydrophobicContact CB-CD1 4.4Å; V866-L950 HydrophobicContact CG1-CD1 3.39Å; V866-L950 HydrophobicContact CG2-CD1 4.1Å; Y947-L950 HydrophobicContact CE2-CB 4.1Å; L950-L958 HydrophobicContact CD1-CD2 3.75Å
951	M	90.1	Very high	90.4	Very high	58 Å²	58	29.2 Å²	29.2	29%	0.286	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.1	-176.8	-172.5	179.5	-65.3	0	0	111.7	R455 T953 F957 V959	R455-M951 CarbonylContact O-C 3.55Å; R455-M951 VanDerWaalsContact O-CA 3.28Å; R455-M951 WeakPolarHBondContact O-CA 3.29Å; M951-T953 HydrophobicContact CG-CG2 4.37Å; M951-T953 HydrophobicContact SD-CG2 4.34Å; M951-F957 PolarHBondContact N-O 2.94Å; M951-F957 WeakPolarHBondContact O-CB 3.5Å; M951-F957 PolarHBondContact O-N 3.24Å; M951-V959 HydrophobicContact CB-CG2 4.07Å
952	E	90	Very high	90.8	Very high	34 Å²	34	27.1 Å²	27.1	16%	0.159	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123	171.8	179.7	178.1	-123.1	0	0	110.2	M454 R455 C456 L457 K458 K955	M454-E952 HydrophobicContact CE-CB 3.53Å; M454-E952 HydrophobicContact CE-CG 4.22Å; M454-E952 HydrophobicContact CG-CB 4.36Å; M454-E952 HydrophobicContact SD-CB 3.71Å; R455-E952 PolarHBondContact O-N 2.93Å; C456-E952 CarbonylContact C-O 3.49Å; C456-E952 PolarHBondContact SG-OE2 2.9Å; L457-E952 PolarHBondContact N-O 2.72Å; K458-E952 WeakPolarHBondContact CE-OE2 3.14Å; K458-E952 IonicContact NZ-OE2 2.66Å; K458-E952 PolarHBondContact NZ-OE2 3.14Å; E952-K955 WeakPolarHBondContact CA-O 3.36Å
953	T	83	Confident	91	Very high	61 Å²	61	27.3 Å²	27.3	37%	0.374	14%	0.144	S	C	.	.	S	Bend	trans	-113.7	-73.2	169.3	56.6	0	0	0	0	109.4	L457 M951 K955 F957	L457-T953 HydrophobicContact CB-CG2 4.23Å; L457-T953 HydrophobicContact CD2-CG2 4.3Å; M951-T953 HydrophobicContact CG-CG2 4.37Å; M951-T953 HydrophobicContact SD-CG2 4.34Å; T953-K955 PolarHBondContact N-O 2.8Å; T953-F957 WeakPolarHBondContact OG1-CE2 3.49Å
954	T	81.1	Confident	91.1	Very high	127 Å²	127	25.3 Å²	25.3	78%	0.779	14%	0.135	S	C	*	.	S	Bend	trans	-97.3	-32.5	167	53	0	0	0	0	111.9
955	K	87.1	Confident	91	Very high	60 Å²	60	26.3 Å²	26.3	26%	0.261	14%	0.141	S	C	.	.	S	Bend	trans	-147.9	165.5	176.2	67.2	-175.2	175.1	-160.4	0	108.9	E855 T867 E952 T953 F957	E855-K955 IonicContact OE1-NZ 3.88Å; E855-K955 PolarHBondContact OE1-NZ 3.02Å; E855-K955 IonicContact OE2-NZ 3.47Å; E855-K955 PolarHBondContact OE2-NZ 3.04Å; T867-K955 HydrophobicContact CG2-CD 4.33Å; T867-K955 WeakPolarHBondContact OG1-CE 3.41Å; E952-K955 WeakPolarHBondContact CA-O 3.36Å; T953-K955 PolarHBondContact N-O 2.8Å; K955-F957 HydrophobicContact CD-CE1 4.21Å; K955-F957 HydrophobicContact CD-CZ 4.06Å; K955-F957 HydrophobicContact CG-CD2 4.49Å; K955-F957 HydrophobicContact CG-CE1 3.86Å; K955-F957 HydrophobicContact CG-CE2 3.78Å; K955-F957 HydrophobicContact CG-CZ 3.45Å; K955-F957 VanDerWaalsContact CG-CZ 3.45Å; K955-F957 WeakPolarHBondContact O-CD2 3.48Å; K955-F957 VanDerWaalsContact O-CE2 3.3Å; K955-F957 WeakPolarHBondContact O-CE2 3.44Å
956	P	91.6	Very high	90.9	Very high	16 Å²	16	26.1 Å²	26.1	10%	0.104	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.8	-179.7	28.6	-35.6	0	0	0	112	M454 V866 T867	M454-P956 HydrophobicContact CE-CB 4.28Å; M454-P956 HydrophobicContact SD-CB 3.59Å; M454-P956 VanDerWaalsContact SD-CB 3.59Å; V866-P956 HydrophobicContact CG1-CB 4.22Å; V866-P956 WeakPolarHBondContact CG1-O 3.45Å; V866-P956 HydrophobicContact CG2-CB 4.28Å; V866-P956 HydrophobicContact CG2-CG 4.36Å; T867-P956 PolarHBondContact N-O 3.24Å; T867-P956 PolarHBondContact OG1-O 2.88Å; T867-P956 VanDerWaalsContact OG1-O 3.06Å
957	F	92.9	Very high	90.8	Very high	13 Å²	13	26.1 Å²	26.1	6%	0.057	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.9	180	-63.9	-71.7	0	0	0	111.9	T867 L868 H869 P870 M951 T953 K955	T867-F957 CarbonylContact O-C 3.59Å; T867-F957 VanDerWaalsContact O-CA 3.23Å; T867-F957 WeakPolarHBondContact O-CA 3.45Å; T867-F957 VanDerWaalsContact OG1-CD1 3.24Å; T867-F957 WeakPolarHBondContact OG1-CD1 3.46Å; T867-F957 WeakPolarHBondContact OG1-CE1 3.37Å; L868-F957 WeakPolarHBondContact O-CD1 3.41Å; H869-F957 HydrophobicContact CB-CB 4.35Å; P870-F957 HydrophobicContact CG-CE1 4.35Å; M951-F957 PolarHBondContact N-O 2.94Å; M951-F957 WeakPolarHBondContact O-CB 3.5Å; M951-F957 PolarHBondContact O-N 3.24Å; T953-F957 WeakPolarHBondContact OG1-CE2 3.49Å; K955-F957 HydrophobicContact CD-CE1 4.21Å; K955-F957 HydrophobicContact CD-CZ 4.06Å; K955-F957 HydrophobicContact CG-CD2 4.49Å; K955-F957 HydrophobicContact CG-CE1 3.86Å; K955-F957 HydrophobicContact CG-CE2 3.78Å; K955-F957 HydrophobicContact CG-CZ 3.45Å; K955-F957 VanDerWaalsContact CG-CZ 3.45Å; K955-F957 WeakPolarHBondContact O-CD2 3.48Å; K955-F957 VanDerWaalsContact O-CE2 3.3Å; K955-F957 WeakPolarHBondContact O-CE2 3.44Å
958	L	93.2	Very high	90.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134.6	162.9	-59.9	172.5	0	0	0	109.3	A833 F858 T860 V866 T867 L868 H869 L945 Y947 L950 T961	A833-L958 HydrophobicContact CB-CD1 3.78Å; A833-L958 HydrophobicContact CB-CD2 4.18Å; F858-L958 HydrophobicContact CB-CD1 3.92Å; F858-L958 HydrophobicContact CD2-CD1 4.32Å; F858-L958 HydrophobicContact CG-CD1 4.01Å; T860-L958 HydrophobicContact CG2-CD2 4.3Å; V866-L958 HydrophobicContact CG1-CD2 3.9Å; V866-L958 HydrophobicContact CG1-CG 3.7Å; T867-L958 PolarHBondContact O-N 3.45Å; L868-L958 HydrophobicContact CD2-CB 4.31Å; L868-L958 HydrophobicContact CD2-CD1 4.14Å; H869-L958 WeakPolarHBondContact CB-O 3.39Å; H869-L958 PolarHBondContact N-O 3.19Å; L945-L958 HydrophobicContact CD1-CD1 4.43Å; Y947-L958 HydrophobicContact CD1-CD2 3.6Å; Y947-L958 HydrophobicContact CD2-CD2 4.06Å; Y947-L958 HydrophobicContact CE1-CD2 3.99Å; Y947-L958 HydrophobicContact CE2-CD2 4.43Å; Y947-L958 HydrophobicContact CG-CD2 3.63Å; L950-L958 HydrophobicContact CD1-CD2 3.75Å; L958-T961 HydrophobicContact CB-CG2 3.58Å
959	V	90.4	Very high	90.9	Very high	31 Å²	31	25.4 Å²	25.4	19%	0.188	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141.5	-178.1	-174.9	0	0	0	0	110.5	L948 D949 M951	L948-V959 PolarHBondContact N-O 3.5Å; L948-V959 VanDerWaalsContact N-O 3.15Å; D949-V959 HydrophobicContact CB-CB 4.47Å; D949-V959 PolarHBondContact O-N 2.97Å; M951-V959 HydrophobicContact CB-CG2 4.07Å
960	N	90.1	Very high	91.1	Very high	33 Å²	33	24.2 Å²	24.2	18%	0.176	13%	0.132	C	C	.	.	S	Bend	trans	54.4	60	-175.7	-68	-29.6	0	0	0	111.6	L948	L948-N960 HydrophobicContact CB-CB 3.85Å; L948-N960 HydrophobicContact CD2-CB 4.47Å
961	T	93.9	Very high	91.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.132	C	C	.	.			trans	-83.9	149	-176.3	70.1	0	0	0	0	112.5	G629 D630 L868 D872 F874 M946 L958	G629-T961 WeakPolarHBondContact CA-O 3.4Å; D630-T961 PolarHBondContact N-O 3.33Å; L868-T961 HydrophobicContact CD2-CG2 3.88Å; D872-T961 PolarHBondContact OD1-OG1 3Å; D872-T961 WeakPolarHBondContact OD2-CB 3.43Å; D872-T961 WeakPolarHBondContact OD2-CG2 3.3Å; D872-T961 PolarHBondContact OD2-OG1 2.71Å; F874-T961 WeakPolarHBondContact CD2-OG1 3.47Å; F874-T961 WeakPolarHBondContact CE2-OG1 3.25Å; M946-T961 CarbonylContact O-C 3.59Å; M946-T961 VanDerWaalsContact O-CA 3.26Å; M946-T961 WeakPolarHBondContact O-CA 3.43Å; L958-T961 HydrophobicContact CB-CG2 3.58Å
962	I	94.5	Very high	91.3	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.1	177.7	-59.4	175.9	0	0	0	108.2	H628 A631 F632 L824 M828 L945 M946 V964	H628-I962 WeakPolarHBondContact O-CA 3.21Å; A631-I962 HydrophobicContact CB-CD1 4.17Å; A631-I962 HydrophobicContact CB-CG1 4.28Å; F632-I962 HydrophobicContact CE2-CD1 4.4Å; F632-I962 HydrophobicContact CE2-CG1 4.49Å; F632-I962 HydrophobicContact CE2-CG2 3.82Å; L824-I962 HydrophobicContact CB-CD1 4.19Å; L824-I962 HydrophobicContact CD1-CD1 3.69Å; L824-I962 HydrophobicContact CG-CD1 4.45Å; M828-I962 HydrophobicContact SD-CD1 3.89Å; L945-I962 WeakPolarHBondContact CA-O 3.47Å; M946-I962 PolarHBondContact N-O 2.95Å; M946-I962 PolarHBondContact O-N 3.35Å; I962-V964 HydrophobicContact CG2-CG1 4.21Å
963	R	93.8	Very high	91.3	Very high	36 Å²	36	22 Å²	22	14%	0.136	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.8	172.1	66.9	169	-177.7	144.9	0.8	111.6	D627 H628 K821 F874 L881 L944 L945	D627-R963 VanDerWaalsContact O-CD 3.26Å; D627-R963 WeakPolarHBondContact O-CD 3.36Å; D627-R963 PolarHBondContact O-NE 3.14Å; D627-R963 IonicContact OD1-CZ 3.68Å; D627-R963 IonicContact OD1-NE 3.82Å; D627-R963 IonicContact OD1-NH2 3.05Å; D627-R963 PolarHBondContact OD1-NH2 2.82Å; D627-R963 IonicContact OD2-CZ 3.09Å; D627-R963 IonicContact OD2-NH2 3.38Å; D627-R963 PolarHBondContact OD2-NH2 3.31Å; H628-R963 PolarHBondContact ND1-NH2 3.08Å; H628-R963 PolarHBondContact O-N 2.95Å; K821-R963 WeakPolarHBondContact CD-O 3.34Å; K821-R963 WeakPolarHBondContact CE-O 3.35Å; F874-R963 HydrophobicContact CE1-CB 4.22Å; F874-R963 HydrophobicContact CE1-CG 4.21Å; F874-R963 HydrophobicContact CZ-CB 3.8Å; F874-R963 HydrophobicContact CZ-CG 3.99Å; L881-R963 HydrophobicContact CD2-CB 4.2Å; L944-R963 WeakPolarHBondContact O-CA 3.44Å; L945-R963 HydrophobicContact CD2-CB 4.12Å
964	V	93.3	Very high	91.7	Very high	1 Å²	1	19 Å²	19	1%	0.006	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.4	179.4	-62.1	0	0	0	0	110.9	K821 A825 Q943 L944 M946 I962 A966 T969	K821-V964 HydrophobicContact CB-CG1 4.36Å; A825-V964 HydrophobicContact CB-CG1 4.42Å; Q943-V964 PolarHBondContact OE1-O 2.87Å; L944-V964 HydrophobicContact CB-CG2 4.21Å; L944-V964 PolarHBondContact N-O 2.98Å; L944-V964 PolarHBondContact O-N 2.83Å; M946-V964 HydrophobicContact CG-CB 4.43Å; M946-V964 HydrophobicContact CG-CG1 3.9Å; M946-V964 HydrophobicContact CG-CG2 3.62Å; I962-V964 HydrophobicContact CG2-CG1 4.21Å; V964-A966 PolarHBondContact O-N 3.09Å; V964-T969 HydrophobicContact CG2-CG2 4.07Å
965	P	92	Very high	91.9	Very high	24 Å²	24	17.4 Å²	17.4	16%	0.156	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	129.4	175.4	27.8	-34.5	0	0	0	109.7	P968 T969 L1083	P965-P968 HydrophobicContact CB-CG 4.12Å; P965-P968 HydrophobicContact CG-CG 4.33Å; P965-T969 VanDerWaalsContact O-CB 3.22Å; P965-T969 WeakPolarHBondContact O-CB 3.46Å; P965-T969 PolarHBondContact O-N 2.89Å; P965-T969 PolarHBondContact O-OG1 3.24Å; P965-L1083 HydrophobicContact CG-CD2 4.36Å
966	A	92.7	Very high	91.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.1	-66.5	-165.3	0	0	0	0	0	113.2	H942 L944 V964 T969 L970 Y1091 I1093	H942-A966 HydrophobicContact CB-CB 3.99Å; H942-A966 WeakPolarHBondContact O-CB 3.48Å; H942-A966 PolarHBondContact O-N 3Å; L944-A966 HydrophobicContact CD1-CB 3.74Å; L944-A966 HydrophobicContact CD2-CB 4.47Å; L944-A966 HydrophobicContact CG-CB 3.58Å; V964-A966 PolarHBondContact O-N 3.09Å; A966-T969 PolarHBondContact O-N 2.76Å; A966-L970 VanDerWaalsContact O-CG 3.28Å; A966-L970 WeakPolarHBondContact O-CG 3.25Å; A966-L970 PolarHBondContact O-N 2.95Å; A966-Y1091 HydrophobicContact CB-CE2 4.33Å; A966-I1093 HydrophobicContact CB-CD1 3.34Å
967	L	93	Very high	91.9	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-60.3	-46.4	-173.2	177	58.7	0	0	0	113.8	T969 L970 L971 F988 V994 L996 P1087 Y1091	L967-T969 VanDerWaalsContact C-N 3.32Å; L967-T969 PolarHBondContact O-N 3.39Å; L967-L970 PolarHBondContact O-N 3.25Å; L967-L971 HydrophobicContact CD1-CD1 3.72Å; L967-L971 HydrophobicContact CD1-CG 3.86Å; L967-L971 HydrophobicContact CG-CD1 3.91Å; L967-L971 HydrophobicContact CG-CG 4.48Å; L967-L971 WeakPolarHBondContact O-CB 3.45Å; L967-L971 WeakPolarHBondContact O-CG 3.26Å; L967-L971 PolarHBondContact O-N 3.24Å; L967-F988 HydrophobicContact CD1-CE2 4.27Å; L967-F988 HydrophobicContact CD1-CZ 4.07Å; L967-V994 HydrophobicContact CD1-CG1 4.26Å; L967-L996 HydrophobicContact CD2-CD2 3.57Å; L967-P1087 WeakPolarHBondContact CD2-O 2.94Å; L967-Y1091 HydrophobicContact CB-CD1 4.27Å; L967-Y1091 HydrophobicContact CB-CD2 4.42Å; L967-Y1091 HydrophobicContact CB-CE1 3.74Å; L967-Y1091 HydrophobicContact CB-CE2 3.87Å; L967-Y1091 VanDerWaalsContact CB-CZ 3.5Å; L967-Y1091 HydrophobicContact CD2-CD1 3.63Å; L967-Y1091 HydrophobicContact CD2-CE1 3.81Å; L967-Y1091 HydrophobicContact CD2-CG 4.08Å; L967-Y1091 HydrophobicContact CG-CE1 4.46Å; L967-Y1091 PolarHBondContact N-OH 3.17Å
968	P	92.8	Very high	91.9	Very high	6 Å²	6	17 Å²	17	4%	0.039	8%	0.08	C	C	.	.	H	α-helix	trans	-59.7	-41.4	176.4	-20.6	29.8	0	0	0	112.8	P965 L972 F1082 L1083 P1087	P965-P968 HydrophobicContact CB-CG 4.12Å; P965-P968 HydrophobicContact CG-CG 4.33Å; P968-L972 WeakPolarHBondContact O-CB 3.41Å; P968-L972 WeakPolarHBondContact O-CG 3.34Å; P968-L972 PolarHBondContact O-N 2.85Å; P968-F1082 HydrophobicContact CB-CD1 4.44Å; P968-F1082 HydrophobicContact CB-CE1 3.92Å; P968-L1083 HydrophobicContact CB-CD2 3.64Å; P968-L1083 HydrophobicContact CG-CD2 4.32Å; P968-P1087 HydrophobicContact CB-CG 4.27Å; P968-P1087 HydrophobicContact CG-CG 3.71Å
969	T	92.5	Very high	91.8	Very high	3 Å²	3	17 Å²	17	2%	0.018	8%	0.08	C	C	.	.	H	α-helix	trans	-66.2	-42.9	-179.8	-57.1	0	0	0	0	111.3	A825 M946 V964 P965 A966 L967 L972 Y973	A825-T969 HydrophobicContact CB-CG2 3.89Å; M946-T969 HydrophobicContact SD-CG2 4.36Å; V964-T969 HydrophobicContact CG2-CG2 4.07Å; P965-T969 VanDerWaalsContact O-CB 3.22Å; P965-T969 WeakPolarHBondContact O-CB 3.46Å; P965-T969 PolarHBondContact O-N 2.89Å; P965-T969 PolarHBondContact O-OG1 3.24Å; A966-T969 PolarHBondContact O-N 2.76Å; L967-T969 VanDerWaalsContact C-N 3.32Å; L967-T969 PolarHBondContact O-N 3.39Å; T969-L972 PolarHBondContact O-N 2.82Å; T969-Y973 HydrophobicContact CG2-CD2 4.11Å; T969-Y973 PolarHBondContact O-N 2.85Å; T969-Y973 VanDerWaalsContact O-N 3.09Å
970	L	93.6	Very high	91.7	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-62.3	-49.6	177.5	-68.9	172.4	0	0	0	111.1	L832 L944 A966 L967 L972 Y973 C974 F988 L992 V994 I1093	L832-L970 HydrophobicContact CD2-CD2 3.57Å; L944-L970 HydrophobicContact CD1-CD1 4.05Å; L944-L970 HydrophobicContact CD1-CD2 4.11Å; L944-L970 HydrophobicContact CD1-CG 4.02Å; A966-L970 VanDerWaalsContact O-CG 3.28Å; A966-L970 WeakPolarHBondContact O-CG 3.25Å; A966-L970 PolarHBondContact O-N 2.95Å; L967-L970 PolarHBondContact O-N 3.25Å; L970-L972 VanDerWaalsContact C-N 3.33Å; L970-L972 PolarHBondContact O-N 2.72Å; L970-Y973 PolarHBondContact O-N 3.18Å; L970-C974 VanDerWaalsContact CD2-SG 3.51Å; L970-C974 WeakPolarHBondContact O-CB 3.26Å; L970-C974 PolarHBondContact O-N 3.49Å; L970-C974 PolarHBondContact O-SG 3.39Å; L970-C974 VanDerWaalsContact O-SG 3.33Å; L970-F988 HydrophobicContact CB-CD1 3.86Å; L970-F988 HydrophobicContact CB-CD2 4.03Å; L970-F988 HydrophobicContact CB-CE1 3.85Å; L970-F988 HydrophobicContact CB-CE2 4.02Å; L970-F988 HydrophobicContact CB-CG 3.94Å; L970-F988 HydrophobicContact CB-CZ 3.92Å; L970-F988 HydrophobicContact CD1-CD2 3.84Å; L970-F988 HydrophobicContact CD1-CE2 4.09Å; L970-F988 HydrophobicContact CD1-CG 4.34Å; L970-F988 HydrophobicContact CD2-CB 4.32Å; L970-F988 HydrophobicContact CD2-CG 4.42Å; L970-F988 HydrophobicContact CG-CD2 4.41Å; L970-F988 HydrophobicContact CG-CG 4.46Å; L970-L992 HydrophobicContact CD1-CD1 4.29Å; L970-L992 HydrophobicContact CD2-CD1 3.68Å; L970-V994 HydrophobicContact CD1-CG2 4.02Å; L970-I1093 HydrophobicContact CD1-CD1 4.28Å
971	L	93.1	Very high	91.3	Very high	5 Å²	5	15.1 Å²	15.1	3%	0.026	7%	0.07	C	C	.	.	H	α-helix	trans	-57.8	-43.9	177.8	-76.4	171.3	0	0	0	112.5	L967 F988 A1005 V1006 T1009 R1013 F1082	L967-L971 HydrophobicContact CD1-CD1 3.72Å; L967-L971 HydrophobicContact CD1-CG 3.86Å; L967-L971 HydrophobicContact CG-CD1 3.91Å; L967-L971 HydrophobicContact CG-CG 4.48Å; L967-L971 WeakPolarHBondContact O-CB 3.45Å; L967-L971 WeakPolarHBondContact O-CG 3.26Å; L967-L971 PolarHBondContact O-N 3.24Å; L971-F988 HydrophobicContact CD2-CE1 3.95Å; L971-F988 HydrophobicContact CD2-CZ 3.84Å; L971-F988 HydrophobicContact CG-CE1 4.26Å; L971-F988 HydrophobicContact CG-CZ 4.04Å; L971-A1005 HydrophobicContact CD1-CB 4.24Å; L971-V1006 HydrophobicContact CD2-CG2 4.09Å; L971-T1009 HydrophobicContact CB-CG2 3.78Å; L971-T1009 WeakPolarHBondContact O-CG2 3.32Å; L971-R1013 PolarHBondContact O-NE 3.34Å; L971-F1082 HydrophobicContact CD1-CZ 4.07Å
972	L	91.8	Very high	90.8	Very high	13 Å²	13	17.9 Å²	17.9	7%	0.068	9%	0.085	C	C	.	.	H	α-helix	trans	-72.6	-32.1	-177	-71.3	172.3	0	0	0	113.7	V822 P968 T969 L970 L1012 R1013 L1079 F1082	V822-L972 HydrophobicContact CG1-CD1 4.17Å; V822-L972 HydrophobicContact CG2-CD1 4.17Å; P968-L972 WeakPolarHBondContact O-CB 3.41Å; P968-L972 WeakPolarHBondContact O-CG 3.34Å; P968-L972 PolarHBondContact O-N 2.85Å; T969-L972 PolarHBondContact O-N 2.82Å; L970-L972 VanDerWaalsContact C-N 3.33Å; L970-L972 PolarHBondContact O-N 2.72Å; L972-L1012 HydrophobicContact CD2-CB 4.14Å; L972-L1012 HydrophobicContact CD2-CD1 4.14Å; L972-R1013 VanDerWaalsContact O-CZ 3.24Å; L972-R1013 PolarHBondContact O-NE 2.93Å; L972-R1013 PolarHBondContact O-NH2 2.96Å; L972-L1079 HydrophobicContact CD1-CD2 3.99Å; L972-L1079 HydrophobicContact CD2-CD2 4.04Å; L972-F1082 HydrophobicContact CG-CE1 4.36Å
973	Y	90.9	Very high	90.5	Very high	29 Å²	29	17.9 Å²	17.9	11%	0.114	9%	0.085	C	C	.	.	H	α-helix	trans	-121.6	-19.9	-167.7	-63.5	-57.7	0	0	0	116.5	M580 V822 A825 Y829 T969 L970 R1013	M580-Y973 HydrophobicContact CE-CE1 4.32Å; V822-Y973 HydrophobicContact CG1-CE2 4.17Å; V822-Y973 WeakPolarHBondContact CG1-OH 3.36Å; V822-Y973 WeakPolarHBondContact O-CE2 3.42Å; V822-Y973 PolarHBondContact O-OH 3.34Å; A825-Y973 HydrophobicContact CB-CD2 4.12Å; A825-Y973 HydrophobicContact CB-CE2 3.84Å; Y829-Y973 WeakPolarHBondContact CE1-O 3.35Å; Y829-Y973 VanDerWaalsContact CZ-O 3.29Å; T969-Y973 HydrophobicContact CG2-CD2 4.11Å; T969-Y973 PolarHBondContact O-N 2.85Å; T969-Y973 VanDerWaalsContact O-N 3.09Å; L970-Y973 PolarHBondContact O-N 3.18Å; Y973-R1013 PolarHBondContact O-NH2 3.47Å
974	C	90.7	Very high	90.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.			trans	-62.5	140.9	178.7	-73	0	0	0	0	113.2	Y829 L970 V977 F988 D989 R1013	Y829-C974 WeakPolarHBondContact OH-CA 3.39Å; L970-C974 VanDerWaalsContact CD2-SG 3.51Å; L970-C974 WeakPolarHBondContact O-CB 3.26Å; L970-C974 PolarHBondContact O-N 3.49Å; L970-C974 PolarHBondContact O-SG 3.39Å; L970-C974 VanDerWaalsContact O-SG 3.33Å; C974-V977 HydrophobicContact CB-CG2 4.4Å; C974-F988 HydrophobicContact CB-CB 4.17Å; C974-F988 HydrophobicContact CB-CD1 3.67Å; C974-F988 HydrophobicContact CB-CG 4.37Å; C974-D989 PolarHBondContact SG-OD2 3.48Å; C974-R1013 VanDerWaalsContact O-CZ 3.26Å; C974-R1013 PolarHBondContact O-NH1 3.24Å; C974-R1013 PolarHBondContact O-NH2 3.45Å
975	R	85.2	Confident	90.1	Very high	92 Å²	92	19.5 Å²	19.5	35%	0.347	10%	0.096	S	C	.	.	S	Bend	trans	-86.1	-28.2	-176.1	-62.8	-168.6	-169.4	125.9	23.3	113.5	S545 Y829 D989 Y1162	S545-R975 VanDerWaalsContact CA-NH2 3.27Å; S545-R975 PolarHBondContact O-NE 2.57Å; S545-R975 PolarHBondContact O-NH2 3.46Å; S545-R975 PolarHBondContact OG-NH2 2.93Å; Y829-R975 HydrophobicContact CE1-CG 4.15Å; Y829-R975 PolarHBondContact OH-N 3.33Å; R975-D989 PolarHBondContact N-OD1 3.2Å; R975-Y1162 VanDerWaalsContact O-CA 3.22Å; R975-Y1162 WeakPolarHBondContact O-CA 3.38Å; R975-Y1162 WeakPolarHBondContact O-CB 3.39Å
976	E	88	Confident	90.1	Very high	77 Å²	77	18.4 Å²	18.4	36%	0.36	9%	0.089	S	C	.	.			trans	-123.4	124.5	174.3	-61.4	176.5	-176.6	0	0	107.5	F988 D989 S990 K1154 Y1162	E976-F988 CarbonylContact O-C 3.56Å; E976-F988 WeakPolarHBondContact O-CA 3.22Å; E976-D989 PolarHBondContact N-OD1 3.36Å; E976-D989 VanDerWaalsContact N-OD1 3.1Å; E976-D989 PolarHBondContact O-N 2.84Å; E976-S990 PolarHBondContact OE2-OG 3.22Å; E976-K1154 IonicContact OE2-NZ 3.02Å; E976-K1154 PolarHBondContact OE2-NZ 3.08Å; E976-Y1162 CarbonylContact C-O 3.48Å; E976-Y1162 WeakPolarHBondContact CA-O 3.31Å
977	V	92	Very high	90.2	Very high	4 Å²	4	18.4 Å²	18.4	2%	0.024	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	102.5	174.7	-174.4	0	0	0	0	105.4	C974 T979 I986 F988 Y1162 L1163 N1164	C974-V977 HydrophobicContact CB-CG2 4.4Å; V977-T979 HydrophobicContact CG1-CG2 4.38Å; V977-I986 HydrophobicContact CG1-CG2 3.57Å; V977-F988 HydrophobicContact CG1-CD1 4.32Å; V977-F988 HydrophobicContact CG1-CE1 3.92Å; V977-F988 HydrophobicContact CG2-CD1 3.93Å; V977-F988 HydrophobicContact CG2-CE1 3.96Å; V977-Y1162 HydrophobicContact CG2-CD2 4.21Å; V977-Y1162 PolarHBondContact N-O 2.83Å; V977-L1163 HydrophobicContact CB-CD1 3.95Å; V977-L1163 HydrophobicContact CG1-CD1 3.76Å; V977-L1163 WeakPolarHBondContact O-CA 3.26Å; V977-N1164 PolarHBondContact O-N 3.4Å
978	D	91.6	Very high	90.2	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.9	179.3	-58.3	-55.9	0	0	0	108	I986 V987 F1105 K1154 N1164 S1167 L1168	D978-I986 CarbonylContact O-C 3.6Å; D978-I986 WeakPolarHBondContact O-CA 3.47Å; D978-V987 HydrophobicContact CB-CB 4.43Å; D978-V987 PolarHBondContact N-O 3.35Å; D978-V987 PolarHBondContact O-N 2.95Å; D978-F1105 HydrophobicContact CB-CE1 4.06Å; D978-K1154 VanDerWaalsContact CG-NZ 3.3Å; D978-K1154 WeakPolarHBondContact OD1-CD 3.46Å; D978-K1154 IonicContact OD1-NZ 3.53Å; D978-K1154 PolarHBondContact OD1-NZ 2.72Å; D978-K1154 VanDerWaalsContact OD1-NZ 3.11Å; D978-K1154 IonicContact OD2-NZ 2.77Å; D978-K1154 PolarHBondContact OD2-NZ 3.25Å; D978-N1164 PolarHBondContact OD1-ND2 3.32Å; D978-S1167 WeakPolarHBondContact CB-OG 3.4Å; D978-L1168 HydrophobicContact CB-CD2 4.01Å; D978-L1168 HydrophobicContact CB-CG 4.26Å; D978-L1168 WeakPolarHBondContact O-CD1 3.35Å
979	T	91.8	Very high	90	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	162.4	-179.6	79.8	0	0	0	0	111.9	V977 I983 R985 I986 L1163 N1164 I1165 D1166 S1167 L1168	V977-T979 HydrophobicContact CG1-CG2 4.38Å; T979-I983 HydrophobicContact CG2-CG1 4.42Å; T979-I983 HydrophobicContact CG2-CG2 4.33Å; T979-R985 WeakPolarHBondContact CA-O 3.36Å; T979-I986 HydrophobicContact CG2-CG1 4.14Å; T979-I986 HydrophobicContact CG2-CG2 4.26Å; T979-L1163 HydrophobicContact CG2-CD1 4.11Å; T979-N1164 PolarHBondContact N-O 3.36Å; T979-I1165 WeakPolarHBondContact OG1-CA 3.45Å; T979-D1166 WeakPolarHBondContact O-CA 3.22Å; T979-D1166 PolarHBondContact O-N 2.85Å; T979-S1167 PolarHBondContact O-N 2.66Å; T979-S1167 VanDerWaalsContact O-N 3.07Å; T979-L1168 PolarHBondContact O-N 2.85Å
980	N	88.3	Confident	89.8	Confident	13 Å²	13	19.9 Å²	19.9	7%	0.07	10%	0.098	C	C	.	.			trans	-79.4	-178	158.8	63.9	-18.1	0	0	0	110.7	D982 I983 S984 R985 L1168	N980-D982 PolarHBondContact ND2-OD1 3.43Å; N980-D982 PolarHBondContact O-N 2.85Å; N980-D982 PolarHBondContact OD1-OD1 3.02Å; N980-I983 VanDerWaalsContact OD1-CA 3.3Å; N980-I983 WeakPolarHBondContact OD1-CA 3.16Å; N980-I983 PolarHBondContact OD1-N 3.1Å; N980-I983 VanDerWaalsContact OD1-N 3.12Å; N980-S984 PolarHBondContact ND2-OG 2.71Å; N980-S984 PolarHBondContact OD1-N 3.47Å; N980-S984 VanDerWaalsContact OD1-N 3.17Å; N980-R985 HydrophobicContact CB-CB 4.38Å; N980-R985 PolarHBondContact N-O 3.17Å; N980-R985 VanDerWaalsContact N-O 3.17Å; N980-R985 PolarHBondContact OD1-N 2.98Å; N980-R985 PolarHBondContact OD1-O 3.29Å; N980-R985 VanDerWaalsContact OD1-O 3.1Å; N980-L1168 HydrophobicContact CB-CB 4.36Å
981	A	82	Confident	89.6	Confident	12 Å²	12	20.7 Å²	20.7	10%	0.099	10%	0.101	C	C	.	.	S	Bend	trans	-58.2	-40.4	-174.7	0	0	0	0	0	114.9	D1166 Y1190 L1198	A981-D1166 WeakPolarHBondContact CB-OD1 3.47Å; A981-D1166 PolarHBondContact N-OD1 2.85Å; A981-Y1190 HydrophobicContact CB-CE2 3.61Å; A981-L1198 VanDerWaalsContact O-CD2 3.31Å; A981-L1198 WeakPolarHBondContact O-CD2 3.34Å
982	D	83.8	Confident	89.6	Confident	58 Å²	58	20.5 Å²	20.5	31%	0.31	10%	0.1	S	C	.	.	S	Bend	trans	-98.6	-12.9	-173.6	64.7	-13.3	0	0	0	113.3	N980 S984 V999 Q1003	N980-D982 PolarHBondContact ND2-OD1 3.43Å; N980-D982 PolarHBondContact O-N 2.85Å; N980-D982 PolarHBondContact OD1-OD1 3.02Å; D982-S984 VanDerWaalsContact C-N 3.35Å; D982-S984 PolarHBondContact OD1-N 2.57Å; D982-S984 PolarHBondContact OD1-OG 3.43Å; D982-S984 WeakPolarHBondContact OD2-CB 3.16Å; D982-S984 PolarHBondContact OD2-OG 3.39Å; D982-V999 HydrophobicContact CB-CG1 3.92Å; D982-V999 VanDerWaalsContact O-CG1 3.25Å; D982-V999 WeakPolarHBondContact O-CG1 3.36Å; D982-Q1003 PolarHBondContact O-NE2 3.49Å; D982-Q1003 VanDerWaalsContact O-NE2 3.15Å
983	I	87.7	Confident	89.7	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	76.3	15.4	-174.2	-48.1	-176.9	0	0	0	112.8	T979 N980 R985 I986 A1002 Q1003 V1006 L1198 L1202	T979-I983 HydrophobicContact CG2-CG1 4.42Å; T979-I983 HydrophobicContact CG2-CG2 4.33Å; N980-I983 VanDerWaalsContact OD1-CA 3.3Å; N980-I983 WeakPolarHBondContact OD1-CA 3.16Å; N980-I983 PolarHBondContact OD1-N 3.1Å; N980-I983 VanDerWaalsContact OD1-N 3.12Å; I983-R985 PolarHBondContact O-N 2.97Å; I983-I986 HydrophobicContact CG2-CD1 3.63Å; I983-I986 HydrophobicContact CG2-CG1 3.87Å; I983-A1002 HydrophobicContact CB-CB 4.48Å; I983-A1002 HydrophobicContact CG2-CB 4.06Å; I983-Q1003 HydrophobicContact CB-CG 4.37Å; I983-Q1003 HydrophobicContact CD1-CG 4.14Å; I983-Q1003 HydrophobicContact CG1-CG 4.43Å; I983-V1006 HydrophobicContact CD1-CB 4.34Å; I983-V1006 HydrophobicContact CD1-CG1 4.34Å; I983-V1006 HydrophobicContact CD1-CG2 4.36Å; I983-V1006 HydrophobicContact CG2-CG2 3.78Å; I983-L1198 HydrophobicContact CD1-CD2 3.8Å; I983-L1198 HydrophobicContact CG1-CD2 3.9Å; I983-L1202 HydrophobicContact CD1-CD1 4.34Å
984	S	87.2	Confident	89.8	Confident	31 Å²	31	18.6 Å²	18.6	22%	0.217	9%	0.092	C	C	.	.	S	Bend	trans	-66.8	-21.6	170.1	56.2	0	0	0	0	112.8	N980 D982 R995 L996	N980-S984 PolarHBondContact ND2-OG 2.71Å; N980-S984 PolarHBondContact OD1-N 3.47Å; N980-S984 VanDerWaalsContact OD1-N 3.17Å; D982-S984 VanDerWaalsContact C-N 3.35Å; D982-S984 PolarHBondContact OD1-N 2.57Å; D982-S984 PolarHBondContact OD1-OG 3.43Å; D982-S984 WeakPolarHBondContact OD2-CB 3.16Å; D982-S984 PolarHBondContact OD2-OG 3.39Å; S984-R995 WeakPolarHBondContact O-CA 3.27Å; S984-L996 PolarHBondContact O-N 3.31Å
985	R	90.5	Very high	89.8	Confident	40 Å²	40	21.7 Å²	21.7	15%	0.151	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.3	178.7	-170.7	-175.4	-171.4	-168.2	3.5	110.7	T979 N980 I983 E993 L1168 Y1169	T979-R985 WeakPolarHBondContact CA-O 3.36Å; N980-R985 HydrophobicContact CB-CB 4.38Å; N980-R985 PolarHBondContact N-O 3.17Å; N980-R985 VanDerWaalsContact N-O 3.17Å; N980-R985 PolarHBondContact OD1-N 2.98Å; N980-R985 PolarHBondContact OD1-O 3.29Å; N980-R985 VanDerWaalsContact OD1-O 3.1Å; I983-R985 PolarHBondContact O-N 2.97Å; R985-E993 HydrophobicContact CG-CG 4.49Å; R985-E993 IonicContact CZ-OE1 2.89Å; R985-E993 IonicContact NE-OE1 2.66Å; R985-E993 PolarHBondContact NE-OE1 2.86Å; R985-E993 IonicContact NH2-OE1 3.86Å; R985-E993 PolarHBondContact NH2-OE1 3.46Å; R985-L1168 HydrophobicContact CG-CD1 4.27Å; R985-Y1169 PolarHBondContact NH1-O 3.36Å
986	I	93.7	Very high	90.1	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.2	178.7	-50.8	179.4	0	0	0	109.6	V977 D978 T979 I983 F988 V994 L996 V1006	V977-I986 HydrophobicContact CG1-CG2 3.57Å; D978-I986 CarbonylContact O-C 3.6Å; D978-I986 WeakPolarHBondContact O-CA 3.47Å; T979-I986 HydrophobicContact CG2-CG1 4.14Å; T979-I986 HydrophobicContact CG2-CG2 4.26Å; I983-I986 HydrophobicContact CG2-CD1 3.63Å; I983-I986 HydrophobicContact CG2-CG1 3.87Å; I986-F988 HydrophobicContact CB-CE2 4.01Å; I986-F988 HydrophobicContact CB-CZ 4.25Å; I986-F988 HydrophobicContact CG2-CD1 4.39Å; I986-F988 HydrophobicContact CG2-CD2 4.07Å; I986-F988 HydrophobicContact CG2-CE1 3.91Å; I986-F988 HydrophobicContact CG2-CE2 3.53Å; I986-F988 HydrophobicContact CG2-CG 4.48Å; I986-F988 HydrophobicContact CG2-CZ 3.46Å; I986-F988 VanDerWaalsContact CG2-CZ 3.46Å; I986-V994 PolarHBondContact N-O 2.94Å; I986-V994 PolarHBondContact O-N 3.15Å; I986-L996 HydrophobicContact CD1-CD1 3.64Å; I986-L996 HydrophobicContact CG1-CD1 3.81Å; I986-V1006 HydrophobicContact CD1-CG2 4.17Å
987	V	93.4	Very high	90	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.2	173	175.5	0	0	0	0	109.7	D978 L992 E993 L1096 L1104 L1168	D978-V987 HydrophobicContact CB-CB 4.43Å; D978-V987 PolarHBondContact N-O 3.35Å; D978-V987 PolarHBondContact O-N 2.95Å; V987-L992 CarbonylContact C-O 3.59Å; V987-L992 WeakPolarHBondContact CA-O 3.36Å; V987-E993 HydrophobicContact CG2-CB 4.33Å; V987-E993 HydrophobicContact CG2-CG 4.42Å; V987-L1096 HydrophobicContact CB-CD1 4.47Å; V987-L1096 HydrophobicContact CG1-CD1 3.59Å; V987-L1096 HydrophobicContact CG2-CD1 4.03Å; V987-L1104 HydrophobicContact CB-CD2 4.42Å; V987-L1104 HydrophobicContact CG1-CD2 4.02Å; V987-L1104 HydrophobicContact CG2-CD1 4.3Å; V987-L1104 HydrophobicContact CG2-CD2 4.07Å; V987-L1168 HydrophobicContact CB-CD1 4.19Å; V987-L1168 HydrophobicContact CB-CD2 4.34Å; V987-L1168 HydrophobicContact CG2-CD1 3.73Å; V987-L1168 HydrophobicContact CG2-CD2 4.11Å
988	F	93.2	Very high	89.9	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.3	-178.7	-64.7	-80.8	0	0	0	111.1	L967 L970 L971 C974 E976 V977 I986 S990 W991 L992 V994	L967-F988 HydrophobicContact CD1-CE2 4.27Å; L967-F988 HydrophobicContact CD1-CZ 4.07Å; L970-F988 HydrophobicContact CB-CD1 3.86Å; L970-F988 HydrophobicContact CB-CD2 4.03Å; L970-F988 HydrophobicContact CB-CE1 3.85Å; L970-F988 HydrophobicContact CB-CE2 4.02Å; L970-F988 HydrophobicContact CB-CG 3.94Å; L970-F988 HydrophobicContact CB-CZ 3.92Å; L970-F988 HydrophobicContact CD1-CD2 3.84Å; L970-F988 HydrophobicContact CD1-CE2 4.09Å; L970-F988 HydrophobicContact CD1-CG 4.34Å; L970-F988 HydrophobicContact CD2-CB 4.32Å; L970-F988 HydrophobicContact CD2-CG 4.42Å; L970-F988 HydrophobicContact CG-CD2 4.41Å; L970-F988 HydrophobicContact CG-CG 4.46Å; L971-F988 HydrophobicContact CD2-CE1 3.95Å; L971-F988 HydrophobicContact CD2-CZ 3.84Å; L971-F988 HydrophobicContact CG-CE1 4.26Å; L971-F988 HydrophobicContact CG-CZ 4.04Å; C974-F988 HydrophobicContact CB-CB 4.17Å; C974-F988 HydrophobicContact CB-CD1 3.67Å; C974-F988 HydrophobicContact CB-CG 4.37Å; E976-F988 CarbonylContact O-C 3.56Å; E976-F988 WeakPolarHBondContact O-CA 3.22Å; V977-F988 HydrophobicContact CG1-CD1 4.32Å; V977-F988 HydrophobicContact CG1-CE1 3.92Å; V977-F988 HydrophobicContact CG2-CD1 3.93Å; V977-F988 HydrophobicContact CG2-CE1 3.96Å; I986-F988 HydrophobicContact CB-CE2 4.01Å; I986-F988 HydrophobicContact CB-CZ 4.25Å; I986-F988 HydrophobicContact CG2-CD1 4.39Å; I986-F988 HydrophobicContact CG2-CD2 4.07Å; I986-F988 HydrophobicContact CG2-CE1 3.91Å; I986-F988 HydrophobicContact CG2-CE2 3.53Å; I986-F988 HydrophobicContact CG2-CG 4.48Å; I986-F988 HydrophobicContact CG2-CZ 3.46Å; I986-F988 VanDerWaalsContact CG2-CZ 3.46Å; F988-S990 PolarHBondContact O-N 3.06Å; F988-W991 VanDerWaalsContact O-CD1 3.32Å; F988-W991 PolarHBondContact O-N 3.43Å; F988-L992 HydrophobicContact CB-CB 4.38Å; F988-L992 PolarHBondContact N-O 2.79Å; F988-L992 PolarHBondContact O-N 2.83Å; F988-V994 HydrophobicContact CD2-CB 4.49Å; F988-V994 HydrophobicContact CD2-CG2 3.76Å; F988-V994 HydrophobicContact CE2-CB 3.99Å; F988-V994 HydrophobicContact CE2-CG2 3.55Å
989	D	89.3	Confident	89.7	Confident	10 Å²	10	23.3 Å²	23.3	5%	0.053	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	47	30.1	178.4	-56.8	-45.7	0	0	0	114.2	Y829 K861 C974 R975 E976 W991	Y829-D989 PolarHBondContact OH-OD1 3.27Å; Y829-D989 VanDerWaalsContact OH-OD1 3.12Å; Y829-D989 PolarHBondContact OH-OD2 2.92Å; K861-D989 PolarHBondContact NZ-O 3.05Å; C974-D989 PolarHBondContact SG-OD2 3.48Å; R975-D989 PolarHBondContact N-OD1 3.2Å; E976-D989 PolarHBondContact N-OD1 3.36Å; E976-D989 VanDerWaalsContact N-OD1 3.1Å; E976-D989 PolarHBondContact O-N 2.84Å; D989-W991 PolarHBondContact O-N 3.14Å
990	S	87.3	Confident	89.5	Confident	30 Å²	30	30.1 Å²	30.1	21%	0.21	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	27.5	-176.7	-56.5	0	0	0	0	115.2	E976 F988 V1101	E976-S990 PolarHBondContact OE2-OG 3.22Å; F988-S990 PolarHBondContact O-N 3.06Å; S990-V1101 WeakPolarHBondContact O-CG2 3.42Å
991	W	90.5	Very high	89.5	Confident	19 Å²	19	30 Å²	30	7%	0.072	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-143.6	-19	179.3	81.9	-65.9	0	0	0	116.1	L832 I834 K861 F988 D989 R1095 L1096	L832-W991 HydrophobicContact CB-CZ2 4.31Å; L832-W991 HydrophobicContact CD2-CZ2 4.15Å; L832-W991 HydrophobicContact CG-CZ2 4.45Å; I834-W991 HydrophobicContact CG2-CH2 4.35Å; I834-W991 HydrophobicContact CG2-CZ3 4.02Å; K861-W991 HydrophobicContact CB-CD2 3.9Å; K861-W991 HydrophobicContact CB-CE3 4.26Å; K861-W991 HydrophobicContact CB-CG 4.2Å; K861-W991 HydrophobicContact CB-CZ2 4.45Å; K861-W991 HydrophobicContact CD-CG 4.22Å; K861-W991 HydrophobicContact CG-CB 4.4Å; K861-W991 HydrophobicContact CG-CD2 4.3Å; K861-W991 HydrophobicContact CG-CG 4.06Å; F988-W991 VanDerWaalsContact O-CD1 3.32Å; F988-W991 PolarHBondContact O-N 3.43Å; D989-W991 PolarHBondContact O-N 3.14Å; W991-R1095 HydrophobicContact CE3-CG 4.45Å; W991-L1096 PolarHBondContact O-N 3.19Å
992	L	93.1	Very high	89.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.2	174	-68.5	174.1	0	0	0	109.7	L832 I834 L944 L970 V987 F988 I1093	L832-L992 HydrophobicContact CD2-CD1 3.95Å; I834-L992 HydrophobicContact CB-CD2 4.39Å; I834-L992 HydrophobicContact CD1-CD2 3.85Å; I834-L992 HydrophobicContact CG2-CD2 4.18Å; L944-L992 HydrophobicContact CD1-CD1 4.49Å; L970-L992 HydrophobicContact CD1-CD1 4.29Å; L970-L992 HydrophobicContact CD2-CD1 3.68Å; V987-L992 CarbonylContact C-O 3.59Å; V987-L992 WeakPolarHBondContact CA-O 3.36Å; F988-L992 HydrophobicContact CB-CB 4.38Å; F988-L992 PolarHBondContact N-O 2.79Å; F988-L992 PolarHBondContact O-N 2.83Å; L992-I1093 HydrophobicContact CD2-CG2 4.4Å
993	E	93	Very high	90	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.009	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130	171.9	177.8	-176.1	-158.7	0	0	108.9	R985 V987 R995 I1093 K1094 L1096	R985-E993 HydrophobicContact CG-CG 4.49Å; R985-E993 IonicContact CZ-OE1 2.89Å; R985-E993 IonicContact NE-OE1 2.66Å; R985-E993 PolarHBondContact NE-OE1 2.86Å; R985-E993 IonicContact NH2-OE1 3.86Å; R985-E993 PolarHBondContact NH2-OE1 3.46Å; V987-E993 HydrophobicContact CG2-CB 4.33Å; V987-E993 HydrophobicContact CG2-CG 4.42Å; E993-R995 HydrophobicContact CG-CG 4.35Å; E993-R995 IonicContact OE1-CZ 3.26Å; E993-R995 IonicContact OE1-NE 3.57Å; E993-R995 PolarHBondContact OE1-NE 3.39Å; E993-R995 IonicContact OE1-NH2 3.11Å; E993-R995 PolarHBondContact OE1-NH2 3.45Å; E993-R995 IonicContact OE2-NH2 3.21Å; E993-I1093 WeakPolarHBondContact O-CA 3.35Å; E993-K1094 HydrophobicContact CB-CB 4.49Å; E993-K1094 PolarHBondContact N-O 2.77Å; E993-K1094 PolarHBondContact O-N 2.87Å; E993-L1096 HydrophobicContact CB-CD1 4.1Å; E993-L1096 HydrophobicContact CB-CD2 3.79Å; E993-L1096 HydrophobicContact CB-CG 3.85Å
994	V	93.4	Very high	90.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.9	172.3	-176.7	0	0	0	0	108.6	L967 L970 I986 F988 L996 Y1091 S1092 I1093	L967-V994 HydrophobicContact CD1-CG1 4.26Å; L970-V994 HydrophobicContact CD1-CG2 4.02Å; I986-V994 PolarHBondContact N-O 2.94Å; I986-V994 PolarHBondContact O-N 3.15Å; F988-V994 HydrophobicContact CD2-CB 4.49Å; F988-V994 HydrophobicContact CD2-CG2 3.76Å; F988-V994 HydrophobicContact CE2-CB 3.99Å; F988-V994 HydrophobicContact CE2-CG2 3.55Å; V994-L996 HydrophobicContact CG1-CD1 4.34Å; V994-L996 HydrophobicContact CG1-CG 4.33Å; V994-Y1091 HydrophobicContact CG1-CD2 3.7Å; V994-Y1091 HydrophobicContact CG1-CG 4.01Å; V994-S1092 VanDerWaalsContact CA-O 3.32Å; V994-S1092 WeakPolarHBondContact CA-O 3.16Å; V994-I1093 HydrophobicContact CG1-CG1 4.43Å; V994-I1093 HydrophobicContact CG2-CD1 4.09Å; V994-I1093 HydrophobicContact CG2-CG1 3.94Å
995	R	91.2	Very high	90.3	Very high	65 Å²	65	35 Å²	35	25%	0.245	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.4	176.3	-58.6	177.2	177.9	-151.9	-6.8	108.6	F938 S984 E993 Y1091 S1092 E1171	F938-R995 HydrophobicContact CE1-CB 4.25Å; F938-R995 WeakPolarHBondContact CE1-O 3.46Å; F938-R995 HydrophobicContact CZ-CB 4.18Å; S984-R995 WeakPolarHBondContact O-CA 3.27Å; E993-R995 HydrophobicContact CG-CG 4.35Å; E993-R995 IonicContact OE1-CZ 3.26Å; E993-R995 IonicContact OE1-NE 3.57Å; E993-R995 PolarHBondContact OE1-NE 3.39Å; E993-R995 IonicContact OE1-NH2 3.11Å; E993-R995 PolarHBondContact OE1-NH2 3.45Å; E993-R995 IonicContact OE2-NH2 3.21Å; R995-Y1091 CarbonylContact O-C 3.58Å; R995-Y1091 WeakPolarHBondContact O-CA 3.48Å; R995-Y1091 WeakPolarHBondContact O-CB 3.4Å; R995-S1092 PolarHBondContact N-O 3.47Å; R995-S1092 PolarHBondContact O-N 2.93Å; R995-E1171 IonicContact CZ-OE1 2.99Å; R995-E1171 IonicContact CZ-OE2 2.67Å; R995-E1171 IonicContact NH1-OE1 2.75Å; R995-E1171 PolarHBondContact NH1-OE1 3.15Å; R995-E1171 IonicContact NH1-OE2 2.57Å; R995-E1171 PolarHBondContact NH1-OE2 2.91Å; R995-E1171 VanDerWaalsContact NH1-OE2 3.09Å; R995-E1171 IonicContact NH2-OE1 3.96Å; R995-E1171 PolarHBondContact NH2-OE1 3.36Å; R995-E1171 IonicContact NH2-OE2 2.88Å
996	L	90.9	Very high	90.3	Very high	10 Å²	10	33.3 Å²	33.3	5%	0.052	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	138.3	-178.9	-55.9	106.4	0	0	0	109.4	L967 S984 I986 V994 A1002 G1088	L967-L996 HydrophobicContact CD2-CD2 3.57Å; S984-L996 PolarHBondContact O-N 3.31Å; I986-L996 HydrophobicContact CD1-CD1 3.64Å; I986-L996 HydrophobicContact CG1-CD1 3.81Å; V994-L996 HydrophobicContact CG1-CD1 4.34Å; V994-L996 HydrophobicContact CG1-CG 4.33Å; L996-A1002 HydrophobicContact CB-CB 4.14Å; L996-A1002 HydrophobicContact CD1-CB 4.15Å; L996-A1002 HydrophobicContact CD2-CB 3.99Å; L996-A1002 HydrophobicContact CG-CB 4.31Å; L996-G1088 VanDerWaalsContact CD2-O 3.3Å; L996-G1088 WeakPolarHBondContact CD2-O 3.44Å
997	L	87.2	Confident	90	Very high	86 Å²	86	34 Å²	34	45%	0.45	17%	0.165	S	C	.	.	S	Bend	trans	-79.8	-37.7	176.8	-66.5	171.9	0	0	0	111.9	L934 P935 F938 A1090	L934-L997 HydrophobicContact CD2-CD1 4.13Å; P935-L997 HydrophobicContact CG-CD1 4.24Å; P935-L997 HydrophobicContact CG-CD2 4.36Å; F938-L997 HydrophobicContact CB-CD1 4.34Å; F938-L997 HydrophobicContact CD1-CD1 3.66Å; F938-L997 HydrophobicContact CD1-CD2 4.03Å; F938-L997 HydrophobicContact CD1-CG 3.53Å; F938-L997 HydrophobicContact CE1-CD1 4.16Å; F938-L997 HydrophobicContact CE1-CD2 3.65Å; F938-L997 HydrophobicContact CE1-CG 3.54Å; F938-L997 HydrophobicContact CG-CD1 4.06Å; F938-L997 HydrophobicContact CG-CG 4.35Å; F938-L997 HydrophobicContact CZ-CD2 3.96Å; F938-L997 HydrophobicContact CZ-CG 4.34Å; L997-A1090 HydrophobicContact CD1-CB 4.02Å; L997-A1090 PolarHBondContact N-O 3.38Å; L997-A1090 VanDerWaalsContact N-O 3.12Å
998	D	88.3	Confident	89.9	Confident	67 Å²	67	36.6 Å²	36.6	36%	0.358	18%	0.182	S	C	.	.			trans	-97.5	101.9	-177.5	-178.3	-12.5	0	0	0	110.5	E1000 A1001 A1002	D998-E1000 VanDerWaalsContact C-N 3.34Å; D998-E1000 PolarHBondContact O-N 3.28Å; D998-E1000 PolarHBondContact OD1-N 3.24Å; D998-A1001 HydrophobicContact CB-CB 3.87Å; D998-A1001 PolarHBondContact O-N 3.47Å; D998-A1001 PolarHBondContact OD1-N 3.35Å; D998-A1001 WeakPolarHBondContact OD2-CB 3.39Å; D998-A1002 WeakPolarHBondContact O-CB 3.38Å; D998-A1002 PolarHBondContact O-N 2.89Å
999	V	87	Confident	89.8	Confident	44 Å²	44	36.8 Å²	36.8	27%	0.267	18%	0.183	S	C	.	.	H	α-helix	trans	-61.6	-40.7	179	179.3	0	0	0	0	111.6	D982 A1002 Q1003	D982-V999 HydrophobicContact CB-CG1 3.92Å; D982-V999 VanDerWaalsContact O-CG1 3.25Å; D982-V999 WeakPolarHBondContact O-CG1 3.36Å; V999-A1002 PolarHBondContact O-N 2.85Å; V999-Q1003 WeakPolarHBondContact O-CG 3.41Å; V999-Q1003 PolarHBondContact O-N 3.11Å
1000	E	87.8	Confident	89.8	Confident	144 Å²	144	36.4 Å²	36.4	67%	0.673	18%	0.181	S	C	*	.	H	α-helix	trans	-70.5	-41.4	-178.4	-65.1	-170.9	174.7	0	0	111.4	D998 A1002 Q1003 R1004	D998-E1000 VanDerWaalsContact C-N 3.34Å; D998-E1000 PolarHBondContact O-N 3.28Å; D998-E1000 PolarHBondContact OD1-N 3.24Å; E1000-A1002 VanDerWaalsContact C-N 3.33Å; E1000-Q1003 PolarHBondContact O-N 3.26Å; E1000-R1004 WeakPolarHBondContact O-CB 3.39Å; E1000-R1004 WeakPolarHBondContact O-CG 3.46Å; E1000-R1004 PolarHBondContact O-N 2.94Å; E1000-R1004 PolarHBondContact O-NE 3.23Å
1001	A	88.1	Confident	89.8	Confident	9 Å²	9	38 Å²	38	7%	0.074	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-39	172.1	0	0	0	0	0	111.9	D998 R1004 A1005	D998-A1001 HydrophobicContact CB-CB 3.87Å; D998-A1001 PolarHBondContact O-N 3.47Å; D998-A1001 PolarHBondContact OD1-N 3.35Å; D998-A1001 WeakPolarHBondContact OD2-CB 3.39Å; A1001-R1004 PolarHBondContact O-N 2.87Å; A1001-A1005 VanDerWaalsContact O-CB 3.28Å; A1001-A1005 WeakPolarHBondContact O-CB 3.34Å; A1001-A1005 PolarHBondContact O-N 2.91Å
1002	A	88.9	Confident	89.9	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-61.7	-47.9	176.3	0	0	0	0	0	111.6	I983 L996 D998 V999 E1000 R1004 A1005 V1006	I983-A1002 HydrophobicContact CB-CB 4.48Å; I983-A1002 HydrophobicContact CG2-CB 4.06Å; L996-A1002 HydrophobicContact CB-CB 4.14Å; L996-A1002 HydrophobicContact CD1-CB 4.15Å; L996-A1002 HydrophobicContact CD2-CB 3.99Å; L996-A1002 HydrophobicContact CG-CB 4.31Å; D998-A1002 WeakPolarHBondContact O-CB 3.38Å; D998-A1002 PolarHBondContact O-N 2.89Å; V999-A1002 PolarHBondContact O-N 2.85Å; E1000-A1002 VanDerWaalsContact C-N 3.33Å; A1002-R1004 PolarHBondContact O-N 3.07Å; A1002-A1005 PolarHBondContact O-N 3.49Å; A1002-V1006 WeakPolarHBondContact O-CG2 3.16Å; A1002-V1006 PolarHBondContact O-N 3.29Å
1003	Q	89.4	Confident	89.8	Confident	43 Å²	43	39.1 Å²	39.1	20%	0.201	19%	0.186	C	C	.	.	H	α-helix	trans	-61.3	-42.8	176.4	-70.7	179.8	17.8	0	0	112.2	D982 I983 V999 E1000 V1006 A1007 L1198	D982-Q1003 PolarHBondContact O-NE2 3.49Å; D982-Q1003 VanDerWaalsContact O-NE2 3.15Å; I983-Q1003 HydrophobicContact CB-CG 4.37Å; I983-Q1003 HydrophobicContact CD1-CG 4.14Å; I983-Q1003 HydrophobicContact CG1-CG 4.43Å; V999-Q1003 WeakPolarHBondContact O-CG 3.41Å; V999-Q1003 PolarHBondContact O-N 3.11Å; E1000-Q1003 PolarHBondContact O-N 3.26Å; Q1003-V1006 PolarHBondContact O-N 2.74Å; Q1003-A1007 WeakPolarHBondContact O-CB 3.42Å; Q1003-A1007 PolarHBondContact O-N 2.97Å; Q1003-L1198 HydrophobicContact CG-CD1 4.36Å
1004	R	88.8	Confident	89.5	Confident	156 Å²	156	41 Å²	41	59%	0.589	20%	0.2	S	C	*	.	H	α-helix	trans	-63.2	-41	174.8	-75.5	-176	-68.2	139.9	-4.2	112.2	E1000 A1001 A1002 A1007 T1008	E1000-R1004 WeakPolarHBondContact O-CB 3.39Å; E1000-R1004 WeakPolarHBondContact O-CG 3.46Å; E1000-R1004 PolarHBondContact O-N 2.94Å; E1000-R1004 PolarHBondContact O-NE 3.23Å; A1001-R1004 PolarHBondContact O-N 2.87Å; A1002-R1004 PolarHBondContact O-N 3.07Å; R1004-A1007 PolarHBondContact O-N 3.14Å; R1004-T1008 WeakPolarHBondContact O-CB 3.23Å; R1004-T1008 PolarHBondContact O-N 3.17Å; R1004-T1008 PolarHBondContact O-OG1 3.42Å
1005	A	90.9	Very high	89.2	Confident	6 Å²	6	41 Å²	41	5%	0.05	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-44.1	178.3	0	0	0	0	0	111.8	L971 A1001 A1002 T1009 F1082 P1087	L971-A1005 HydrophobicContact CD1-CB 4.24Å; A1001-A1005 VanDerWaalsContact O-CB 3.28Å; A1001-A1005 WeakPolarHBondContact O-CB 3.34Å; A1001-A1005 PolarHBondContact O-N 2.91Å; A1002-A1005 PolarHBondContact O-N 3.49Å; A1005-T1009 WeakPolarHBondContact O-CB 3.17Å; A1005-T1009 PolarHBondContact O-N 3.37Å; A1005-T1009 PolarHBondContact O-OG1 3.48Å; A1005-F1082 HydrophobicContact CB-CE2 4.42Å; A1005-P1087 HydrophobicContact CB-CB 3.88Å
1006	V	90.8	Very high	89.1	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.03	20%	0.196	C	C	.	.	H	α-helix	trans	-65.3	-46	175.8	172.1	0	0	0	0	111.2	L971 I983 I986 A1002 Q1003 T1008 T1009 I1010 L1163 L1202	L971-V1006 HydrophobicContact CD2-CG2 4.09Å; I983-V1006 HydrophobicContact CD1-CB 4.34Å; I983-V1006 HydrophobicContact CD1-CG1 4.34Å; I983-V1006 HydrophobicContact CD1-CG2 4.36Å; I983-V1006 HydrophobicContact CG2-CG2 3.78Å; I986-V1006 HydrophobicContact CD1-CG2 4.17Å; A1002-V1006 WeakPolarHBondContact O-CG2 3.16Å; A1002-V1006 PolarHBondContact O-N 3.29Å; Q1003-V1006 PolarHBondContact O-N 2.74Å; V1006-T1008 PolarHBondContact O-N 3.5Å; V1006-T1009 WeakPolarHBondContact O-CB 3.18Å; V1006-T1009 PolarHBondContact O-N 3.37Å; V1006-T1009 VanDerWaalsContact O-N 3.16Å; V1006-I1010 HydrophobicContact CG1-CD1 4.14Å; V1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; V1006-I1010 PolarHBondContact O-N 2.88Å; V1006-L1163 HydrophobicContact CG1-CD1 4.43Å; V1006-L1163 HydrophobicContact CG1-CD2 3.99Å; V1006-L1202 HydrophobicContact CG1-CD1 4.4Å
1007	A	88.5	Confident	88.9	Confident	16 Å²	16	44.5 Å²	44.5	13%	0.132	22%	0.221	C	C	.	.	H	α-helix	trans	-57	-47.6	176.3	0	0	0	0	0	112.1	Q1003 R1004 T1009 I1010 W1011 L1202	Q1003-A1007 WeakPolarHBondContact O-CB 3.42Å; Q1003-A1007 PolarHBondContact O-N 2.97Å; R1004-A1007 PolarHBondContact O-N 3.14Å; A1007-T1009 VanDerWaalsContact C-N 3.31Å; A1007-T1009 PolarHBondContact O-N 3.26Å; A1007-I1010 PolarHBondContact O-N 3.27Å; A1007-W1011 PolarHBondContact O-N 3.29Å; A1007-L1202 HydrophobicContact CB-CD2 3.78Å
1008	T	89.8	Confident	88.9	Confident	55 Å²	55	41.8 Å²	41.8	34%	0.337	21%	0.209	S	C	.	.	H	α-helix	trans	-62.5	-40.4	177.1	-53	0	0	0	0	111.2	R1004 V1006 I1010 W1011 L1012 F1082	R1004-T1008 WeakPolarHBondContact O-CB 3.23Å; R1004-T1008 PolarHBondContact O-N 3.17Å; R1004-T1008 PolarHBondContact O-OG1 3.42Å; V1006-T1008 PolarHBondContact O-N 3.5Å; T1008-I1010 PolarHBondContact O-N 3.41Å; T1008-W1011 PolarHBondContact O-N 2.9Å; T1008-L1012 HydrophobicContact CG2-CD1 3.93Å; T1008-L1012 HydrophobicContact CG2-CG 4.28Å; T1008-L1012 WeakPolarHBondContact O-CB 3.49Å; T1008-L1012 VanDerWaalsContact O-CG 3.27Å; T1008-L1012 WeakPolarHBondContact O-CG 3.28Å; T1008-L1012 PolarHBondContact O-N 3.12Å; T1008-F1082 HydrophobicContact CG2-CD2 3.67Å; T1008-F1082 HydrophobicContact CG2-CE2 4.2Å; T1008-F1082 HydrophobicContact CG2-CG 4.42Å
1009	T	91.2	Very high	88.8	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-45.1	177.6	-62.8	0	0	0	0	112.1	L971 A1005 V1006 A1007 W1011 L1012 R1013 F1082	L971-T1009 HydrophobicContact CB-CG2 3.78Å; L971-T1009 WeakPolarHBondContact O-CG2 3.32Å; A1005-T1009 WeakPolarHBondContact O-CB 3.17Å; A1005-T1009 PolarHBondContact O-N 3.37Å; A1005-T1009 PolarHBondContact O-OG1 3.48Å; V1006-T1009 WeakPolarHBondContact O-CB 3.18Å; V1006-T1009 PolarHBondContact O-N 3.37Å; V1006-T1009 VanDerWaalsContact O-N 3.16Å; A1007-T1009 VanDerWaalsContact C-N 3.31Å; A1007-T1009 PolarHBondContact O-N 3.26Å; T1009-W1011 VanDerWaalsContact C-N 3.29Å; T1009-W1011 PolarHBondContact O-N 2.97Å; T1009-L1012 PolarHBondContact O-N 3.02Å; T1009-R1013 HydrophobicContact CG2-CG 4.34Å; T1009-R1013 WeakPolarHBondContact O-CB 3.06Å; T1009-R1013 WeakPolarHBondContact O-CG 3.33Å; T1009-R1013 PolarHBondContact O-N 3.45Å; T1009-F1082 WeakPolarHBondContact OG1-CZ 3.27Å
1010	I	89.1	Confident	88.8	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-58.1	-45.6	178	-69.8	169.1	0	0	0	110.6	V1006 A1007 T1008 S1014 L1163 L1202 I1206	V1006-I1010 HydrophobicContact CG1-CD1 4.14Å; V1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; V1006-I1010 PolarHBondContact O-N 2.88Å; A1007-I1010 PolarHBondContact O-N 3.27Å; T1008-I1010 PolarHBondContact O-N 3.41Å; I1010-S1014 WeakPolarHBondContact O-CB 3.29Å; I1010-S1014 PolarHBondContact O-N 3.38Å; I1010-S1014 PolarHBondContact O-OG 3Å; I1010-L1163 HydrophobicContact CD1-CD2 3.62Å; I1010-L1163 HydrophobicContact CG1-CD2 4.2Å; I1010-L1202 HydrophobicContact CD1-CB 4.01Å; I1010-L1202 HydrophobicContact CD1-CD1 4.49Å; I1010-L1202 HydrophobicContact CD1-CD2 3.95Å; I1010-L1202 HydrophobicContact CD1-CG 4.36Å; I1010-I1206 HydrophobicContact CG2-CD1 3.61Å; I1010-I1206 HydrophobicContact CG2-CG1 3.18Å
1011	W	88.5	Confident	88.7	Confident	65 Å²	65	36.6 Å²	36.6	25%	0.246	18%	0.18	C	C	.	.	H	α-helix	trans	-65.8	-42.9	178.1	-179.9	87.2	0	0	0	112.2	A1007 T1008 T1009 S1014 T1015 I1074 S1078	A1007-W1011 PolarHBondContact O-N 3.29Å; T1008-W1011 PolarHBondContact O-N 2.9Å; T1009-W1011 VanDerWaalsContact C-N 3.29Å; T1009-W1011 PolarHBondContact O-N 2.97Å; W1011-S1014 PolarHBondContact O-N 2.86Å; W1011-T1015 WeakPolarHBondContact O-CB 3.35Å; W1011-T1015 PolarHBondContact O-N 3.19Å; W1011-T1015 PolarHBondContact O-OG1 3.16Å; W1011-I1074 HydrophobicContact CH2-CG2 3.43Å; W1011-I1074 VanDerWaalsContact CH2-CG2 3.43Å; W1011-I1074 HydrophobicContact CZ2-CG2 3.81Å; W1011-S1078 WeakPolarHBondContact CH2-OG 3.47Å; W1011-S1078 VanDerWaalsContact CZ3-CB 3.5Å; W1011-S1078 WeakPolarHBondContact CZ3-OG 3.36Å
1012	L	91.4	Very high	88.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-44.4	176.9	-74	170.3	0	0	0	112	L972 T1008 T1009 T1015 T1016 L1075 L1079 F1082	L972-L1012 HydrophobicContact CD2-CB 4.14Å; L972-L1012 HydrophobicContact CD2-CD1 4.14Å; T1008-L1012 HydrophobicContact CG2-CD1 3.93Å; T1008-L1012 HydrophobicContact CG2-CG 4.28Å; T1008-L1012 WeakPolarHBondContact O-CB 3.49Å; T1008-L1012 VanDerWaalsContact O-CG 3.27Å; T1008-L1012 WeakPolarHBondContact O-CG 3.28Å; T1008-L1012 PolarHBondContact O-N 3.12Å; T1009-L1012 PolarHBondContact O-N 3.02Å; L1012-T1015 PolarHBondContact O-N 2.87Å; L1012-T1016 WeakPolarHBondContact O-CB 3.4Å; L1012-T1016 PolarHBondContact O-N 3.38Å; L1012-T1016 PolarHBondContact O-OG1 3.48Å; L1012-L1075 HydrophobicContact CD2-CD1 3.96Å; L1012-L1079 HydrophobicContact CD1-CD2 4.06Å; L1012-L1079 HydrophobicContact CD2-CD2 4Å; L1012-L1079 HydrophobicContact CD2-CG 4.01Å; L1012-L1079 HydrophobicContact CG-CD2 4.46Å; L1012-F1082 HydrophobicContact CD1-CB 3.94Å; L1012-F1082 HydrophobicContact CD1-CD1 3.88Å; L1012-F1082 HydrophobicContact CD1-CD2 4.17Å; L1012-F1082 HydrophobicContact CD1-CE1 4.41Å; L1012-F1082 HydrophobicContact CD1-CG 3.73Å
1013	R	91	Very high	88.2	Confident	41 Å²	41	40.2 Å²	40.2	16%	0.155	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-47.7	176.9	-76.7	-174.2	141.5	-170.9	-8	111.9	L971 L972 Y973 C974 T1009 T1015 T1016 Q1017 Y1162	L971-R1013 PolarHBondContact O-NE 3.34Å; L972-R1013 VanDerWaalsContact O-CZ 3.24Å; L972-R1013 PolarHBondContact O-NE 2.93Å; L972-R1013 PolarHBondContact O-NH2 2.96Å; Y973-R1013 PolarHBondContact O-NH2 3.47Å; C974-R1013 VanDerWaalsContact O-CZ 3.26Å; C974-R1013 PolarHBondContact O-NH1 3.24Å; C974-R1013 PolarHBondContact O-NH2 3.45Å; T1009-R1013 HydrophobicContact CG2-CG 4.34Å; T1009-R1013 WeakPolarHBondContact O-CB 3.06Å; T1009-R1013 WeakPolarHBondContact O-CG 3.33Å; T1009-R1013 PolarHBondContact O-N 3.45Å; R1013-T1015 VanDerWaalsContact C-N 3.35Å; R1013-T1015 PolarHBondContact O-N 3.42Å; R1013-T1016 PolarHBondContact O-N 3.37Å; R1013-Q1017 PolarHBondContact O-N 3.38Å; R1013-Y1162 WeakPolarHBondContact CD-OH 3.3Å
1014	S	87.6	Confident	87.9	Confident	41 Å²	41	39 Å²	39	29%	0.287	19%	0.187	S	C	.	.	H	α-helix	trans	-61.5	-44.4	178.9	-55.6	0	0	0	0	111.2	I1010 W1011 T1016 Q1017 C1018	I1010-S1014 WeakPolarHBondContact O-CB 3.29Å; I1010-S1014 PolarHBondContact O-N 3.38Å; I1010-S1014 PolarHBondContact O-OG 3Å; W1011-S1014 PolarHBondContact O-N 2.86Å; S1014-T1016 PolarHBondContact O-N 3.18Å; S1014-Q1017 PolarHBondContact O-N 3.1Å; S1014-C1018 VanDerWaalsContact O-CB 3.28Å; S1014-C1018 WeakPolarHBondContact O-CB 3.34Å; S1014-C1018 PolarHBondContact O-N 3.46Å
1015	T	87.5	Confident	87.5	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-63.5	-41.5	176.3	-56.6	0	0	0	0	111.6	W1011 L1012 R1013 C1018 L1019 L1071 L1075	W1011-T1015 WeakPolarHBondContact O-CB 3.35Å; W1011-T1015 PolarHBondContact O-N 3.19Å; W1011-T1015 PolarHBondContact O-OG1 3.16Å; L1012-T1015 PolarHBondContact O-N 2.87Å; R1013-T1015 VanDerWaalsContact C-N 3.35Å; R1013-T1015 PolarHBondContact O-N 3.42Å; T1015-C1018 PolarHBondContact O-N 2.78Å; T1015-L1019 WeakPolarHBondContact O-CB 3.37Å; T1015-L1019 PolarHBondContact O-N 2.9Å; T1015-L1071 HydrophobicContact CG2-CD2 4.33Å; T1015-L1075 HydrophobicContact CG2-CB 4.26Å; T1015-L1075 HydrophobicContact CG2-CD1 4.24Å
1016	T	89.2	Confident	87	Confident	27 Å²	27	34.5 Å²	34.5	17%	0.166	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-45.4	177.2	-58.3	0	0	0	0	111.6	L1012 R1013 S1014 L1019 M1020 L1075	L1012-T1016 WeakPolarHBondContact O-CB 3.4Å; L1012-T1016 PolarHBondContact O-N 3.38Å; L1012-T1016 PolarHBondContact O-OG1 3.48Å; R1013-T1016 PolarHBondContact O-N 3.37Å; S1014-T1016 PolarHBondContact O-N 3.18Å; T1016-L1019 PolarHBondContact O-N 2.91Å; T1016-M1020 WeakPolarHBondContact O-CB 3.37Å; T1016-M1020 PolarHBondContact O-N 2.8Å; T1016-L1075 HydrophobicContact CG2-CD2 4.48Å; T1016-L1075 WeakPolarHBondContact OG1-CD1 3.26Å
1017	Q	86.5	Confident	86.4	Confident	121 Å²	121	34.5 Å²	34.5	57%	0.565	18%	0.182	S	C	*	.	H	α-helix	trans	-62.2	-47.7	176.8	179.4	178.7	-16.2	0	0	111	R1013 S1014 L1019 M1020 E1021	R1013-Q1017 PolarHBondContact O-N 3.38Å; S1014-Q1017 PolarHBondContact O-N 3.1Å; Q1017-L1019 PolarHBondContact O-N 3.09Å; Q1017-M1020 WeakPolarHBondContact O-CB 3.07Å; Q1017-M1020 PolarHBondContact O-N 3.05Å; Q1017-M1020 VanDerWaalsContact O-N 3.14Å; Q1017-E1021 WeakPolarHBondContact CG-OE1 3.05Å; Q1017-E1021 PolarHBondContact NE2-OE1 3.3Å; Q1017-E1021 WeakPolarHBondContact O-CG 3.39Å; Q1017-E1021 PolarHBondContact O-N 2.79Å
1018	C	85.9	Confident	85.7	Confident	29 Å²	29	36.7 Å²	36.7	20%	0.196	19%	0.191	C	C	.	.	H	α-helix	trans	-57.5	-48	177.8	-171.4	0	0	0	0	111.5	S1014 T1015 M1020 E1021 Y1022	S1014-C1018 VanDerWaalsContact O-CB 3.28Å; S1014-C1018 WeakPolarHBondContact O-CB 3.34Å; S1014-C1018 PolarHBondContact O-N 3.46Å; T1015-C1018 PolarHBondContact O-N 2.78Å; C1018-M1020 VanDerWaalsContact C-N 3.33Å; C1018-M1020 PolarHBondContact O-N 3.19Å; C1018-E1021 PolarHBondContact O-N 3.33Å; C1018-Y1022 WeakPolarHBondContact O-CD2 3.28Å; C1018-Y1022 PolarHBondContact O-N 3.07Å; C1018-Y1022 WeakPolarHBondContact SG-CE2 3.39Å
1019	L	87.9	Confident	85	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.7	-42.5	175.9	175.4	61.6	0	0	0	112	L583 T1015 T1016 Q1017 Y1022 E1023 I1068 L1071 Q1072 L1075	L583-L1019 HydrophobicContact CB-CD2 4.19Å; L583-L1019 HydrophobicContact CD2-CG 4.38Å; T1015-L1019 WeakPolarHBondContact O-CB 3.37Å; T1015-L1019 PolarHBondContact O-N 2.9Å; T1016-L1019 PolarHBondContact O-N 2.91Å; Q1017-L1019 PolarHBondContact O-N 3.09Å; L1019-Y1022 PolarHBondContact O-N 3.4Å; L1019-E1023 HydrophobicContact CD1-CG 4.12Å; L1019-E1023 WeakPolarHBondContact O-CB 3.46Å; L1019-E1023 PolarHBondContact O-N 2.57Å; L1019-I1068 HydrophobicContact CD1-CG2 4.08Å; L1019-L1071 HydrophobicContact CD1-CB 4.1Å; L1019-Q1072 HydrophobicContact CD1-CG 3.76Å; L1019-Q1072 HydrophobicContact CD2-CG 3.8Å; L1019-Q1072 HydrophobicContact CG-CG 4.42Å; L1019-L1075 HydrophobicContact CD2-CD2 3.79Å
1020	M	86.8	Confident	84.2	Confident	35 Å²	35	39.4 Å²	39.4	17%	0.172	20%	0.195	C	C	.	.	H	α-helix	trans	-61.4	-44.5	178	-175.5	179.7	-68.2	0	0	111.4	L561 M580 L583 T1016 Q1017 C1018 E1023 L1024	L561-M1020 HydrophobicContact CD2-SD 4.33Å; M580-M1020 HydrophobicContact SD-CE 3.67Å; L583-M1020 HydrophobicContact CD1-CB 4.06Å; L583-M1020 HydrophobicContact CD1-CE 3.66Å; L583-M1020 HydrophobicContact CD1-CG 4.3Å; L583-M1020 HydrophobicContact CD2-CB 4.46Å; T1016-M1020 WeakPolarHBondContact O-CB 3.37Å; T1016-M1020 PolarHBondContact O-N 2.8Å; Q1017-M1020 WeakPolarHBondContact O-CB 3.07Å; Q1017-M1020 PolarHBondContact O-N 3.05Å; Q1017-M1020 VanDerWaalsContact O-N 3.14Å; C1018-M1020 VanDerWaalsContact C-N 3.33Å; C1018-M1020 PolarHBondContact O-N 3.19Å; M1020-E1023 PolarHBondContact O-N 3.15Å; M1020-L1024 HydrophobicContact CG-CD1 3.67Å; M1020-L1024 HydrophobicContact CG-CG 4.25Å; M1020-L1024 VanDerWaalsContact O-CB 3.3Å; M1020-L1024 WeakPolarHBondContact O-CB 3.39Å; M1020-L1024 WeakPolarHBondContact O-CG 3.33Å; M1020-L1024 PolarHBondContact O-N 3.48Å; M1020-L1024 HydrophobicContact SD-CD1 4.41Å
1021	E	83.9	Confident	83.1	Confident	111 Å²	111	43.3 Å²	43.3	52%	0.519	21%	0.21	S	C	.	.	H	α-helix	trans	-61.2	-45.7	176.8	-71.7	170.9	-169.7	0	0	111.8	Q1017 C1018 L1024 A1025	Q1017-E1021 WeakPolarHBondContact CG-OE1 3.05Å; Q1017-E1021 PolarHBondContact NE2-OE1 3.3Å; Q1017-E1021 WeakPolarHBondContact O-CG 3.39Å; Q1017-E1021 PolarHBondContact O-N 2.79Å; C1018-E1021 PolarHBondContact O-N 3.33Å; E1021-L1024 PolarHBondContact O-N 2.96Å; E1021-A1025 VanDerWaalsContact O-CB 3.29Å; E1021-A1025 WeakPolarHBondContact O-CB 3.4Å; E1021-A1025 PolarHBondContact O-N 3.37Å
1022	Y	84.1	Confident	82.1	Confident	76 Å²	76	44.5 Å²	44.5	30%	0.298	22%	0.221	S	C	.	.	H	α-helix	trans	-63.2	-45.2	176.7	-80.6	-64.5	0	0	0	113	C1018 L1019 E1026 L1071	C1018-Y1022 WeakPolarHBondContact O-CD2 3.28Å; C1018-Y1022 PolarHBondContact O-N 3.07Å; C1018-Y1022 WeakPolarHBondContact SG-CE2 3.39Å; L1019-Y1022 PolarHBondContact O-N 3.4Å; Y1022-E1026 WeakPolarHBondContact O-CB 3.39Å; Y1022-E1026 PolarHBondContact O-N 3.16Å; Y1022-L1071 HydrophobicContact CD2-CD1 4.02Å; Y1022-L1071 HydrophobicContact CE2-CD1 4.3Å
1023	E	83.6	Confident	80.7	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-43.3	178	-82.7	-76	-168.5	0	0	111.4	L583 L1019 M1020 E1026 C1027 I1068 Q1072	L583-E1023 HydrophobicContact CD2-CB 3.92Å; L583-E1023 HydrophobicContact CD2-CG 3.94Å; L1019-E1023 HydrophobicContact CD1-CG 4.12Å; L1019-E1023 WeakPolarHBondContact O-CB 3.46Å; L1019-E1023 PolarHBondContact O-N 2.57Å; M1020-E1023 PolarHBondContact O-N 3.15Å; E1023-E1026 PolarHBondContact O-N 3.5Å; E1023-C1027 WeakPolarHBondContact O-CB 3.33Å; E1023-C1027 PolarHBondContact O-N 3.26Å; E1023-I1068 HydrophobicContact CG-CG2 4.03Å; E1023-I1068 WeakPolarHBondContact OE1-CG2 3.19Å; E1023-Q1072 PolarHBondContact OE1-NE2 2.7Å
1024	L	81.9	Confident	79.1	Confident	17 Å²	17	51.6 Å²	51.6	9%	0.089	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-40.7	177.9	-70.5	171.8	0	0	0	112.1	P560 L561 L564 M1020 E1021 C1027 L1028	P560-L1024 HydrophobicContact CB-CB 4.11Å; P560-L1024 HydrophobicContact CB-CD1 4.2Å; L561-L1024 HydrophobicContact CB-CD1 4.09Å; L564-L1024 HydrophobicContact CD2-CD2 3.62Å; M1020-L1024 HydrophobicContact CG-CD1 3.67Å; M1020-L1024 HydrophobicContact CG-CG 4.25Å; M1020-L1024 VanDerWaalsContact O-CB 3.3Å; M1020-L1024 WeakPolarHBondContact O-CB 3.39Å; M1020-L1024 WeakPolarHBondContact O-CG 3.33Å; M1020-L1024 PolarHBondContact O-N 3.48Å; M1020-L1024 HydrophobicContact SD-CD1 4.41Å; E1021-L1024 PolarHBondContact O-N 2.96Å; L1024-C1027 WeakPolarHBondContact O-CB 3.38Å; L1024-C1027 PolarHBondContact O-N 3.4Å; L1024-L1028 WeakPolarHBondContact O-CG 3.36Å; L1024-L1028 PolarHBondContact O-N 2.74Å
1025	A	80.6	Confident	77.2	Confident	61 Å²	61	55 Å²	55	50%	0.504	28%	0.277	S	S	.	.	H	α-helix	trans	-63.2	-43.7	176.4	0	0	0	0	0	111.8	E1021 R1029	E1021-A1025 VanDerWaalsContact O-CB 3.29Å; E1021-A1025 WeakPolarHBondContact O-CB 3.4Å; E1021-A1025 PolarHBondContact O-N 3.37Å; A1025-R1029 WeakPolarHBondContact O-CB 3.41Å; A1025-R1029 PolarHBondContact O-N 2.79Å; A1025-R1029 VanDerWaalsContact O-N 3.08Å
1026	E	80.1	Confident	75.1	Confident	7 Å²	7	60.1 Å²	60.1	3%	0.033	31%	0.308	C	S	.	.	H	α-helix	trans	-70.5	-33.9	178.1	173.4	61.8	-167	0	0	112.1	Y1022 E1023 R1029 R1030 I1068	Y1022-E1026 WeakPolarHBondContact O-CB 3.39Å; Y1022-E1026 PolarHBondContact O-N 3.16Å; E1023-E1026 PolarHBondContact O-N 3.5Å; E1026-R1029 PolarHBondContact O-N 3.43Å; E1026-R1029 IonicContact OE1-CZ 2.94Å; E1026-R1029 IonicContact OE1-NE 3.42Å; E1026-R1029 IonicContact OE1-NH2 3.79Å; E1026-R1029 PolarHBondContact OE1-NH2 3.35Å; E1026-R1029 IonicContact OE2-CZ 3.97Å; E1026-R1029 IonicContact OE2-NE 2.72Å; E1026-R1029 PolarHBondContact OE2-NE 3.02Å; E1026-R1029 IonicContact OE2-NH2 3.28Å; E1026-R1029 PolarHBondContact OE2-NH2 3.43Å; E1026-R1030 WeakPolarHBondContact O-CG 3.47Å; E1026-R1030 PolarHBondContact O-N 2.89Å; E1026-R1030 IonicContact OE1-CZ 3.67Å; E1026-R1030 IonicContact OE1-NE 2.76Å; E1026-R1030 PolarHBondContact OE1-NE 3.05Å; E1026-R1030 IonicContact OE1-NH2 3.57Å; E1026-R1030 PolarHBondContact OE1-NH2 3.4Å; E1026-I1068 HydrophobicContact CB-CD1 4.2Å; E1026-I1068 HydrophobicContact CG-CD1 4.37Å
1027	C	79.6	Confident	72.6	Confident	6 Å²	6	62.1 Å²	62.1	4%	0.041	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-52.5	172.7	-179.6	0	0	0	0	111.4	S703 L705 E1023 L1024 R1029 R1030 R1031	S703-C1027 PolarHBondContact O-SG 2.89Å; L705-C1027 HydrophobicContact CD2-CB 4.28Å; E1023-C1027 WeakPolarHBondContact O-CB 3.33Å; E1023-C1027 PolarHBondContact O-N 3.26Å; L1024-C1027 WeakPolarHBondContact O-CB 3.38Å; L1024-C1027 PolarHBondContact O-N 3.4Å; C1027-R1029 VanDerWaalsContact C-N 3.31Å; C1027-R1029 PolarHBondContact O-N 3.46Å; C1027-R1030 WeakPolarHBondContact O-CB 3.17Å; C1027-R1030 PolarHBondContact O-N 3.37Å; C1027-R1030 VanDerWaalsContact O-N 3.13Å; C1027-R1031 PolarHBondContact O-N 2.68Å; C1027-R1031 VanDerWaalsContact O-N 3.12Å
1028	L	74.2	Confident	70	Confident	62 Å²	62	63.6 Å²	63.6	33%	0.325	35%	0.346	S	S	.	.	H	α-helix	trans	-58.1	-42.4	174.9	-71	173.7	0	0	0	111.9	P560 L1024 R1030 R1031 D1032	P560-L1028 HydrophobicContact CB-CD1 4.06Å; P560-L1028 HydrophobicContact CG-CD1 4.31Å; L1024-L1028 WeakPolarHBondContact O-CG 3.36Å; L1024-L1028 PolarHBondContact O-N 2.74Å; L1028-R1030 VanDerWaalsContact C-N 3.31Å; L1028-R1030 PolarHBondContact O-N 3.42Å; L1028-R1031 WeakPolarHBondContact O-CB 3.25Å; L1028-R1031 PolarHBondContact O-N 3.46Å; L1028-R1031 VanDerWaalsContact O-N 3.1Å; L1028-D1032 PolarHBondContact O-N 3.14Å; L1028-D1032 VanDerWaalsContact O-N 3.12Å
1029	R	73.7	Confident	67.4	Low	71 Å²	71	67 Å²	67	27%	0.268	37%	0.37	S	S	.	.	H	α-helix	trans	-61.8	-35.7	177.2	-163.7	-161.6	63	62.9	2.9	113	A1025 E1026 C1027	A1025-R1029 WeakPolarHBondContact O-CB 3.41Å; A1025-R1029 PolarHBondContact O-N 2.79Å; A1025-R1029 VanDerWaalsContact O-N 3.08Å; E1026-R1029 PolarHBondContact O-N 3.43Å; E1026-R1029 IonicContact OE1-CZ 2.94Å; E1026-R1029 IonicContact OE1-NE 3.42Å; E1026-R1029 IonicContact OE1-NH2 3.79Å; E1026-R1029 PolarHBondContact OE1-NH2 3.35Å; E1026-R1029 IonicContact OE2-CZ 3.97Å; E1026-R1029 IonicContact OE2-NE 2.72Å; E1026-R1029 PolarHBondContact OE2-NE 3.02Å; E1026-R1029 IonicContact OE2-NH2 3.28Å; E1026-R1029 PolarHBondContact OE2-NH2 3.43Å; C1027-R1029 VanDerWaalsContact C-N 3.31Å; C1027-R1029 PolarHBondContact O-N 3.46Å
1030	R	74	Confident	64.5	Low	44 Å²	44	71 Å²	71	17%	0.166	41%	0.411	C	S	.	.	H	α-helix	trans	-68.5	-37.6	175	-72.2	168.8	-168.5	146.4	2	111	G704 E1026 C1027 L1028 Q1033 T1034	G704-R1030 WeakPolarHBondContact O-CD 3.48Å; G704-R1030 PolarHBondContact O-NH1 3.09Å; E1026-R1030 WeakPolarHBondContact O-CG 3.47Å; E1026-R1030 PolarHBondContact O-N 2.89Å; E1026-R1030 IonicContact OE1-CZ 3.67Å; E1026-R1030 IonicContact OE1-NE 2.76Å; E1026-R1030 PolarHBondContact OE1-NE 3.05Å; E1026-R1030 IonicContact OE1-NH2 3.57Å; E1026-R1030 PolarHBondContact OE1-NH2 3.4Å; C1027-R1030 WeakPolarHBondContact O-CB 3.17Å; C1027-R1030 PolarHBondContact O-N 3.37Å; C1027-R1030 VanDerWaalsContact O-N 3.13Å; L1028-R1030 VanDerWaalsContact C-N 3.31Å; L1028-R1030 PolarHBondContact O-N 3.42Å; R1030-Q1033 PolarHBondContact O-N 3.13Å; R1030-T1034 PolarHBondContact O-N 3.37Å
1031	R	67.3	Low	61.8	Low	84 Å²	84	75.9 Å²	75.9	32%	0.317	44%	0.438	S	S	.	.	H	α-helix	trans	-64.4	-42.9	179	-159	-176.6	81.4	138.4	6	112.8	D567 C1027 L1028 Q1033 T1034 L1035	D567-R1031 IonicContact OD2-NH1 3.28Å; C1027-R1031 PolarHBondContact O-N 2.68Å; C1027-R1031 VanDerWaalsContact O-N 3.12Å; L1028-R1031 WeakPolarHBondContact O-CB 3.25Å; L1028-R1031 PolarHBondContact O-N 3.46Å; L1028-R1031 VanDerWaalsContact O-N 3.1Å; R1031-Q1033 PolarHBondContact O-N 3.43Å; R1031-T1034 PolarHBondContact O-N 3.29Å; R1031-T1034 PolarHBondContact O-OG1 3.4Å; R1031-L1035 HydrophobicContact CG-CD1 4.5Å; R1031-L1035 PolarHBondContact O-N 2.65Å
1032	D	66.5	Low	59.2	Low	91 Å²	91	74.5 Å²	74.5	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-67.1	-24.1	-180	-65.3	-18.8	0	0	0	112.5	L1028 T1036	L1028-D1032 PolarHBondContact O-N 3.14Å; L1028-D1032 VanDerWaalsContact O-N 3.12Å; D1032-T1036 PolarHBondContact O-N 2.81Å; D1032-T1036 PolarHBondContact O-OG1 2.9Å
1033	Q	63.4	Low	56.5	Low	91 Å²	91	75.6 Å²	75.6	43%	0.425	47%	0.472	S	S	.	.	H	α-helix	trans	-77.4	-32.8	175.6	-73	178.4	-15.4	0	0	113.2	R1030 R1031 T1036	R1030-Q1033 PolarHBondContact O-N 3.13Å; R1031-Q1033 PolarHBondContact O-N 3.43Å; Q1033-T1036 PolarHBondContact O-OG1 3.03Å
1034	T	56.1	Low	54	Low	99 Å²	99	82.6 Å²	82.6	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-75.7	-31.3	178	53.5	0	0	0	0	112	R1030 R1031	R1030-T1034 PolarHBondContact O-N 3.37Å; R1031-T1034 PolarHBondContact O-N 3.29Å; R1031-T1034 PolarHBondContact O-OG1 3.4Å
1035	L	48.2	Very low	51.6	Low	113 Å²	113	89 Å²	89	59%	0.592	54%	0.544	S	S	*	.	H	α-helix	trans	-71.9	-32.7	176.9	-72.8	162.7	0	0	0	113.4	R1031	R1031-L1035 HydrophobicContact CG-CD1 4.5Å; R1031-L1035 PolarHBondContact O-N 2.65Å
1036	T	43.1	Very low	49.2	Very low	108 Å²	108	89.1 Å²	89.1	66%	0.663	55%	0.55	S	S	*	*	H	α-helix	trans	-81.9	-20.7	-177.8	44.3	0	0	0	0	113.9	D1032 Q1033	D1032-T1036 PolarHBondContact O-N 2.81Å; D1032-T1036 PolarHBondContact O-OG1 2.9Å; Q1033-T1036 PolarHBondContact O-OG1 3.03Å
1037	G	36.2	Very low	46.8	Very low	69 Å²	69	96.1 Å²	96.1	71%	0.711	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-12.7	-177.2	0	0	0	0	0	116.5
1038	D	33.4	Very low	44.5	Very low	152 Å²	152	102.5 Å²	102.5	81%	0.813	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	4.2	-172.9	-143.2	16	0	0	0	113.7	G1040	D1038-G1040 PolarHBondContact O-N 3.2Å; D1038-G1040 VanDerWaalsContact O-N 3.11Å
1039	S	31.1	Very low	42.3	Very low	101 Å²	101	105 Å²	105	71%	0.706	65%	0.645	S	S	*	*			trans	-84.8	81.2	173.3	-57.9	0	0	0	0	109.6	D1041	S1039-D1041 VanDerWaalsContact C-N 3.31Å; S1039-D1041 PolarHBondContact O-N 3.3Å
1040	G	27.6	Very low	40.3	Very low	83 Å²	83	107.5 Å²	107.5	86%	0.856	67%	0.668	S	S	*	*			trans	-67	87.4	170.6	0	0	0	0	0	110.9	D1038	D1038-G1040 PolarHBondContact O-N 3.2Å; D1038-G1040 VanDerWaalsContact O-N 3.11Å
1041	D	29.2	Very low	38.3	Very low	138 Å²	138	115.1 Å²	115.1	74%	0.738	70%	0.703	S	S	*	*			trans	-116.7	99.7	165.5	-150.1	8.7	0	0	0	109.1	S1039 C1043	S1039-D1041 VanDerWaalsContact C-N 3.31Å; S1039-D1041 PolarHBondContact O-N 3.3Å; D1041-C1043 PolarHBondContact O-N 3.03Å; D1041-C1043 VanDerWaalsContact O-N 3.07Å
1042	G	29.4	Very low	36.8	Very low	82 Å²	82	116.8 Å²	116.8	85%	0.845	72%	0.722	S	S	*	*			trans	-73.3	91.5	173.6	0	0	0	0	0	109.3
1043	C	27.2	Very low	35.3	Very low	100 Å²	100	117.2 Å²	117.2	68%	0.676	73%	0.732	S	S	*	*			trans	-120.2	88.3	158	45.6	0	0	0	0	108.6	D1041 N1045	D1041-C1043 PolarHBondContact O-N 3.03Å; D1041-C1043 VanDerWaalsContact O-N 3.07Å; C1043-N1045 PolarHBondContact O-N 3.14Å; C1043-N1045 VanDerWaalsContact O-N 3.09Å
1044	D	30.7	Very low	33.9	Very low	156 Å²	156	118.2 Å²	118.2	83%	0.834	75%	0.745	S	S	*	*			trans	-60.9	100	163.3	-166.7	14.2	0	0	0	108
1045	N	31.5	Very low	33.1	Very low	152 Å²	152	122.1 Å²	122.1	81%	0.813	75%	0.753	S	S	*	*			trans	-137.8	104.9	163.8	-96	-22	0	0	0	107.8	C1043 N1047	C1043-N1045 PolarHBondContact O-N 3.14Å; C1043-N1045 VanDerWaalsContact O-N 3.09Å; N1045-N1047 PolarHBondContact O-N 2.58Å
1046	G	30	Very low	32.5	Very low	62 Å²	62	126.7 Å²	126.7	64%	0.639	76%	0.764	S	S	*	*			trans	-55.8	126.1	178.3	0	0	0	0	0	111.6
1047	N	30.1	Very low	32.5	Very low	155 Å²	155	125.5 Å²	125.5	83%	0.829	76%	0.76	S	S	*	*			trans	-143.7	100.3	150.7	-100.4	-20.3	0	0	0	108.9	N1045 T1049	N1045-N1047 PolarHBondContact O-N 2.58Å; N1047-T1049 VanDerWaalsContact C-N 3.32Å; N1047-T1049 PolarHBondContact O-N 3.42Å; N1047-T1049 VanDerWaalsContact O-N 3.08Å
1048	T	30.8	Very low	33	Very low	140 Å²	140	125.3 Å²	125.3	86%	0.859	75%	0.747	S	S	*	*			trans	-82.3	67	-175.4	-38.3	0	0	0	0	110.6
1049	T	29.2	Very low	33.8	Very low	115 Å²	115	122 Å²	122	71%	0.706	74%	0.736	S	S	*	*			trans	-159.7	100	169	32.8	0	0	0	0	110.4	N1047	N1047-T1049 VanDerWaalsContact C-N 3.32Å; N1047-T1049 PolarHBondContact O-N 3.42Å; N1047-T1049 VanDerWaalsContact O-N 3.08Å
1050	T	30.3	Very low	35	Very low	123 Å²	123	124.5 Å²	124.5	76%	0.755	73%	0.734	S	S	*	*			trans	157.5	72.8	147.9	41.4	0	0	0	0	110.8	T1052	T1050-T1052 VanDerWaalsContact C-N 3.31Å
1051	K	33.8	Very low	36.5	Very low	204 Å²	204	124 Å²	124	89%	0.887	71%	0.708	S	S	*	*			trans	-88.7	15.5	172.4	-88.8	-173.4	177.4	178.4	0	114
1052	T	35.4	Very low	38.2	Very low	118 Å²	118	121.5 Å²	121.5	72%	0.724	70%	0.695	S	S	*	*	S	Bend	trans	-104	-15.1	-174.9	24.8	0	0	0	0	115.5	T1050	T1050-T1052 VanDerWaalsContact C-N 3.31Å
1053	S	33.7	Very low	40.4	Very low	100 Å²	100	121.9 Å²	121.9	70%	0.699	68%	0.675	S	S	*	*	S	Bend	trans	-87.5	-8.4	-178.9	-71.6	0	0	0	0	115.7
1054	T	34.3	Very low	42.7	Very low	112 Å²	112	120 Å²	120	69%	0.687	66%	0.658	S	S	*	*	H	α-helix	trans	-83.4	-18.5	-179.4	20.6	0	0	0	0	114.8
1055	K	39.4	Very low	45	Very low	182 Å²	182	115.2 Å²	115.2	79%	0.791	63%	0.63	S	S	*	*	H	α-helix	trans	-73.3	-37.3	178.4	-87.4	-173.3	174	-178.1	0	113.4	C1057 S1058	K1055-C1057 VanDerWaalsContact C-N 3.33Å; K1055-C1057 PolarHBondContact O-N 2.96Å; K1055-S1058 PolarHBondContact O-N 3Å
1056	Y	36.3	Very low	47.3	Very low	208 Å²	208	117 Å²	117	82%	0.816	63%	0.625	S	S	*	*	H	α-helix	trans	-67.1	-30.5	-177	-104.8	-86.6	0	0	0	113.6
1057	C	41.9	Very low	49.8	Very low	84 Å²	84	118 Å²	118	57%	0.568	61%	0.612	S	S	*	*	H	α-helix	trans	-80.9	-19.3	-179.1	-155.1	0	0	0	0	113.7	K1055	K1055-C1057 VanDerWaalsContact C-N 3.33Å; K1055-C1057 PolarHBondContact O-N 2.96Å
1058	S	47.1	Very low	52.4	Low	65 Å²	65	111 Å²	111	46%	0.455	57%	0.574	S	S	.	*	H	α-helix	trans	-74.6	-40.4	178.7	-165.3	0	0	0	0	112.1	K1055 K1060 K1061	K1055-S1058 PolarHBondContact O-N 3Å; S1058-K1060 PolarHBondContact O-N 3.42Å; S1058-K1061 WeakPolarHBondContact O-CB 3.39Å; S1058-K1061 PolarHBondContact O-N 3.24Å; S1058-K1061 VanDerWaalsContact O-N 3.15Å
1059	S	51	Low	55	Low	82 Å²	82	110.3 Å²	110.3	57%	0.573	56%	0.556	S	S	*	*	H	α-helix	trans	-59.8	-45.2	-177.5	169.3	0	0	0	0	112.5	K1061 D1062 E1063	S1059-K1061 VanDerWaalsContact C-N 3.27Å; S1059-K1061 PolarHBondContact O-N 3.43Å; S1059-D1062 PolarHBondContact O-N 3.5Å; S1059-E1063 PolarHBondContact O-N 3.03Å
1060	K	56.6	Low	57.7	Low	153 Å²	153	110 Å²	110	67%	0.665	54%	0.542	S	S	*	.	H	α-helix	trans	-62.3	-29.5	177.1	-77.2	-170.7	173.3	-175.3	0	113.9	S1058 N1064	S1058-K1060 PolarHBondContact O-N 3.42Å; K1060-N1064 PolarHBondContact O-N 2.96Å
1061	K	58.2	Low	60.3	Low	72 Å²	72	105 Å²	105	31%	0.313	51%	0.51	S	S	.	.	H	α-helix	trans	-67.4	-44	179.7	-73.1	-178.7	179.8	-179.2	0	111.8	S1058 S1059 E1063 K1065	S1058-K1061 WeakPolarHBondContact O-CB 3.39Å; S1058-K1061 PolarHBondContact O-N 3.24Å; S1058-K1061 VanDerWaalsContact O-N 3.15Å; S1059-K1061 VanDerWaalsContact C-N 3.27Å; S1059-K1061 PolarHBondContact O-N 3.43Å; K1061-E1063 VanDerWaalsContact C-N 3.34Å; K1061-K1065 PolarHBondContact O-N 3.17Å
1062	D	65.3	Low	62.9	Low	86 Å²	86	95.7 Å²	95.7	46%	0.46	47%	0.47	S	S	.	.	H	α-helix	trans	-72	-33	-178.8	-71.9	-28	0	0	0	111.4	S1059 R1066	S1059-D1062 PolarHBondContact O-N 3.5Å; D1062-R1066 WeakPolarHBondContact O-CB 3.28Å; D1062-R1066 VanDerWaalsContact O-CG 3.22Å; D1062-R1066 WeakPolarHBondContact O-CG 3.46Å; D1062-R1066 PolarHBondContact O-N 3.48Å
1063	E	75.7	Confident	65.3	Low	90 Å²	90	98.5 Å²	98.5	42%	0.421	47%	0.467	S	S	.	.	H	α-helix	trans	-63	-49.9	175.3	-161	-168.2	151.1	0	0	112.1	S1059 K1061 K1065 R1066 K1067	S1059-E1063 PolarHBondContact O-N 3.03Å; K1061-E1063 VanDerWaalsContact C-N 3.34Å; E1063-K1065 VanDerWaalsContact C-N 3.35Å; E1063-K1065 PolarHBondContact O-N 2.84Å; E1063-R1066 PolarHBondContact O-N 3.21Å; E1063-K1067 WeakPolarHBondContact O-CG 3.45Å; E1063-K1067 PolarHBondContact O-N 3.19Å; E1063-K1067 WeakPolarHBondContact OE1-CE 3.43Å; E1063-K1067 IonicContact OE1-NZ 3.14Å; E1063-K1067 PolarHBondContact OE1-NZ 3.31Å
1064	N	76.2	Confident	67.9	Low	61 Å²	61	95.1 Å²	95.1	33%	0.326	44%	0.441	S	S	.	.	H	α-helix	trans	-62.6	-40.7	178.7	-80.9	-0.1	0	0	0	112.2	K1060 R1066 K1067 I1068	K1060-N1064 PolarHBondContact O-N 2.96Å; N1064-R1066 VanDerWaalsContact C-N 3.35Å; N1064-R1066 PolarHBondContact O-N 2.92Å; N1064-K1067 PolarHBondContact O-N 2.91Å; N1064-I1068 WeakPolarHBondContact O-CG1 3.28Å; N1064-I1068 PolarHBondContact O-N 3.38Å
1065	K	78.5	Confident	70.5	Confident	56 Å²	56	89.8 Å²	89.8	24%	0.243	41%	0.408	C	S	.	.	H	α-helix	trans	-64.1	-39.1	175.9	-76.3	-174	175.4	-165.7	0	112.4	K1061 E1063 R1069	K1061-K1065 PolarHBondContact O-N 3.17Å; E1063-K1065 VanDerWaalsContact C-N 3.35Å; E1063-K1065 PolarHBondContact O-N 2.84Å; K1065-R1069 WeakPolarHBondContact O-CG 3.08Å; K1065-R1069 PolarHBondContact O-N 3.08Å
1066	R	79.9	Confident	72.8	Confident	188 Å²	188	82.5 Å²	82.5	71%	0.709	38%	0.38	S	S	*	.	H	α-helix	trans	-64.2	-44	174.6	-74.5	172.9	-174.2	-171.5	1.1	111	D1062 E1063 N1064 R1069 R1070	D1062-R1066 WeakPolarHBondContact O-CB 3.28Å; D1062-R1066 VanDerWaalsContact O-CG 3.22Å; D1062-R1066 WeakPolarHBondContact O-CG 3.46Å; D1062-R1066 PolarHBondContact O-N 3.48Å; E1063-R1066 PolarHBondContact O-N 3.21Å; N1064-R1066 VanDerWaalsContact C-N 3.35Å; N1064-R1066 PolarHBondContact O-N 2.92Å; R1066-R1069 PolarHBondContact O-N 3.39Å; R1066-R1070 WeakPolarHBondContact O-CB 3.42Å; R1066-R1070 PolarHBondContact O-N 3.48Å
1067	K	82.1	Confident	75.2	Confident	85 Å²	85	79.2 Å²	79.2	37%	0.37	37%	0.372	S	S	.	.	H	α-helix	trans	-59.5	-49.1	175.8	-73.7	179.6	-177.2	171.4	0	112.2	E1063 N1064 R1069 R1070 L1071	E1063-K1067 WeakPolarHBondContact O-CG 3.45Å; E1063-K1067 PolarHBondContact O-N 3.19Å; E1063-K1067 WeakPolarHBondContact OE1-CE 3.43Å; E1063-K1067 IonicContact OE1-NZ 3.14Å; E1063-K1067 PolarHBondContact OE1-NZ 3.31Å; N1064-K1067 PolarHBondContact O-N 2.91Å; K1067-R1069 PolarHBondContact O-N 2.66Å; K1067-R1070 PolarHBondContact O-N 3.39Å; K1067-L1071 WeakPolarHBondContact O-CG 3.5Å; K1067-L1071 PolarHBondContact O-N 2.82Å
1068	I	84.4	Confident	77.5	Confident	7 Å²	7	77 Å²	77	4%	0.036	36%	0.357	C	S	.	.	H	α-helix	trans	-55.8	-50.9	176	-72.8	169.3	0	0	0	110.6	L1019 E1023 E1026 N1064 R1070 L1071 Q1072	L1019-I1068 HydrophobicContact CD1-CG2 4.08Å; E1023-I1068 HydrophobicContact CG-CG2 4.03Å; E1023-I1068 WeakPolarHBondContact OE1-CG2 3.19Å; E1026-I1068 HydrophobicContact CB-CD1 4.2Å; E1026-I1068 HydrophobicContact CG-CD1 4.37Å; N1064-I1068 WeakPolarHBondContact O-CG1 3.28Å; N1064-I1068 PolarHBondContact O-N 3.38Å; I1068-R1070 VanDerWaalsContact C-N 3.33Å; I1068-R1070 PolarHBondContact O-N 3.16Å; I1068-L1071 PolarHBondContact O-N 2.91Å; I1068-Q1072 HydrophobicContact CG2-CG 4.31Å; I1068-Q1072 WeakPolarHBondContact O-CB 3.38Å; I1068-Q1072 WeakPolarHBondContact O-CG 3.48Å; I1068-Q1072 PolarHBondContact O-N 2.67Å
1069	R	84.5	Confident	79.5	Confident	125 Å²	125	74 Å²	74	47%	0.472	34%	0.337	S	S	.	.	H	α-helix	trans	-62.1	-38.4	179.8	-72.5	176.9	-177	-173.1	-2.2	112.9	K1065 R1066 K1067 R1073	K1065-R1069 WeakPolarHBondContact O-CG 3.08Å; K1065-R1069 PolarHBondContact O-N 3.08Å; R1066-R1069 PolarHBondContact O-N 3.39Å; K1067-R1069 PolarHBondContact O-N 2.66Å; R1069-R1073 WeakPolarHBondContact O-CG 3.49Å; R1069-R1073 PolarHBondContact O-N 3.32Å; R1069-R1073 VanDerWaalsContact O-N 3.13Å
1070	R	86.2	Confident	81.3	Confident	110 Å²	110	71.3 Å²	71.3	42%	0.415	32%	0.319	S	S	.	.	H	α-helix	trans	-63.2	-50.2	176.1	-172.2	179.4	178.8	167.9	6	110.2	R1066 K1067 I1068 Q1072 R1073 I1074 D1217	R1066-R1070 WeakPolarHBondContact O-CB 3.42Å; R1066-R1070 PolarHBondContact O-N 3.48Å; K1067-R1070 PolarHBondContact O-N 3.39Å; I1068-R1070 VanDerWaalsContact C-N 3.33Å; I1068-R1070 PolarHBondContact O-N 3.16Å; R1070-Q1072 VanDerWaalsContact C-N 3.34Å; R1070-Q1072 PolarHBondContact O-N 2.83Å; R1070-R1073 PolarHBondContact O-N 2.86Å; R1070-I1074 HydrophobicContact CG-CD1 3.81Å; R1070-I1074 WeakPolarHBondContact O-CD1 3.4Å; R1070-I1074 VanDerWaalsContact O-CG1 3.28Å; R1070-I1074 WeakPolarHBondContact O-CG1 3.43Å; R1070-I1074 PolarHBondContact O-N 2.81Å; R1070-D1217 IonicContact CZ-OD1 3.83Å; R1070-D1217 IonicContact NH2-OD1 3.68Å; R1070-D1217 PolarHBondContact NH2-OD1 2.74Å
1071	L	85.9	Confident	82.7	Confident	16 Å²	16	66.3 Å²	66.3	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-40.7	177.8	-71.6	172.8	0	0	0	112.5	T1015 L1019 Y1022 K1067 I1068 I1074 L1075 L1211	T1015-L1071 HydrophobicContact CG2-CD2 4.33Å; L1019-L1071 HydrophobicContact CD1-CB 4.1Å; Y1022-L1071 HydrophobicContact CD2-CD1 4.02Å; Y1022-L1071 HydrophobicContact CE2-CD1 4.3Å; K1067-L1071 WeakPolarHBondContact O-CG 3.5Å; K1067-L1071 PolarHBondContact O-N 2.82Å; I1068-L1071 PolarHBondContact O-N 2.91Å; L1071-I1074 PolarHBondContact O-N 2.81Å; L1071-L1075 VanDerWaalsContact O-CB 3.24Å; L1071-L1075 WeakPolarHBondContact O-CB 3.36Å; L1071-L1075 PolarHBondContact O-N 2.81Å; L1071-L1211 HydrophobicContact CD2-CD1 3.84Å
1072	Q	87.3	Confident	84.3	Confident	9 Å²	9	63.6 Å²	63.6	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-58.5	-49.4	175.8	-75.4	176.9	-23.8	0	0	112.1	L583 L1019 E1023 I1068 R1070 L1075 S1076	L583-Q1072 WeakPolarHBondContact O-CG 3.36Å; L1019-Q1072 HydrophobicContact CD1-CG 3.76Å; L1019-Q1072 HydrophobicContact CD2-CG 3.8Å; L1019-Q1072 HydrophobicContact CG-CG 4.42Å; E1023-Q1072 PolarHBondContact OE1-NE2 2.7Å; I1068-Q1072 HydrophobicContact CG2-CG 4.31Å; I1068-Q1072 WeakPolarHBondContact O-CB 3.38Å; I1068-Q1072 WeakPolarHBondContact O-CG 3.48Å; I1068-Q1072 PolarHBondContact O-N 2.67Å; R1070-Q1072 VanDerWaalsContact C-N 3.34Å; R1070-Q1072 PolarHBondContact O-N 2.83Å; Q1072-L1075 PolarHBondContact O-N 3.09Å; Q1072-S1076 WeakPolarHBondContact O-CB 3.36Å; Q1072-S1076 PolarHBondContact O-N 3.05Å; Q1072-S1076 PolarHBondContact O-OG 3.25Å
1073	R	86.3	Confident	85.3	Confident	177 Å²	177	60.3 Å²	60.3	67%	0.668	28%	0.277	S	S	*	.	H	α-helix	trans	-64.2	-42.1	-179.9	-73.9	176.6	-180	172.4	-3.2	112.1	R1069 R1070 S1076 H1077	R1069-R1073 WeakPolarHBondContact O-CG 3.49Å; R1069-R1073 PolarHBondContact O-N 3.32Å; R1069-R1073 VanDerWaalsContact O-N 3.13Å; R1070-R1073 PolarHBondContact O-N 2.86Å; R1073-S1076 PolarHBondContact O-OG 3.36Å; R1073-H1077 PolarHBondContact O-N 3.36Å; R1073-H1077 VanDerWaalsContact O-N 3.16Å; R1073-H1077 PolarHBondContact O-ND1 2.96Å
1074	I	88.5	Confident	85.7	Confident	29 Å²	29	59.7 Å²	59.7	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-52	177.3	-71	164.3	0	0	0	109.3	W1011 R1070 L1071 S1076 H1077 S1078 Y1220	W1011-I1074 HydrophobicContact CH2-CG2 3.43Å; W1011-I1074 VanDerWaalsContact CH2-CG2 3.43Å; W1011-I1074 HydrophobicContact CZ2-CG2 3.81Å; R1070-I1074 HydrophobicContact CG-CD1 3.81Å; R1070-I1074 WeakPolarHBondContact O-CD1 3.4Å; R1070-I1074 VanDerWaalsContact O-CG1 3.28Å; R1070-I1074 WeakPolarHBondContact O-CG1 3.43Å; R1070-I1074 PolarHBondContact O-N 2.81Å; L1071-I1074 PolarHBondContact O-N 2.81Å; I1074-S1076 PolarHBondContact O-N 2.79Å; I1074-H1077 PolarHBondContact O-N 3.38Å; I1074-S1078 WeakPolarHBondContact O-CB 3.37Å; I1074-S1078 PolarHBondContact O-N 3.11Å; I1074-S1078 PolarHBondContact O-OG 3.27Å; I1074-S1078 VanDerWaalsContact O-OG 3.04Å; I1074-Y1220 HydrophobicContact CD1-CE1 4.34Å; I1074-Y1220 VanDerWaalsContact CD1-OH 3.27Å; I1074-Y1220 WeakPolarHBondContact CD1-OH 3.42Å
1075	L	90	Very high	85.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.6	-43	-177.9	-177.4	62.2	0	0	0	112.1	L584 L1012 T1015 T1016 L1019 L1071 Q1072 L1079	L584-L1075 HydrophobicContact CD2-CD2 3.73Å; L584-L1075 HydrophobicContact CD2-CG 3.99Å; L1012-L1075 HydrophobicContact CD2-CD1 3.96Å; T1015-L1075 HydrophobicContact CG2-CB 4.26Å; T1015-L1075 HydrophobicContact CG2-CD1 4.24Å; T1016-L1075 HydrophobicContact CG2-CD2 4.48Å; T1016-L1075 WeakPolarHBondContact OG1-CD1 3.26Å; L1019-L1075 HydrophobicContact CD2-CD2 3.79Å; L1071-L1075 VanDerWaalsContact O-CB 3.24Å; L1071-L1075 WeakPolarHBondContact O-CB 3.36Å; L1071-L1075 PolarHBondContact O-N 2.81Å; Q1072-L1075 PolarHBondContact O-N 3.09Å; L1075-L1079 HydrophobicContact CD1-CD1 3.86Å; L1075-L1079 HydrophobicContact CD1-CG 3.98Å; L1075-L1079 HydrophobicContact CD2-CD1 4.48Å; L1075-L1079 HydrophobicContact CG-CD1 3.78Å; L1075-L1079 HydrophobicContact CG-CG 4.32Å; L1075-L1079 VanDerWaalsContact O-CB 3.26Å; L1075-L1079 WeakPolarHBondContact O-CB 3.25Å; L1075-L1079 VanDerWaalsContact O-CG 3.26Å; L1075-L1079 WeakPolarHBondContact O-CG 3.38Å; L1075-L1079 PolarHBondContact O-N 3.44Å
1076	S	87.4	Confident	85.8	Confident	29 Å²	29	61.8 Å²	61.8	20%	0.203	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-45.7	-179.7	67.6	0	0	0	0	112.3	Q1072 R1073 I1074 A1080	Q1072-S1076 WeakPolarHBondContact O-CB 3.36Å; Q1072-S1076 PolarHBondContact O-N 3.05Å; Q1072-S1076 PolarHBondContact O-OG 3.25Å; R1073-S1076 PolarHBondContact O-OG 3.36Å; I1074-S1076 PolarHBondContact O-N 2.79Å; S1076-A1080 WeakPolarHBondContact O-CB 3.36Å; S1076-A1080 PolarHBondContact O-N 2.95Å
1077	H	87.2	Confident	85.8	Confident	139 Å²	139	53.6 Å²	53.6	64%	0.644	28%	0.283	S	S	*	.	H	α-helix	trans	-65.1	-45.8	178.1	-78.1	81.4	0	0	0	111.3	R1073 I1074 A1080 A1081	R1073-H1077 PolarHBondContact O-N 3.36Å; R1073-H1077 VanDerWaalsContact O-N 3.16Å; R1073-H1077 PolarHBondContact O-ND1 2.96Å; I1074-H1077 PolarHBondContact O-N 3.38Å; H1077-A1080 PolarHBondContact O-N 2.84Å; H1077-A1081 WeakPolarHBondContact O-CB 3.33Å; H1077-A1081 PolarHBondContact O-N 2.92Å
1078	S	89.1	Confident	85.6	Confident	37 Å²	37	49.7 Å²	49.7	26%	0.259	27%	0.266	S	S	.	.	H	α-helix	trans	-67.9	-36.3	-179.6	-59.7	0	0	0	0	112.8	W1011 I1074 F1082	W1011-S1078 WeakPolarHBondContact CH2-OG 3.47Å; W1011-S1078 VanDerWaalsContact CZ3-CB 3.5Å; W1011-S1078 WeakPolarHBondContact CZ3-OG 3.36Å; I1074-S1078 WeakPolarHBondContact O-CB 3.37Å; I1074-S1078 PolarHBondContact O-N 3.11Å; I1074-S1078 PolarHBondContact O-OG 3.27Å; I1074-S1078 VanDerWaalsContact O-OG 3.04Å; S1078-F1082 WeakPolarHBondContact O-CB 3.22Å; S1078-F1082 PolarHBondContact O-N 2.86Å
1079	L	90.3	Very high	85.7	Confident	4 Å²	4	50 Å²	50	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-65.1	-46.3	172.7	-78.8	170.7	0	0	0	111.3	L584 L819 L972 L1012 L1075 A1081 F1082 L1083	L584-L1079 HydrophobicContact CD1-CD1 4.03Å; L584-L1079 HydrophobicContact CD2-CD1 3.96Å; L819-L1079 HydrophobicContact CD1-CB 3.72Å; L819-L1079 HydrophobicContact CD1-CD1 3.83Å; L819-L1079 HydrophobicContact CD1-CG 4.43Å; L972-L1079 HydrophobicContact CD1-CD2 3.99Å; L972-L1079 HydrophobicContact CD2-CD2 4.04Å; L1012-L1079 HydrophobicContact CD1-CD2 4.06Å; L1012-L1079 HydrophobicContact CD2-CD2 4Å; L1012-L1079 HydrophobicContact CD2-CG 4.01Å; L1012-L1079 HydrophobicContact CG-CD2 4.46Å; L1075-L1079 HydrophobicContact CD1-CD1 3.86Å; L1075-L1079 HydrophobicContact CD1-CG 3.98Å; L1075-L1079 HydrophobicContact CD2-CD1 4.48Å; L1075-L1079 HydrophobicContact CG-CD1 3.78Å; L1075-L1079 HydrophobicContact CG-CG 4.32Å; L1075-L1079 VanDerWaalsContact O-CB 3.26Å; L1075-L1079 WeakPolarHBondContact O-CB 3.25Å; L1075-L1079 VanDerWaalsContact O-CG 3.26Å; L1075-L1079 WeakPolarHBondContact O-CG 3.38Å; L1075-L1079 PolarHBondContact O-N 3.44Å; L1079-A1081 VanDerWaalsContact C-N 3.35Å; L1079-A1081 PolarHBondContact O-N 2.86Å; L1079-F1082 PolarHBondContact O-N 2.79Å; L1079-L1083 WeakPolarHBondContact O-CB 3.19Å; L1079-L1083 WeakPolarHBondContact O-CD1 3.47Å; L1079-L1083 WeakPolarHBondContact O-CG 3.39Å; L1079-L1083 PolarHBondContact O-N 2.87Å
1080	A	87.3	Confident	85.8	Confident	24 Å²	24	44.2 Å²	44.2	20%	0.198	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-45.1	178.3	0	0	0	0	0	111.5	A815 S1076 H1077 L1083 A1084	A815-A1080 HydrophobicContact CB-CB 4.43Å; S1076-A1080 WeakPolarHBondContact O-CB 3.36Å; S1076-A1080 PolarHBondContact O-N 2.95Å; H1077-A1080 PolarHBondContact O-N 2.84Å; A1080-L1083 PolarHBondContact O-N 2.82Å; A1080-A1084 WeakPolarHBondContact O-CB 3.17Å; A1080-A1084 PolarHBondContact O-N 3.34Å
1081	A	87.5	Confident	86.1	Confident	49 Å²	49	39.2 Å²	39.2	41%	0.405	23%	0.232	S	C	.	.	H	α-helix	trans	-62.3	-44.3	175.4	0	0	0	0	0	112	H1077 L1079 L1083 A1084 G1085	H1077-A1081 WeakPolarHBondContact O-CB 3.33Å; H1077-A1081 PolarHBondContact O-N 2.92Å; L1079-A1081 VanDerWaalsContact C-N 3.35Å; L1079-A1081 PolarHBondContact O-N 2.86Å; A1081-L1083 VanDerWaalsContact C-N 3.33Å; A1081-L1083 PolarHBondContact O-N 3.4Å; A1081-A1084 PolarHBondContact O-N 3.02Å; A1081-G1085 PolarHBondContact O-N 3.05Å
1082	F	90.1	Very high	86.3	Confident	15 Å²	15	39.4 Å²	39.4	7%	0.066	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-39.4	177.4	179.9	-106.3	0	0	0	112.4	P968 L971 L972 A1005 T1008 T1009 L1012 S1078 L1079 P1087	P968-F1082 HydrophobicContact CB-CD1 4.44Å; P968-F1082 HydrophobicContact CB-CE1 3.92Å; L971-F1082 HydrophobicContact CD1-CZ 4.07Å; L972-F1082 HydrophobicContact CG-CE1 4.36Å; A1005-F1082 HydrophobicContact CB-CE2 4.42Å; T1008-F1082 HydrophobicContact CG2-CD2 3.67Å; T1008-F1082 HydrophobicContact CG2-CE2 4.2Å; T1008-F1082 HydrophobicContact CG2-CG 4.42Å; T1009-F1082 WeakPolarHBondContact OG1-CZ 3.27Å; L1012-F1082 HydrophobicContact CD1-CB 3.94Å; L1012-F1082 HydrophobicContact CD1-CD1 3.88Å; L1012-F1082 HydrophobicContact CD1-CD2 4.17Å; L1012-F1082 HydrophobicContact CD1-CE1 4.41Å; L1012-F1082 HydrophobicContact CD1-CG 3.73Å; S1078-F1082 WeakPolarHBondContact O-CB 3.22Å; S1078-F1082 PolarHBondContact O-N 2.86Å; L1079-F1082 PolarHBondContact O-N 2.79Å; F1082-P1087 HydrophobicContact CD1-CG 4.36Å; F1082-P1087 HydrophobicContact CD2-CB 3.89Å; F1082-P1087 HydrophobicContact CD2-CG 4.2Å; F1082-P1087 HydrophobicContact CE1-CB 4.48Å; F1082-P1087 HydrophobicContact CE1-CG 3.95Å; F1082-P1087 HydrophobicContact CE2-CB 3.39Å; F1082-P1087 HydrophobicContact CE2-CG 3.78Å; F1082-P1087 HydrophobicContact CG-CG 4.48Å; F1082-P1087 HydrophobicContact CZ-CB 3.73Å; F1082-P1087 HydrophobicContact CZ-CG 3.64Å; F1082-P1087 VanDerWaalsContact O-CD 3.25Å; F1082-P1087 WeakPolarHBondContact O-CD 3.5Å; F1082-P1087 WeakPolarHBondContact O-CG 3.5Å
1083	L	86.8	Confident	86.5	Confident	17 Å²	17	40.5 Å²	40.5	9%	0.089	24%	0.24	C	C	.	.	H	α-helix	trans	-74.2	-36.7	178.6	-65.8	163.2	0	0	0	112.4	Q818 V822 P965 P968 L1079 A1080 A1081	Q818-L1083 HydrophobicContact CB-CB 4.21Å; Q818-L1083 HydrophobicContact CB-CD1 3.88Å; V822-L1083 HydrophobicContact CB-CD1 4.46Å; V822-L1083 HydrophobicContact CG2-CD1 3.45Å; V822-L1083 VanDerWaalsContact CG2-CD1 3.45Å; V822-L1083 HydrophobicContact CG2-CD2 3.72Å; V822-L1083 HydrophobicContact CG2-CG 4.16Å; P965-L1083 HydrophobicContact CG-CD2 4.36Å; P968-L1083 HydrophobicContact CB-CD2 3.64Å; P968-L1083 HydrophobicContact CG-CD2 4.32Å; L1079-L1083 WeakPolarHBondContact O-CB 3.19Å; L1079-L1083 WeakPolarHBondContact O-CD1 3.47Å; L1079-L1083 WeakPolarHBondContact O-CG 3.39Å; L1079-L1083 PolarHBondContact O-N 2.87Å; A1080-L1083 PolarHBondContact O-N 2.82Å; A1081-L1083 VanDerWaalsContact C-N 3.33Å; A1081-L1083 PolarHBondContact O-N 3.4Å
1084	A	84	Confident	86.7	Confident	76 Å²	76	36.8 Å²	36.8	63%	0.628	23%	0.229	S	C	*	.	H	α-helix	trans	-72.6	-33.7	178.6	0	0	0	0	0	112.5	A1080 A1081 Q1086	A1080-A1084 WeakPolarHBondContact O-CB 3.17Å; A1080-A1084 PolarHBondContact O-N 3.34Å; A1081-A1084 PolarHBondContact O-N 3.02Å; A1084-Q1086 PolarHBondContact O-N 3.23Å
1085	G	79.7	Confident	86.8	Confident	59 Å²	59	38.6 Å²	38.6	61%	0.608	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	7.1	-174.4	0	0	0	0	0	116.4	A1081	A1081-G1085 PolarHBondContact O-N 3.05Å
1086	Q	78.4	Confident	86.7	Confident	103 Å²	103	39.1 Å²	39.1	48%	0.481	24%	0.236	S	C	.	.			trans	45.7	66.6	-178.4	-65.6	-178.5	-22.2	0	0	112.4	A1084 G1088 G1089	A1084-Q1086 PolarHBondContact O-N 3.23Å; Q1086-G1088 PolarHBondContact O-N 2.65Å; Q1086-G1089 PolarHBondContact O-N 3.01Å
1087	P	79.3	Confident	86.6	Confident	16 Å²	16	42.5 Å²	42.5	10%	0.104	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	133.9	-166.3	28.6	-32.8	0	0	0	110.5	L967 P968 A1005 F1082	L967-P1087 WeakPolarHBondContact CD2-O 2.94Å; P968-P1087 HydrophobicContact CB-CG 4.27Å; P968-P1087 HydrophobicContact CG-CG 3.71Å; A1005-P1087 HydrophobicContact CB-CB 3.88Å; F1082-P1087 HydrophobicContact CD1-CG 4.36Å; F1082-P1087 HydrophobicContact CD2-CB 3.89Å; F1082-P1087 HydrophobicContact CD2-CG 4.2Å; F1082-P1087 HydrophobicContact CE1-CB 4.48Å; F1082-P1087 HydrophobicContact CE1-CG 3.95Å; F1082-P1087 HydrophobicContact CE2-CB 3.39Å; F1082-P1087 HydrophobicContact CE2-CG 3.78Å; F1082-P1087 HydrophobicContact CG-CG 4.48Å; F1082-P1087 HydrophobicContact CZ-CB 3.73Å; F1082-P1087 HydrophobicContact CZ-CG 3.64Å; F1082-P1087 VanDerWaalsContact O-CD 3.25Å; F1082-P1087 WeakPolarHBondContact O-CD 3.5Å; F1082-P1087 WeakPolarHBondContact O-CG 3.5Å
1088	G	77.4	Confident	86.1	Confident	2 Å²	2	39.7 Å²	39.7	2%	0.021	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	-3	179.8	0	0	0	0	0	115.7	L996 Q1086	L996-G1088 VanDerWaalsContact CD2-O 3.3Å; L996-G1088 WeakPolarHBondContact CD2-O 3.44Å; Q1086-G1088 PolarHBondContact O-N 2.65Å
1089	G	85.9	Confident	85.6	Confident	14 Å²	14	41.3 Å²	41.3	14%	0.144	27%	0.268	C	S	.	.	S	Bend	trans	72.4	-149.2	178.3	0	0	0	0	0	113	Y940 Q1086 Y1091	Y940-G1089 VanDerWaalsContact CD1-C 3.45Å; Q1086-G1089 PolarHBondContact O-N 3.01Å; G1089-Y1091 VanDerWaalsContact O-CD1 3.32Å; G1089-Y1091 WeakPolarHBondContact O-CD1 3.18Å
1090	A	87.2	Confident	85.2	Confident	4 Å²	4	43.6 Å²	43.6	3%	0.033	28%	0.28	C	S	.	.	S	Bend	trans	-78.4	130	176.9	0	0	0	0	0	110.3	L934 Y940 L997	L934-A1090 HydrophobicContact CD1-CB 4.29Å; L934-A1090 HydrophobicContact CD2-CB 3.74Å; Y940-A1090 HydrophobicContact CD1-CB 3.94Å; Y940-A1090 HydrophobicContact CE1-CB 3.55Å; Y940-A1090 HydrophobicContact CE2-CB 4.18Å; Y940-A1090 HydrophobicContact CG-CB 4.39Å; L997-A1090 HydrophobicContact CD1-CB 4.02Å; L997-A1090 PolarHBondContact N-O 3.38Å; L997-A1090 VanDerWaalsContact N-O 3.12Å
1091	Y	92	Very high	84.8	Confident	5 Å²	5	44.4 Å²	44.4	2%	0.02	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	161.5	-179.6	60.8	-86.9	0	0	0	111.1	F938 A939 H942 A966 L967 V994 R995 G1089 I1093	F938-Y1091 WeakPolarHBondContact CA-O 3.42Å; F938-Y1091 VanDerWaalsContact CD1-C 3.47Å; A939-Y1091 PolarHBondContact N-O 3.03Å; A939-Y1091 PolarHBondContact O-N 2.95Å; H942-Y1091 HydrophobicContact CB-CE2 3.68Å; H942-Y1091 AromaticContact CD2-CD2 3.71Å; H942-Y1091 AromaticContact CD2-CE2 3.49Å; H942-Y1091 VanDerWaalsContact CD2-CE2 3.49Å; H942-Y1091 WeakPolarHBondContact CD2-CE2 3.41Å; H942-Y1091 PolarHBondContact CD2-O 3.4Å; H942-Y1091 AromaticContact CG-CE2 3.92Å; H942-Y1091 PolarHBondContact NE2-O 3.08Å; A966-Y1091 HydrophobicContact CB-CE2 4.33Å; L967-Y1091 HydrophobicContact CB-CD1 4.27Å; L967-Y1091 HydrophobicContact CB-CD2 4.42Å; L967-Y1091 HydrophobicContact CB-CE1 3.74Å; L967-Y1091 HydrophobicContact CB-CE2 3.87Å; L967-Y1091 VanDerWaalsContact CB-CZ 3.5Å; L967-Y1091 HydrophobicContact CD2-CD1 3.63Å; L967-Y1091 HydrophobicContact CD2-CE1 3.81Å; L967-Y1091 HydrophobicContact CD2-CG 4.08Å; L967-Y1091 HydrophobicContact CG-CE1 4.46Å; L967-Y1091 PolarHBondContact N-OH 3.17Å; V994-Y1091 HydrophobicContact CG1-CD2 3.7Å; V994-Y1091 HydrophobicContact CG1-CG 4.01Å; R995-Y1091 CarbonylContact O-C 3.58Å; R995-Y1091 WeakPolarHBondContact O-CA 3.48Å; R995-Y1091 WeakPolarHBondContact O-CB 3.4Å; G1089-Y1091 VanDerWaalsContact O-CD1 3.32Å; G1089-Y1091 WeakPolarHBondContact O-CD1 3.18Å; Y1091-I1093 HydrophobicContact CD2-CD1 4.13Å; Y1091-I1093 HydrophobicContact CD2-CG1 3.68Å; Y1091-I1093 HydrophobicContact CE2-CD1 3.63Å; Y1091-I1093 HydrophobicContact CE2-CG1 3.67Å
1092	S	90.9	Very high	84.3	Confident	19 Å²	19	50.7 Å²	50.7	13%	0.133	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	148.9	167.5	61.6	0	0	0	0	109.7	G937 F938 V994 R995	G937-S1092 VanDerWaalsContact O-CB 3.29Å; G937-S1092 WeakPolarHBondContact O-CB 3.42Å; F938-S1092 WeakPolarHBondContact CZ-OG 3.42Å; V994-S1092 VanDerWaalsContact CA-O 3.32Å; V994-S1092 WeakPolarHBondContact CA-O 3.16Å; R995-S1092 PolarHBondContact N-O 3.47Å; R995-S1092 PolarHBondContact O-N 2.93Å
1093	I	91.7	Very high	83.6	Confident	33 Å²	33	57.8 Å²	57.8	17%	0.169	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.2	176.5	-57.8	-163.4	0	0	0	110	I834 H942 A966 L970 L992 E993 V994 Y1091	I834-I1093 HydrophobicContact CD1-CB 4.41Å; I834-I1093 HydrophobicContact CD1-CG2 3.44Å; I834-I1093 VanDerWaalsContact CD1-CG2 3.44Å; H942-I1093 HydrophobicContact CB-CD1 4.31Å; A966-I1093 HydrophobicContact CB-CD1 3.34Å; L970-I1093 HydrophobicContact CD1-CD1 4.28Å; L992-I1093 HydrophobicContact CD2-CG2 4.4Å; E993-I1093 WeakPolarHBondContact O-CA 3.35Å; V994-I1093 HydrophobicContact CG1-CG1 4.43Å; V994-I1093 HydrophobicContact CG2-CD1 4.09Å; V994-I1093 HydrophobicContact CG2-CG1 3.94Å; Y1091-I1093 HydrophobicContact CD2-CD1 4.13Å; Y1091-I1093 HydrophobicContact CD2-CG1 3.68Å; Y1091-I1093 HydrophobicContact CE2-CD1 3.63Å; Y1091-I1093 HydrophobicContact CE2-CG1 3.67Å
1094	K	89.7	Confident	83.2	Confident	99 Å²	99	57.2 Å²	57.2	43%	0.43	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139	174.9	-177	-177.4	170.1	-164.8	0	110.6	E993	E993-K1094 HydrophobicContact CB-CB 4.49Å; E993-K1094 PolarHBondContact N-O 2.77Å; E993-K1094 PolarHBondContact O-N 2.87Å
1095	R	90.7	Very high	83.1	Confident	67 Å²	67	55 Å²	55	25%	0.253	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	126.6	166.7	178.7	-174.9	174.2	-157	0.9	109.6	I834 H859 W991	I834-R1095 HydrophobicContact CG2-CB 4.37Å; H859-R1095 PolarHBondContact CE1-NH1 3.06Å; H859-R1095 PolarHBondContact ND1-NH1 3.27Å; W991-R1095 HydrophobicContact CE3-CG 4.45Å
1096	L	88.2	Confident	82.7	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.052	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-82.2	136.6	172.8	-63.6	172.6	0	0	0	110.9	V987 W991 E993 D1100 V1101 L1104	V987-L1096 HydrophobicContact CB-CD1 4.47Å; V987-L1096 HydrophobicContact CG1-CD1 3.59Å; V987-L1096 HydrophobicContact CG2-CD1 4.03Å; W991-L1096 PolarHBondContact O-N 3.19Å; E993-L1096 HydrophobicContact CB-CD1 4.1Å; E993-L1096 HydrophobicContact CB-CD2 3.79Å; E993-L1096 HydrophobicContact CB-CG 3.85Å; L1096-D1100 HydrophobicContact CB-CB 4.33Å; L1096-D1100 HydrophobicContact CD2-CB 3.81Å; L1096-V1101 HydrophobicContact CB-CG2 4.25Å; L1096-L1104 HydrophobicContact CD1-CD2 4.05Å
1097	L	84.5	Confident	82	Confident	100 Å²	100	56 Å²	56	52%	0.524	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-93.6	163.1	171.2	-59.4	177.4	0	0	0	110.2	A1099 D1100 V1101	L1097-A1099 PolarHBondContact O-N 3.33Å; L1097-A1099 VanDerWaalsContact O-N 3.07Å; L1097-D1100 WeakPolarHBondContact CB-OD2 3.47Å; L1097-D1100 PolarHBondContact N-OD2 3.15Å; L1097-D1100 WeakPolarHBondContact O-CB 3.22Å; L1097-D1100 PolarHBondContact O-N 2.99Å; L1097-V1101 PolarHBondContact O-N 2.8Å
1098	A	78.1	Confident	80.6	Confident	81 Å²	81	64 Å²	64	67%	0.669	33%	0.329	S	S	*	.	H	α-helix	trans	-58.7	-25.5	-179.7	0	0	0	0	0	113.6	K1102	A1098-K1102 WeakPolarHBondContact O-CG 3.4Å
1099	A	77.6	Confident	79	Confident	70 Å²	70	70.3 Å²	70.3	58%	0.579	36%	0.362	S	S	*	.	H	α-helix	trans	-71.1	-42.6	173.3	0	0	0	0	0	111.8	L1097 V1101 K1102	L1097-A1099 PolarHBondContact O-N 3.33Å; L1097-A1099 VanDerWaalsContact O-N 3.07Å; A1099-V1101 VanDerWaalsContact C-N 3.34Å; A1099-V1101 PolarHBondContact O-N 3.22Å; A1099-K1102 PolarHBondContact O-N 3.32Å
1100	D	82.4	Confident	76.5	Confident	52 Å²	52	77.4 Å²	77.4	28%	0.278	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-43.9	179.1	-55.1	-44.9	0	0	0	110.7	L1096 L1097 K1102 Q1103 L1104	L1096-D1100 HydrophobicContact CB-CB 4.33Å; L1096-D1100 HydrophobicContact CD2-CB 3.81Å; L1097-D1100 WeakPolarHBondContact CB-OD2 3.47Å; L1097-D1100 PolarHBondContact N-OD2 3.15Å; L1097-D1100 WeakPolarHBondContact O-CB 3.22Å; L1097-D1100 PolarHBondContact O-N 2.99Å; D1100-K1102 VanDerWaalsContact C-N 3.27Å; D1100-K1102 PolarHBondContact O-N 3.33Å; D1100-Q1103 PolarHBondContact O-N 3.04Å; D1100-L1104 WeakPolarHBondContact O-CB 3.5Å; D1100-L1104 PolarHBondContact O-N 3.22Å
1101	V	78.8	Confident	73.8	Confident	41 Å²	41	83.4 Å²	83.4	25%	0.248	43%	0.428	C	S	.	.	H	α-helix	trans	-62.4	-30.8	-178.5	-179.1	0	0	0	0	112.7	S990 L1096 L1097 A1099 Q1103 L1104 F1105	S990-V1101 WeakPolarHBondContact O-CG2 3.42Å; L1096-V1101 HydrophobicContact CB-CG2 4.25Å; L1097-V1101 PolarHBondContact O-N 2.8Å; A1099-V1101 VanDerWaalsContact C-N 3.34Å; A1099-V1101 PolarHBondContact O-N 3.22Å; V1101-Q1103 VanDerWaalsContact C-N 3.3Å; V1101-Q1103 PolarHBondContact O-N 3.03Å; V1101-L1104 WeakPolarHBondContact O-CB 3.47Å; V1101-L1104 PolarHBondContact O-N 2.85Å; V1101-F1105 HydrophobicContact CG1-CE2 4.13Å
1102	K	76.7	Confident	70.9	Confident	182 Å²	182	90.8 Å²	90.8	79%	0.791	47%	0.468	S	S	*	.	H	α-helix	trans	-68.9	-27.1	-179	-75.5	-179.7	-178.7	-175.8	0	113.6	A1098 A1099 D1100	A1098-K1102 WeakPolarHBondContact O-CG 3.4Å; A1099-K1102 PolarHBondContact O-N 3.32Å; D1100-K1102 VanDerWaalsContact C-N 3.27Å; D1100-K1102 PolarHBondContact O-N 3.33Å
1103	Q	75.6	Confident	68.1	Low	164 Å²	164	97.3 Å²	97.3	77%	0.766	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	9	-177.8	-64.5	-179.4	-12.9	0	0	112.2	D1100 V1101	D1100-Q1103 PolarHBondContact O-N 3.04Å; V1101-Q1103 VanDerWaalsContact C-N 3.3Å; V1101-Q1103 PolarHBondContact O-N 3.03Å
1104	L	79.4	Confident	65	Low	4 Å²	4	102.4 Å²	102.4	2%	0.021	53%	0.529	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-37.9	-166.5	-169.2	68.3	0	0	0	113.5	V987 L1096 D1100 V1101 L1168 Y1169	V987-L1104 HydrophobicContact CB-CD2 4.42Å; V987-L1104 HydrophobicContact CG1-CD2 4.02Å; V987-L1104 HydrophobicContact CG2-CD1 4.3Å; V987-L1104 HydrophobicContact CG2-CD2 4.07Å; L1096-L1104 HydrophobicContact CD1-CD2 4.05Å; D1100-L1104 WeakPolarHBondContact O-CB 3.5Å; D1100-L1104 PolarHBondContact O-N 3.22Å; V1101-L1104 WeakPolarHBondContact O-CB 3.47Å; V1101-L1104 PolarHBondContact O-N 2.85Å; L1104-L1168 HydrophobicContact CD1-CD2 4.18Å; L1104-L1168 HydrophobicContact CD2-CD2 4.01Å; L1104-L1168 HydrophobicContact CG-CD2 3.67Å; L1104-Y1169 PolarHBondContact O-N 2.84Å
1105	F	81.5	Confident	62.1	Low	30 Å²	30	105.4 Å²	105.4	13%	0.132	55%	0.548	C	S	.	.	B	Isolated β-bridge	trans	-105.2	143.2	-168.1	-60.4	-70.5	0	0	0	112.4	D978 V1101 K1107 K1154 S1167 L1168 Y1169	D978-F1105 HydrophobicContact CB-CE1 4.06Å; V1101-F1105 HydrophobicContact CG1-CE2 4.13Å; F1105-K1107 PolarHBondContact O-N 3.09Å; F1105-K1154 HydrophobicContact CD1-CB 3.89Å; F1105-K1154 HydrophobicContact CD1-CD 4.08Å; F1105-K1154 HydrophobicContact CD1-CG 3.99Å; F1105-K1154 HydrophobicContact CE1-CB 4.33Å; F1105-K1154 HydrophobicContact CE1-CD 3.66Å; F1105-K1154 HydrophobicContact CE1-CG 4.05Å; F1105-K1154 HydrophobicContact CG-CB 4.32Å; F1105-K1154 HydrophobicContact CG-CG 4.31Å; F1105-K1154 HydrophobicContact CZ-CD 3.99Å; F1105-K1154 HydrophobicContact CZ-CG 4.41Å; F1105-S1167 WeakPolarHBondContact CA-O 3.28Å; F1105-L1168 HydrophobicContact CD1-CD2 3.96Å; F1105-L1168 HydrophobicContact CE1-CD2 3.8Å; F1105-Y1169 WeakPolarHBondContact O-CE2 3.29Å
1106	R	70.5	Confident	59	Low	42 Å²	42	107.7 Å²	107.7	16%	0.158	57%	0.572	C	S	.	*			trans	-70.5	35.9	-175.6	-69.9	-176.5	169	-179	-3.8	116.5	D1166 S1167 Y1169 Y1190	R1106-D1166 IonicContact CZ-OD1 2.76Å; R1106-D1166 IonicContact CZ-OD2 3.11Å; R1106-D1166 IonicContact NH1-OD1 3.77Å; R1106-D1166 PolarHBondContact NH1-OD1 3.11Å; R1106-D1166 IonicContact NH1-OD2 2.64Å; R1106-D1166 PolarHBondContact NH1-OD2 2.87Å; R1106-D1166 IonicContact NH2-OD1 2.82Å; R1106-D1166 PolarHBondContact NH2-OD1 3.22Å; R1106-S1167 PolarHBondContact N-O 2.92Å; R1106-Y1169 HydrophobicContact CB-CE1 4.35Å; R1106-Y1169 HydrophobicContact CB-CE2 4.44Å; R1106-Y1169 HydrophobicContact CG-CD1 3.77Å; R1106-Y1169 HydrophobicContact CG-CD2 4.24Å; R1106-Y1169 HydrophobicContact CG-CE1 3.8Å; R1106-Y1169 HydrophobicContact CG-CE2 4.27Å; R1106-Y1169 HydrophobicContact CG-CG 3.99Å; R1106-Y1190 PolarHBondContact NH1-OH 3.08Å; R1106-Y1190 VanDerWaalsContact NH1-OH 3.11Å; R1106-Y1190 PolarHBondContact NH2-OH 3.27Å
1107	K	64.6	Low	56	Low	140 Å²	140	115.2 Å²	115.2	61%	0.609	61%	0.607	S	S	*	*			trans	-36.3	140.6	-172	-89.3	-173.9	168.8	-169.7	0	116.3	F1105	F1105-K1107 PolarHBondContact O-N 3.09Å
1108	Q	49	Very low	53.3	Low	186 Å²	186	117.9 Å²	117.9	87%	0.869	62%	0.622	S	S	*	*			trans	-95.1	116.1	158.3	-121.5	172.2	7.3	0	0	108.9	N1110	Q1108-N1110 PolarHBondContact O-N 3.21Å; Q1108-N1110 VanDerWaalsContact O-N 3.16Å
1109	D	43.1	Very low	50.8	Low	134 Å²	134	123.2 Å²	123.2	72%	0.717	63%	0.633	S	S	*	*			trans	-70.8	104.4	178.3	-86.8	-26.8	0	0	0	111.1	N1111	D1109-N1111 PolarHBondContact O-N 2.8Å
1110	N	33.3	Very low	48.3	Very low	163 Å²	163	124.7 Å²	124.7	87%	0.872	64%	0.64	S	S	*	*			trans	-74.9	58.2	169.2	-92	-20.9	0	0	0	111.8	Q1108	Q1108-N1110 PolarHBondContact O-N 3.21Å; Q1108-N1110 VanDerWaalsContact O-N 3.16Å
1111	N	30.7	Very low	45.6	Very low	129 Å²	129	130.3 Å²	130.3	69%	0.69	66%	0.664	S	S	*	*			trans	-118.5	29.6	-180	-108.1	2.4	0	0	0	114.2	D1109 N1113	D1109-N1111 PolarHBondContact O-N 2.8Å; N1111-N1113 VanDerWaalsContact C-N 3.32Å; N1111-N1113 PolarHBondContact O-N 3.33Å
1112	D	32.9	Very low	43.2	Very low	161 Å²	161	139 Å²	139	86%	0.861	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	74.4	164.1	-78.9	-16.2	0	0	0	110.2
1113	N	30.5	Very low	40.8	Very low	155 Å²	155	139.8 Å²	139.8	83%	0.829	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.1	18.1	160.9	-98.9	-24.8	0	0	0	113.7	N1111	N1111-N1113 VanDerWaalsContact C-N 3.32Å; N1111-N1113 PolarHBondContact O-N 3.33Å
1114	N	27.4	Very low	38.4	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	70%	0.703	S	S	*	*			trans	-108	89.1	170.7	-78.3	-24.1	0	0	0	110.4	C1116	N1114-C1116 VanDerWaalsContact C-N 3.3Å; N1114-C1116 PolarHBondContact O-N 2.9Å
1115	I	28.5	Very low	35.8	Very low	162 Å²	162	145.7 Å²	145.7	83%	0.831	74%	0.744	S	S	*	*			trans	-57.8	96.3	156.7	-60.2	166.5	0	0	0	106.7
1116	C	24.8	Very low	33.2	Very low	114 Å²	114	149.1 Å²	149.1	77%	0.77	77%	0.77	S	S	*	*			trans	-126.1	93.7	166.5	-84.7	0	0	0	0	108.4	N1114	N1114-C1116 VanDerWaalsContact C-N 3.3Å; N1114-C1116 PolarHBondContact O-N 2.9Å
1117	E	26.1	Very low	31.1	Very low	169 Å²	169	156.5 Å²	156.5	79%	0.79	80%	0.803	S	S	*	*			trans	-50.9	142.9	155.2	-69.2	178.8	150	0	0	110.2
1118	N	27.4	Very low	29.3	Very low	156 Å²	156	156.5 Å²	156.5	83%	0.834	81%	0.814	S	S	*	*			trans	121.5	66	161.5	-60.1	-35.4	0	0	0	114	S1120	N1118-S1120 PolarHBondContact O-N 3.18Å
1119	Q	25.2	Very low	28.2	Very low	192 Å²	192	153.3 Å²	153.3	90%	0.897	81%	0.812	S	S	*	*			trans	-68.1	116.6	148.7	-66.5	177.7	3.8	0	0	108.6
1120	S	26.3	Very low	27.4	Very low	102 Å²	102	157 Å²	157	71%	0.713	82%	0.821	S	S	*	*				-177	140	129.2	56.1	0	0	0	0	111.5	N1118	N1118-S1120 PolarHBondContact O-N 3.18Å
1121	Q	26.3	Very low	27.2	Very low	170 Å²	170	158 Å²	158	79%	0.794	82%	0.818	S	S	*	*			trans	85.3	83.2	161	-50.8	-178.4	10.7	0	0	118
1122	F	27	Very low	27.1	Very low	223 Å²	223	158.5 Å²	158.5	98%	0.978	82%	0.819	S	S	*	*				-143.9	128.8	128.8	-99.9	-78.4	0	0	0	110.8
1123	K	26.1	Very low	27.3	Very low	199 Å²	199	154.9 Å²	154.9	87%	0.865	80%	0.8	S	S	*	*			trans	-83	128.5	-171.9	-76.9	175.5	173.1	175.3	0	112.1
1124	S	25.2	Very low	27.9	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	78%	0.775	S	S	*	*			trans	37.5	111.3	139	65.3	0	0	0	0	120.3
1125	M	25	Very low	28.8	Very low	182 Å²	182	147.2 Å²	147.2	90%	0.897	76%	0.76	S	S	*	*			trans	-122.7	147.6	137.2	-108	-155.5	79.4	0	0	110
1126	P	28.2	Very low	29.6	Very low	102 Å²	102	145.6 Å²	145.6	66%	0.662	75%	0.753	S	S	*	*			trans	-91	138.8	-163.4	35.3	-31.9	0	0	0	113.6
1127	K	26.4	Very low	30.8	Very low	197 Å²	197	143.5 Å²	143.5	86%	0.857	73%	0.734	S	S	*	*			trans	23	109.9	141.1	-58.3	178.1	-179.6	179.1	0	117.1
1128	T	26.2	Very low	32.1	Very low	139 Å²	139	140.7 Å²	140.7	85%	0.853	73%	0.73	S	S	*	*				175.8	100.3	120	43.6	0	0	0	0	110.2
1129	C	25.5	Very low	33.8	Very low	120 Å²	120	135.1 Å²	135.1	81%	0.811	70%	0.7	S	S	*	*			trans	158.8	92.7	150.6	-87.1	0	0	0	0	104.4	K1131	C1129-K1131 PolarHBondContact O-N 3.11Å
1130	K	26.8	Very low	35.7	Very low	210 Å²	210	130 Å²	130	91%	0.913	68%	0.676	S	S	*	*			trans	-63.7	89.8	164.3	-79.3	-179.3	174.2	-179.1	0	105.7	I1132	K1130-I1132 PolarHBondContact O-N 2.9Å
1131	K	29.3	Very low	37.4	Very low	186 Å²	186	132.9 Å²	132.9	81%	0.809	68%	0.678	S	S	*	*			trans	-59.4	106.6	162.2	-75.9	-177.3	174.5	-176.2	0	105.1	C1129 N1133	C1129-K1131 PolarHBondContact O-N 3.11Å; K1131-N1133 VanDerWaalsContact C-N 3.32Å; K1131-N1133 PolarHBondContact O-N 3.21Å
1132	I	28.8	Very low	39.2	Very low	138 Å²	138	126.1 Å²	126.1	71%	0.708	65%	0.649	S	S	*	*			trans	-58.9	108.8	158.9	-65.5	169.1	0	0	0	103.5	K1130 V1134	K1130-I1132 PolarHBondContact O-N 2.9Å; I1132-V1134 PolarHBondContact O-N 3.01Å; I1132-V1134 VanDerWaalsContact O-N 3.14Å
1133	N	37	Very low	41.1	Very low	86 Å²	86	120.3 Å²	120.3	46%	0.46	63%	0.628	S	S	.	*			trans	-74.6	104.3	176.3	-153.6	25.1	0	0	0	105.4	K1131 D1135 D1136	K1131-N1133 VanDerWaalsContact C-N 3.32Å; K1131-N1133 PolarHBondContact O-N 3.21Å; N1133-D1135 PolarHBondContact O-N 3.05Å; N1133-D1135 PolarHBondContact OD1-OD2 3.16Å; N1133-D1136 PolarHBondContact O-N 3.47Å
1134	V	43.3	Very low	42.7	Very low	50 Å²	50	120.3 Å²	120.3	30%	0.303	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-58.4	-17	179.9	177.6	0	0	0	0	111.2	I1132 D1136 M1172	I1132-V1134 PolarHBondContact O-N 3.01Å; I1132-V1134 VanDerWaalsContact O-N 3.14Å; V1134-D1136 PolarHBondContact O-N 3.27Å; V1134-M1172 HydrophobicContact CG2-CE 4.5Å
1135	D	45	Very low	44.4	Very low	85 Å²	85	124.3 Å²	124.3	46%	0.455	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-65.2	-15.5	173.8	-59.9	-30.2	0	0	0	114.4	N1133 Y1169	N1133-D1135 PolarHBondContact O-N 3.05Å; N1133-D1135 PolarHBondContact OD1-OD2 3.16Å; D1135-Y1169 WeakPolarHBondContact OD1-CE1 3.43Å; D1135-Y1169 PolarHBondContact OD1-OH 3.1Å
1136	D	45.5	Very low	46	Very low	127 Å²	127	117 Å²	117	68%	0.679	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-97.4	6.9	-175.4	-71.8	-35.2	0	0	0	114.8	N1133 V1134 P1138	N1133-D1136 PolarHBondContact O-N 3.47Å; V1134-D1136 PolarHBondContact O-N 3.27Å; D1136-P1138 VanDerWaalsContact O-CD 3.23Å; D1136-P1138 WeakPolarHBondContact O-CD 3.46Å
1137	I	50.4	Low	47.8	Very low	71 Å²	71	113.9 Å²	113.9	36%	0.364	59%	0.591	S	S	.	*	S	Bend	trans	-88.7	104.9	173.2	-53.3	175.7	0	0	0	108.1	L1139 Y1190 P1192	I1137-L1139 PolarHBondContact O-N 3.04Å; I1137-Y1190 HydrophobicContact CD1-CD1 4.35Å; I1137-P1192 HydrophobicContact CG2-CB 4.38Å; I1137-P1192 HydrophobicContact CG2-CG 3.65Å
1138	P	54.4	Low	50	Low	110 Å²	110	104.9 Å²	104.9	71%	0.714	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-67.7	126.3	179.7	-1.9	17.5	0	0	0	108.9	D1136	D1136-P1138 VanDerWaalsContact O-CD 3.23Å; D1136-P1138 WeakPolarHBondContact O-CD 3.46Å
1139	L	62.4	Low	52.4	Low	38 Å²	38	102 Å²	102	20%	0.199	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-63	140.7	167	-69.9	170.6	0	0	0	109.1	I1137 E1141 F1150 Y1157 D1166	I1137-L1139 PolarHBondContact O-N 3.04Å; L1139-E1141 PolarHBondContact O-N 2.71Å; L1139-F1150 HydrophobicContact CB-CE1 3.67Å; L1139-F1150 HydrophobicContact CB-CZ 3.75Å; L1139-F1150 HydrophobicContact CD1-CE1 3.88Å; L1139-F1150 HydrophobicContact CG-CE1 4.42Å; L1139-Y1157 HydrophobicContact CD2-CE2 4.04Å; L1139-D1166 WeakPolarHBondContact CD2-OD2 3.46Å
1140	Q	63.8	Low	54.8	Low	85 Å²	85	99.6 Å²	99.6	40%	0.397	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-58.7	127.2	176.5	-178.2	173.1	-0.4	0	0	110	F1150 Y1157	Q1140-F1150 WeakPolarHBondContact O-CZ 3.28Å; Q1140-Y1157 PolarHBondContact N-OH 2.91Å; Q1140-Y1157 VanDerWaalsContact N-OH 3.08Å; Q1140-Y1157 VanDerWaalsContact O-CE1 3.31Å; Q1140-Y1157 WeakPolarHBondContact O-CE1 3.35Å; Q1140-Y1157 PolarHBondContact O-OH 3.06Å; Q1140-Y1157 VanDerWaalsContact O-OH 3.13Å
1141	E	62.5	Low	56.9	Low	163 Å²	163	90.5 Å²	90.5	76%	0.762	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-61.9	129.6	177.4	-75	-173	166	0	0	110.6	L1139 D1143 F1150	L1139-E1141 PolarHBondContact O-N 2.71Å; E1141-D1143 PolarHBondContact O-N 3.14Å; E1141-F1150 HydrophobicContact CG-CE2 4.42Å
1142	P	64.2	Low	58.9	Low	28 Å²	28	89.5 Å²	89.5	18%	0.182	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-70.2	128.4	-177.8	26.7	-33.3	0	0	0	110.4	H1144 I1148 F1150 Y1196	P1142-H1144 PolarHBondContact O-N 3.35Å; P1142-I1148 HydrophobicContact CB-CB 4.23Å; P1142-I1148 HydrophobicContact CB-CG2 4.26Å; P1142-I1148 WeakPolarHBondContact CB-O 3.19Å; P1142-F1150 VanDerWaalsContact CD-CD2 3.47Å; P1142-F1150 HydrophobicContact CG-CD2 3.93Å; P1142-F1150 HydrophobicContact CG-CE2 4Å; P1142-Y1196 HydrophobicContact CB-CE2 3.95Å
1143	D	66.7	Low	60.8	Low	100 Å²	100	91.3 Å²	91.3	54%	0.535	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-57.9	135.1	173.8	-64.3	-30.3	0	0	0	110.6	E1141 E1145 S1146 Y1196	E1141-D1143 PolarHBondContact O-N 3.14Å; D1143-E1145 PolarHBondContact O-N 3.17Å; D1143-S1146 WeakPolarHBondContact O-CB 3.27Å; D1143-S1146 PolarHBondContact O-N 3.18Å; D1143-S1146 PolarHBondContact O-OG 3.27Å; D1143-Y1196 PolarHBondContact N-OH 2.93Å
1144	H	60.2	Low	62.5	Low	199 Å²	199	88.5 Å²	88.5	92%	0.921	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-26.8	178.1	-77.2	-64.3	0	0	0	113.5	P1142	P1142-H1144 PolarHBondContact O-N 3.35Å
1145	E	60.6	Low	64	Low	194 Å²	194	87.1 Å²	87.1	91%	0.907	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-23.9	177.5	-62.6	-172.3	171.9	0	0	113.7	D1143 G1147	D1143-E1145 PolarHBondContact O-N 3.17Å; E1145-G1147 VanDerWaalsContact C-N 3.25Å; E1145-G1147 PolarHBondContact O-N 3.03Å
1146	S	59.5	Low	65.7	Low	29 Å²	29	83.1 Å²	83.1	20%	0.203	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.6	-176.4	69.1	0	0	0	0	113.4	D1143 I1148 Y1196	D1143-S1146 WeakPolarHBondContact O-CB 3.27Å; D1143-S1146 PolarHBondContact O-N 3.18Å; D1143-S1146 PolarHBondContact O-OG 3.27Å; S1146-I1148 PolarHBondContact O-N 2.69Å; S1146-Y1196 PolarHBondContact OG-OH 3.12Å
1147	G	65.7	Low	67.5	Low	37 Å²	37	77.1 Å²	77.1	38%	0.381	40%	0.404	S	S	.	.			trans	62.8	17.8	-177.6	0	0	0	0	0	114	E1145 R1203	E1145-G1147 VanDerWaalsContact C-N 3.25Å; E1145-G1147 PolarHBondContact O-N 3.03Å; G1147-R1203 PolarHBondContact O-NE 2.68Å; G1147-R1203 PolarHBondContact O-NH2 3.2Å
1148	I	72.7	Confident	69.1	Low	8 Å²	8	76.3 Å²	76.3	4%	0.041	40%	0.398	C	S	.	.			trans	-95.1	134.6	173.6	-64.8	171.3	0	0	0	107.7	P1142 S1146 Y1157 Y1196 A1199 V1200 R1203	P1142-I1148 HydrophobicContact CB-CB 4.23Å; P1142-I1148 HydrophobicContact CB-CG2 4.26Å; P1142-I1148 WeakPolarHBondContact CB-O 3.19Å; S1146-I1148 PolarHBondContact O-N 2.69Å; I1148-Y1157 HydrophobicContact CG2-CD1 4.03Å; I1148-Y1157 HydrophobicContact CG2-CG 4.3Å; I1148-Y1196 HydrophobicContact CD1-CE2 4.41Å; I1148-A1199 HydrophobicContact CD1-CB 3.94Å; I1148-V1200 HydrophobicContact CD1-CB 4.27Å; I1148-V1200 HydrophobicContact CD1-CG2 3.63Å; I1148-R1203 HydrophobicContact CD1-CB 4.21Å; I1148-R1203 HydrophobicContact CG1-CB 4.11Å; I1148-R1203 HydrophobicContact CG1-CG 4.05Å
1149	T	76.9	Confident	70.5	Confident	77 Å²	77	71.1 Å²	71.1	47%	0.472	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	152.5	176.9	52.2	0	0	0	0	110.1	Q1158	T1149-Q1158 WeakPolarHBondContact O-CA 3.35Å; T1149-Q1158 VanDerWaalsContact O-CB 3.3Å; T1149-Q1158 WeakPolarHBondContact O-CB 3.36Å; T1149-Q1158 PolarHBondContact O-N 3.41Å
1150	F	75.7	Confident	71.4	Confident	70 Å²	70	70 Å²	70	31%	0.307	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	138.4	168	-82.3	-62.8	0	0	0	110.8	L1139 Q1140 E1141 P1142 L1152 G1156 Y1157	L1139-F1150 HydrophobicContact CB-CE1 3.67Å; L1139-F1150 HydrophobicContact CB-CZ 3.75Å; L1139-F1150 HydrophobicContact CD1-CE1 3.88Å; L1139-F1150 HydrophobicContact CG-CE1 4.42Å; Q1140-F1150 WeakPolarHBondContact O-CZ 3.28Å; E1141-F1150 HydrophobicContact CG-CE2 4.42Å; P1142-F1150 VanDerWaalsContact CD-CD2 3.47Å; P1142-F1150 HydrophobicContact CG-CD2 3.93Å; P1142-F1150 HydrophobicContact CG-CE2 4Å; F1150-L1152 PolarHBondContact O-N 2.94Å; F1150-G1156 WeakPolarHBondContact CD1-O 3.15Å; F1150-Y1157 HydrophobicContact CD1-CD1 4.15Å; F1150-Y1157 HydrophobicContact CD1-CE1 4.3Å; F1150-Y1157 AromaticContact CE1-CD1 3.71Å; F1150-Y1157 HydrophobicContact CE1-CD1 3.71Å; F1150-Y1157 AromaticContact CE1-CE1 3.42Å; F1150-Y1157 HydrophobicContact CE1-CE1 3.42Å; F1150-Y1157 VanDerWaalsContact CE1-CE1 3.42Å; F1150-Y1157 HydrophobicContact CZ-CD1 4.3Å; F1150-Y1157 AromaticContact CZ-CE1 3.69Å; F1150-Y1157 HydrophobicContact CZ-CE1 3.69Å
1151	N	70.4	Confident	72.1	Confident	20 Å²	20	73.4 Å²	73.4	11%	0.107	38%	0.381	C	S	.	.			trans	-79.2	103.3	170.4	-169.5	-44.7	0	0	0	109.6	F1153 K1154 G1155 G1156 Q1158 N1164	N1151-F1153 PolarHBondContact O-N 3.24Å; N1151-F1153 VanDerWaalsContact O-N 3.12Å; N1151-F1153 PolarHBondContact OD1-N 3.27Å; N1151-K1154 PolarHBondContact OD1-N 3.1Å; N1151-K1154 VanDerWaalsContact OD1-N 3.08Å; N1151-G1155 WeakPolarHBondContact O-CA 3.3Å; N1151-G1155 PolarHBondContact O-N 2.98Å; N1151-G1156 PolarHBondContact N-O 3.06Å; N1151-Q1158 HydrophobicContact CB-CB 4.45Å; N1151-N1164 PolarHBondContact ND2-ND2 2.82Å; N1151-N1164 PolarHBondContact ND2-OD1 3.36Å
1152	L	70.4	Confident	73.2	Confident	164 Å²	164	67.5 Å²	67.5	86%	0.859	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.3	-176.9	-65.6	170.3	0	0	0	114.3	F1150	F1150-L1152 PolarHBondContact O-N 2.94Å
1153	F	69.2	Low	74.4	Confident	177 Å²	177	66.3 Å²	66.3	78%	0.776	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-37	-175	-65.7	-78.2	0	0	0	113.3	N1151	N1151-F1153 PolarHBondContact O-N 3.24Å; N1151-F1153 VanDerWaalsContact O-N 3.12Å; N1151-F1153 PolarHBondContact OD1-N 3.27Å
1154	K	73.7	Confident	75.5	Confident	26 Å²	26	61.9 Å²	61.9	11%	0.113	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-14.9	-174.9	-65.8	-178.1	176.4	-176.4	0	113.8	E976 D978 F1105 N1151	E976-K1154 IonicContact OE2-NZ 3.02Å; E976-K1154 PolarHBondContact OE2-NZ 3.08Å; D978-K1154 VanDerWaalsContact CG-NZ 3.3Å; D978-K1154 WeakPolarHBondContact OD1-CD 3.46Å; D978-K1154 IonicContact OD1-NZ 3.53Å; D978-K1154 PolarHBondContact OD1-NZ 2.72Å; D978-K1154 VanDerWaalsContact OD1-NZ 3.11Å; D978-K1154 IonicContact OD2-NZ 2.77Å; D978-K1154 PolarHBondContact OD2-NZ 3.25Å; F1105-K1154 HydrophobicContact CD1-CB 3.89Å; F1105-K1154 HydrophobicContact CD1-CD 4.08Å; F1105-K1154 HydrophobicContact CD1-CG 3.99Å; F1105-K1154 HydrophobicContact CE1-CB 4.33Å; F1105-K1154 HydrophobicContact CE1-CD 3.66Å; F1105-K1154 HydrophobicContact CE1-CG 4.05Å; F1105-K1154 HydrophobicContact CG-CB 4.32Å; F1105-K1154 HydrophobicContact CG-CG 4.31Å; F1105-K1154 HydrophobicContact CZ-CD 3.99Å; F1105-K1154 HydrophobicContact CZ-CG 4.41Å; N1151-K1154 PolarHBondContact OD1-N 3.1Å; N1151-K1154 VanDerWaalsContact OD1-N 3.08Å
1155	G	74.4	Confident	76.7	Confident	22 Å²	22	52.4 Å²	52.4	23%	0.227	28%	0.276	C	S	.	.			trans	74.8	170.7	-165.3	0	0	0	0	0	111.9	N1151 S1167	N1151-G1155 WeakPolarHBondContact O-CA 3.3Å; N1151-G1155 PolarHBondContact O-N 2.98Å; G1155-S1167 WeakPolarHBondContact O-CA 3.41Å; G1155-S1167 WeakPolarHBondContact O-CB 3.36Å
1156	G	81.1	Confident	78	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.01	23%	0.233	C	C	.	.	S	Bend	trans	81.3	178.2	-179	0	0	0	0	0	114.8	F1150 N1151 I1165	F1150-G1156 WeakPolarHBondContact CD1-O 3.15Å; N1151-G1156 PolarHBondContact N-O 3.06Å; G1156-I1165 CarbonylContact C-O 3.59Å; G1156-I1165 VanDerWaalsContact CA-O 3.3Å; G1156-I1165 WeakPolarHBondContact CA-O 3.29Å
1157	Y	82.8	Confident	79.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.7	-176.2	-56.4	-72	0	0	0	111.4	L1139 Q1140 I1148 F1150 V1159 N1164 I1165 Y1196 A1199	L1139-Y1157 HydrophobicContact CD2-CE2 4.04Å; Q1140-Y1157 PolarHBondContact N-OH 2.91Å; Q1140-Y1157 VanDerWaalsContact N-OH 3.08Å; Q1140-Y1157 VanDerWaalsContact O-CE1 3.31Å; Q1140-Y1157 WeakPolarHBondContact O-CE1 3.35Å; Q1140-Y1157 PolarHBondContact O-OH 3.06Å; Q1140-Y1157 VanDerWaalsContact O-OH 3.13Å; I1148-Y1157 HydrophobicContact CG2-CD1 4.03Å; I1148-Y1157 HydrophobicContact CG2-CG 4.3Å; F1150-Y1157 HydrophobicContact CD1-CD1 4.15Å; F1150-Y1157 HydrophobicContact CD1-CE1 4.3Å; F1150-Y1157 AromaticContact CE1-CD1 3.71Å; F1150-Y1157 HydrophobicContact CE1-CD1 3.71Å; F1150-Y1157 AromaticContact CE1-CE1 3.42Å; F1150-Y1157 HydrophobicContact CE1-CE1 3.42Å; F1150-Y1157 VanDerWaalsContact CE1-CE1 3.42Å; F1150-Y1157 HydrophobicContact CZ-CD1 4.3Å; F1150-Y1157 AromaticContact CZ-CE1 3.69Å; F1150-Y1157 HydrophobicContact CZ-CE1 3.69Å; Y1157-V1159 PolarHBondContact O-N 2.86Å; Y1157-N1164 WeakPolarHBondContact O-CA 3.41Å; Y1157-I1165 PolarHBondContact N-O 2.92Å; Y1157-I1165 PolarHBondContact O-N 3.38Å; Y1157-Y1196 HydrophobicContact CD1-CD2 4.09Å; Y1157-Y1196 AromaticContact CE1-CD2 3.64Å; Y1157-Y1196 HydrophobicContact CE1-CD2 3.64Å; Y1157-Y1196 HydrophobicContact CE1-CE2 4.38Å; Y1157-Y1196 HydrophobicContact CE2-CD2 4.46Å; Y1157-Y1196 AromaticContact CZ-CD2 3.85Å; Y1157-A1199 HydrophobicContact CD2-CB 4.36Å; Y1157-A1199 HydrophobicContact CG-CB 4.29Å
1158	Q	84.4	Confident	80.1	Confident	54 Å²	54	40 Å²	40	25%	0.252	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	106.1	172.5	-172.3	173.9	9.5	0	0	109.7	T1149 N1151 T1160	T1149-Q1158 WeakPolarHBondContact O-CA 3.35Å; T1149-Q1158 VanDerWaalsContact O-CB 3.3Å; T1149-Q1158 WeakPolarHBondContact O-CB 3.36Å; T1149-Q1158 PolarHBondContact O-N 3.41Å; N1151-Q1158 HydrophobicContact CB-CB 4.45Å; Q1158-T1160 WeakPolarHBondContact CG-O 3.38Å; Q1158-T1160 PolarHBondContact NE2-O 2.92Å
1159	V	82.6	Confident	80.3	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	21%	0.214	C	C	.	.			trans	-89.7	-34.5	-178.2	179.5	0	0	0	0	111.6	Y1157 L1163 I1165 A1199 L1202 R1203 I1206	Y1157-V1159 PolarHBondContact O-N 2.86Å; V1159-L1163 HydrophobicContact CB-CD2 4.3Å; V1159-L1163 HydrophobicContact CB-CG 4.49Å; V1159-L1163 HydrophobicContact CG1-CD2 4.45Å; V1159-L1163 PolarHBondContact N-O 2.59Å; V1159-I1165 HydrophobicContact CG2-CD1 3.6Å; V1159-I1165 HydrophobicContact CG2-CG1 3.88Å; V1159-A1199 HydrophobicContact CG2-CB 3.69Å; V1159-L1202 HydrophobicContact CG1-CB 4.13Å; V1159-R1203 HydrophobicContact CG1-CB 4.14Å; V1159-R1203 WeakPolarHBondContact O-CD 3.24Å; V1159-R1203 PolarHBondContact O-NH1 3.41Å; V1159-I1206 HydrophobicContact CG1-CD1 4.26Å
1160	T	81.5	Confident	79.8	Confident	14 Å²	14	41.3 Å²	41.3	9%	0.086	21%	0.208	C	C	.	.	S	Bend	trans	-137.9	177.3	172	68.5	0	0	0	0	109.8	Q1158 Y1162 L1163 I1206	Q1158-T1160 WeakPolarHBondContact CG-O 3.38Å; Q1158-T1160 PolarHBondContact NE2-O 2.92Å; T1160-Y1162 HydrophobicContact CG2-CE1 4.22Å; T1160-Y1162 PolarHBondContact O-N 2.93Å; T1160-Y1162 WeakPolarHBondContact OG1-CD1 3.18Å; T1160-Y1162 WeakPolarHBondContact OG1-CD2 3.24Å; T1160-Y1162 VanDerWaalsContact OG1-CE1 3.32Å; T1160-Y1162 WeakPolarHBondContact OG1-CE1 3.23Å; T1160-Y1162 VanDerWaalsContact OG1-CG 3.28Å; T1160-Y1162 PolarHBondContact OG1-N 3.03Å; T1160-L1163 PolarHBondContact N-O 3.03Å; T1160-L1163 VanDerWaalsContact OG1-CB 3.29Å; T1160-L1163 WeakPolarHBondContact OG1-CB 3.29Å; T1160-L1163 PolarHBondContact OG1-N 3.32Å; T1160-I1206 HydrophobicContact CG2-CD1 3.33Å
1161	D	79	Confident	79.1	Confident	158 Å²	158	43.6 Å²	43.6	85%	0.845	22%	0.22	S	C	*	.	S	Bend	trans	-58.9	-18.7	173.5	-57.4	-10.2	0	0	0	112.8
1162	Y	86.1	Confident	77.9	Confident	39 Å²	39	50 Å²	50	15%	0.153	25%	0.251	C	S	.	.	S	Bend	trans	-118.4	-23.2	-177.7	63.2	-98.7	0	0	0	115	R975 E976 V977 R1013 T1160	R975-Y1162 VanDerWaalsContact O-CA 3.22Å; R975-Y1162 WeakPolarHBondContact O-CA 3.38Å; R975-Y1162 WeakPolarHBondContact O-CB 3.39Å; E976-Y1162 CarbonylContact C-O 3.48Å; E976-Y1162 WeakPolarHBondContact CA-O 3.31Å; V977-Y1162 HydrophobicContact CG2-CD2 4.21Å; V977-Y1162 PolarHBondContact N-O 2.83Å; R1013-Y1162 WeakPolarHBondContact CD-OH 3.3Å; T1160-Y1162 HydrophobicContact CG2-CE1 4.22Å; T1160-Y1162 PolarHBondContact O-N 2.93Å; T1160-Y1162 WeakPolarHBondContact OG1-CD1 3.18Å; T1160-Y1162 WeakPolarHBondContact OG1-CD2 3.24Å; T1160-Y1162 VanDerWaalsContact OG1-CE1 3.32Å; T1160-Y1162 WeakPolarHBondContact OG1-CE1 3.23Å; T1160-Y1162 VanDerWaalsContact OG1-CG 3.28Å; T1160-Y1162 PolarHBondContact OG1-N 3.03Å
1163	L	89.9	Confident	76.4	Confident	2 Å²	2	49 Å²	49	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.5	-172.3	179.3	66.2	0	0	0	111	V977 T979 V1006 I1010 V1159 T1160 I1165	V977-L1163 HydrophobicContact CB-CD1 3.95Å; V977-L1163 HydrophobicContact CG1-CD1 3.76Å; V977-L1163 WeakPolarHBondContact O-CA 3.26Å; T979-L1163 HydrophobicContact CG2-CD1 4.11Å; V1006-L1163 HydrophobicContact CG1-CD1 4.43Å; V1006-L1163 HydrophobicContact CG1-CD2 3.99Å; I1010-L1163 HydrophobicContact CD1-CD2 3.62Å; I1010-L1163 HydrophobicContact CG1-CD2 4.2Å; V1159-L1163 HydrophobicContact CB-CD2 4.3Å; V1159-L1163 HydrophobicContact CB-CG 4.49Å; V1159-L1163 HydrophobicContact CG1-CD2 4.45Å; V1159-L1163 PolarHBondContact N-O 2.59Å; T1160-L1163 PolarHBondContact N-O 3.03Å; T1160-L1163 VanDerWaalsContact OG1-CB 3.29Å; T1160-L1163 WeakPolarHBondContact OG1-CB 3.29Å; T1160-L1163 PolarHBondContact OG1-N 3.32Å; L1163-I1165 HydrophobicContact CG-CG1 4.35Å
1164	N	89.3	Confident	74.7	Confident	7 Å²	7	45.6 Å²	45.6	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.5	171.3	-55	-63	0	0	0	109.7	V977 D978 T979 N1151 Y1157	V977-N1164 PolarHBondContact O-N 3.4Å; D978-N1164 PolarHBondContact OD1-ND2 3.32Å; T979-N1164 PolarHBondContact N-O 3.36Å; N1151-N1164 PolarHBondContact ND2-ND2 2.82Å; N1151-N1164 PolarHBondContact ND2-OD1 3.36Å; Y1157-N1164 WeakPolarHBondContact O-CA 3.41Å
1165	I	86	Confident	72.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.6	178	-60.9	-175.3	0	0	0	109.4	T979 G1156 Y1157 V1159 L1163 S1167 L1198 A1199 L1202	T979-I1165 WeakPolarHBondContact OG1-CA 3.45Å; G1156-I1165 CarbonylContact C-O 3.59Å; G1156-I1165 VanDerWaalsContact CA-O 3.3Å; G1156-I1165 WeakPolarHBondContact CA-O 3.29Å; Y1157-I1165 PolarHBondContact N-O 2.92Å; Y1157-I1165 PolarHBondContact O-N 3.38Å; V1159-I1165 HydrophobicContact CG2-CD1 3.6Å; V1159-I1165 HydrophobicContact CG2-CG1 3.88Å; L1163-I1165 HydrophobicContact CG-CG1 4.35Å; I1165-S1167 PolarHBondContact O-N 3.01Å; I1165-L1198 HydrophobicContact CD1-CG 4.36Å; I1165-L1198 HydrophobicContact CG2-CD2 4.49Å; I1165-A1199 HydrophobicContact CD1-CB 4.1Å; I1165-L1202 HydrophobicContact CD1-CD1 3.48Å; I1165-L1202 VanDerWaalsContact CD1-CD1 3.48Å
1166	D	86.5	Confident	70.6	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.3	C	S	.	.	S	Bend	trans	62.3	28.1	176.7	-156.3	30.4	0	0	0	114.2	T979 A981 R1106 L1139 Y1190 S1195	T979-D1166 WeakPolarHBondContact O-CA 3.22Å; T979-D1166 PolarHBondContact O-N 2.85Å; A981-D1166 WeakPolarHBondContact CB-OD1 3.47Å; A981-D1166 PolarHBondContact N-OD1 2.85Å; R1106-D1166 IonicContact CZ-OD1 2.76Å; R1106-D1166 IonicContact CZ-OD2 3.11Å; R1106-D1166 IonicContact NH1-OD1 3.77Å; R1106-D1166 PolarHBondContact NH1-OD1 3.11Å; R1106-D1166 IonicContact NH1-OD2 2.64Å; R1106-D1166 PolarHBondContact NH1-OD2 2.87Å; R1106-D1166 IonicContact NH2-OD1 2.82Å; R1106-D1166 PolarHBondContact NH2-OD1 3.22Å; L1139-D1166 WeakPolarHBondContact CD2-OD2 3.46Å; D1166-Y1190 PolarHBondContact OD1-OH 2.96Å; D1166-Y1190 PolarHBondContact OD2-OH 3.49Å; D1166-S1195 PolarHBondContact OD2-OG 3.38Å
1167	S	85.4	Confident	68.3	Low	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.335	C	S	.	.			trans	-83.1	-20.1	173.4	55.2	0	0	0	0	112.8	D978 T979 F1105 R1106 G1155 I1165	D978-S1167 WeakPolarHBondContact CB-OG 3.4Å; T979-S1167 PolarHBondContact O-N 2.66Å; T979-S1167 VanDerWaalsContact O-N 3.07Å; F1105-S1167 WeakPolarHBondContact CA-O 3.28Å; R1106-S1167 PolarHBondContact N-O 2.92Å; G1155-S1167 WeakPolarHBondContact O-CA 3.41Å; G1155-S1167 WeakPolarHBondContact O-CB 3.36Å; I1165-S1167 PolarHBondContact O-N 3.01Å
1168	L	84.8	Confident	65.7	Low	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-95.2	143.7	-177.1	-56.5	179.2	0	0	0	111.4	D978 T979 N980 R985 V987 L1104 F1105	D978-L1168 HydrophobicContact CB-CD2 4.01Å; D978-L1168 HydrophobicContact CB-CG 4.26Å; D978-L1168 WeakPolarHBondContact O-CD1 3.35Å; T979-L1168 PolarHBondContact O-N 2.85Å; N980-L1168 HydrophobicContact CB-CB 4.36Å; R985-L1168 HydrophobicContact CG-CD1 4.27Å; V987-L1168 HydrophobicContact CB-CD1 4.19Å; V987-L1168 HydrophobicContact CB-CD2 4.34Å; V987-L1168 HydrophobicContact CG2-CD1 3.73Å; V987-L1168 HydrophobicContact CG2-CD2 4.11Å; L1104-L1168 HydrophobicContact CD1-CD2 4.18Å; L1104-L1168 HydrophobicContact CD2-CD2 4.01Å; L1104-L1168 HydrophobicContact CG-CD2 3.67Å; F1105-L1168 HydrophobicContact CD1-CD2 3.96Å; F1105-L1168 HydrophobicContact CE1-CD2 3.8Å
1169	Y	75.7	Confident	63.3	Low	57 Å²	57	74.6 Å²	74.6	22%	0.224	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-66.5	137.9	168.2	-76	-75.6	0	0	0	111.5	R985 L1104 F1105 R1106 D1135	R985-Y1169 PolarHBondContact NH1-O 3.36Å; L1104-Y1169 PolarHBondContact O-N 2.84Å; F1105-Y1169 WeakPolarHBondContact O-CE2 3.29Å; R1106-Y1169 HydrophobicContact CB-CE1 4.35Å; R1106-Y1169 HydrophobicContact CB-CE2 4.44Å; R1106-Y1169 HydrophobicContact CG-CD1 3.77Å; R1106-Y1169 HydrophobicContact CG-CD2 4.24Å; R1106-Y1169 HydrophobicContact CG-CE1 3.8Å; R1106-Y1169 HydrophobicContact CG-CE2 4.27Å; R1106-Y1169 HydrophobicContact CG-CG 3.99Å; D1135-Y1169 WeakPolarHBondContact OD1-CE1 3.43Å; D1135-Y1169 PolarHBondContact OD1-OH 3.1Å
1170	P	67.3	Low	60.9	Low	55 Å²	55	78.9 Å²	78.9	36%	0.357	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-63.4	146.9	163.9	16.3	-14.1	0	0	0	110	M1172	P1170-M1172 PolarHBondContact O-N 3.19Å
1171	E	59.9	Low	58.6	Low	118 Å²	118	84.4 Å²	84.4	55%	0.551	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-69.3	123.5	-176.3	-164.7	163.5	-143.2	0	0	110	R995 I1173	R995-E1171 IonicContact CZ-OE1 2.99Å; R995-E1171 IonicContact CZ-OE2 2.67Å; R995-E1171 IonicContact NH1-OE1 2.75Å; R995-E1171 PolarHBondContact NH1-OE1 3.15Å; R995-E1171 IonicContact NH1-OE2 2.57Å; R995-E1171 PolarHBondContact NH1-OE2 2.91Å; R995-E1171 VanDerWaalsContact NH1-OE2 3.09Å; R995-E1171 IonicContact NH2-OE1 3.96Å; R995-E1171 PolarHBondContact NH2-OE1 3.36Å; R995-E1171 IonicContact NH2-OE2 2.88Å; E1171-I1173 PolarHBondContact O-N 3.16Å
1172	M	45.6	Very low	56.5	Low	153 Å²	153	85.2 Å²	85.2	75%	0.754	47%	0.466	S	S	*	.			trans	-73.8	108.1	164.9	-69.4	-112.2	-153	0	0	107	V1134 P1170 S1174	V1134-M1172 HydrophobicContact CG2-CE 4.5Å; P1170-M1172 PolarHBondContact O-N 3.19Å; M1172-S1174 PolarHBondContact O-N 3.49Å
1173	I	38.9	Very low	54	Low	145 Å²	145	90.8 Å²	90.8	74%	0.744	50%	0.498	S	S	*	.			trans	-63	101.6	171.9	-56.6	170.9	0	0	0	107.1	E1171 V1175	E1171-I1173 PolarHBondContact O-N 3.16Å; I1173-V1175 VanDerWaalsContact C-N 3.31Å; I1173-V1175 HydrophobicContact CG2-CG2 3.88Å; I1173-V1175 PolarHBondContact O-N 3.44Å
1174	S	33.2	Very low	51.3	Low	104 Å²	104	98 Å²	98	73%	0.727	54%	0.535	S	S	*	.			trans	-70.1	94.1	166.3	52.6	0	0	0	0	107.4	M1172 E1176	M1172-S1174 PolarHBondContact O-N 3.49Å; S1174-E1176 PolarHBondContact O-N 2.77Å
1175	V	32.6	Very low	48.8	Very low	106 Å²	106	104.7 Å²	104.7	64%	0.642	57%	0.571	S	S	*	*			trans	-69.9	73.7	175.3	-173.7	0	0	0	0	109.1	I1173 R1178	I1173-V1175 VanDerWaalsContact C-N 3.31Å; I1173-V1175 HydrophobicContact CG2-CG2 3.88Å; I1173-V1175 PolarHBondContact O-N 3.44Å; V1175-R1178 HydrophobicContact CG1-CB 4.42Å
1176	E	30.5	Very low	46.2	Very low	191 Å²	191	113.3 Å²	113.3	89%	0.893	61%	0.611	S	S	*	*			trans	-101.2	88.8	162.1	-72.8	-171.3	175.1	0	0	107.3	S1174	S1174-E1176 PolarHBondContact O-N 2.77Å
1177	G	33.1	Very low	44	Very low	72 Å²	72	119 Å²	119	74%	0.742	65%	0.648	S	S	*	*	S	Bend	trans	159.5	-9.8	171.1	0	0	0	0	0	118.4
1178	R	28.6	Very low	42	Very low	218 Å²	218	128.1 Å²	128.1	82%	0.823	69%	0.691	S	S	*	*			trans	-108.4	87.5	175.2	-75.9	-172.8	179.7	-176.1	0.6	111.1	V1175 S1180	V1175-R1178 HydrophobicContact CG1-CB 4.42Å; R1178-S1180 PolarHBondContact O-N 2.98Å; R1178-S1180 VanDerWaalsContact O-N 3.11Å
1179	S	31.9	Very low	40	Very low	125 Å²	125	138.9 Å²	138.9	87%	0.874	73%	0.733	S	S	*	*			trans	-77.6	75.2	163.8	57.5	0	0	0	0	109.6
1180	S	33.4	Very low	38.9	Very low	91 Å²	91	139.5 Å²	139.5	64%	0.636	74%	0.735	S	S	*	*			trans	-163.7	97.8	161.6	55.4	0	0	0	0	106.7	R1178 E1182	R1178-S1180 PolarHBondContact O-N 2.98Å; R1178-S1180 VanDerWaalsContact O-N 3.11Å; S1180-E1182 PolarHBondContact O-N 3.47Å
1181	V	33.7	Very low	38.5	Very low	131 Å²	131	140.5 Å²	140.5	79%	0.794	74%	0.738	S	S	*	*			trans	-79.7	97.2	178.1	175.9	0	0	0	0	106.4
1182	E	34.5	Very low	38.3	Very low	174 Å²	174	136.6 Å²	136.6	81%	0.813	72%	0.723	S	S	*	*	S	Bend	trans	179.9	130.7	157.9	-96.3	154.7	-144.4	0	0	104.8	S1180	S1180-E1182 PolarHBondContact O-N 3.47Å
1183	D	33.2	Very low	39.2	Very low	157 Å²	157	131 Å²	131	84%	0.84	70%	0.699	S	S	*	*			trans	81.7	54.8	-171.7	-47.8	-24.9	0	0	0	116.6
1184	I	34.2	Very low	41	Very low	153 Å²	153	126.8 Å²	126.8	79%	0.785	68%	0.682	S	S	*	*			trans	-91.4	92.3	153.7	-58.7	173.4	0	0	0	106.3	E1186	I1184-E1186 PolarHBondContact O-N 3.02Å
1185	D	36.2	Very low	43.1	Very low	148 Å²	148	121.8 Å²	121.8	79%	0.791	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-53.9	130.2	161.2	-75.3	-44.4	0	0	0	108.2
1186	E	31.6	Very low	45.2	Very low	181 Å²	181	117.3 Å²	117.3	85%	0.846	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-51	134.7	177.3	-69.6	-170.5	148	0	0	109.8	I1184 E1188	I1184-E1186 PolarHBondContact O-N 3.02Å; E1186-E1188 PolarHBondContact O-N 3.23Å; E1186-E1188 VanDerWaalsContact O-N 3.12Å
1187	P	38.9	Very low	47.6	Very low	120 Å²	120	112.7 Å²	112.7	78%	0.779	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-58.4	123.8	179.2	23.3	-31.2	0	0	0	108.9	Y1189	P1187-Y1189 PolarHBondContact O-N 2.89Å
1188	E	44.2	Very low	49.9	Very low	192 Å²	192	109.8 Å²	109.8	90%	0.897	57%	0.568	S	S	*	*			trans	-41	125	-179.4	-74.5	176.7	147.7	0	0	110.8	E1186 Y1190	E1186-E1188 PolarHBondContact O-N 3.23Å; E1186-E1188 VanDerWaalsContact O-N 3.12Å; E1188-Y1190 PolarHBondContact O-N 2.84Å
1189	Y	43.8	Very low	52.4	Low	225 Å²	225	99.4 Å²	99.4	88%	0.882	53%	0.528	S	S	*	.			trans	-54.5	104.8	-177.6	-152.4	-94.9	0	0	0	109.6	P1187 D1191	P1187-Y1189 PolarHBondContact O-N 2.89Å; Y1189-D1191 PolarHBondContact O-N 3.38Å
1190	Y	51.1	Low	54.8	Low	70 Å²	70	94.4 Å²	94.4	28%	0.275	49%	0.493	S	S	.	.			trans	-65	102.3	177.5	-179.9	-93.7	0	0	0	109.1	A981 R1106 I1137 D1166 E1188 P1192	A981-Y1190 HydrophobicContact CB-CE2 3.61Å; R1106-Y1190 PolarHBondContact NH1-OH 3.08Å; R1106-Y1190 VanDerWaalsContact NH1-OH 3.11Å; R1106-Y1190 PolarHBondContact NH2-OH 3.27Å; I1137-Y1190 HydrophobicContact CD1-CD1 4.35Å; D1166-Y1190 PolarHBondContact OD1-OH 2.96Å; D1166-Y1190 PolarHBondContact OD2-OH 3.49Å; E1188-Y1190 PolarHBondContact O-N 2.84Å; Y1190-P1192 HydrophobicContact CD1-CG 4.46Å; Y1190-P1192 WeakPolarHBondContact O-CD 3.33Å
1191	D	59.2	Low	57.1	Low	77 Å²	77	95.8 Å²	95.8	41%	0.412	48%	0.484	S	S	.	.			trans	-80	108.4	175.4	179	9.4	0	0	0	109.9	Y1189 S1193 S1194	Y1189-D1191 PolarHBondContact O-N 3.38Å; D1191-S1193 PolarHBondContact O-N 3.13Å; D1191-S1193 VanDerWaalsContact O-N 3.13Å; D1191-S1193 VanDerWaalsContact OD1-CB 3.22Å; D1191-S1193 WeakPolarHBondContact OD1-CB 3.34Å; D1191-S1193 PolarHBondContact OD1-N 2.99Å; D1191-S1193 PolarHBondContact OD1-OG 3.4Å; D1191-S1193 PolarHBondContact OD2-OG 2.87Å; D1191-S1194 WeakPolarHBondContact O-CB 2.92Å; D1191-S1194 PolarHBondContact O-N 3.48Å; D1191-S1194 PolarHBondContact O-OG 3.08Å
1192	P	56.7	Low	59.5	Low	35 Å²	35	89.6 Å²	89.6	23%	0.227	45%	0.446	C	S	.	.	H	α-helix	trans	-62.7	-20.2	179.6	-17.5	32.8	0	0	0	112.7	I1137 Y1190 S1194 S1195	I1137-P1192 HydrophobicContact CG2-CB 4.38Å; I1137-P1192 HydrophobicContact CG2-CG 3.65Å; Y1190-P1192 HydrophobicContact CD1-CG 4.46Å; Y1190-P1192 WeakPolarHBondContact O-CD 3.33Å; P1192-S1194 VanDerWaalsContact C-N 3.26Å; P1192-S1194 PolarHBondContact O-N 3.46Å; P1192-S1195 PolarHBondContact O-OG 3.21Å
1193	S	64.3	Low	61.6	Low	36 Å²	36	85.1 Å²	85.1	25%	0.252	42%	0.422	S	S	.	.	H	α-helix	trans	-69.1	-27	177.3	91.9	0	0	0	0	112	D1191 Y1196 N1197	D1191-S1193 PolarHBondContact O-N 3.13Å; D1191-S1193 VanDerWaalsContact O-N 3.13Å; D1191-S1193 VanDerWaalsContact OD1-CB 3.22Å; D1191-S1193 WeakPolarHBondContact OD1-CB 3.34Å; D1191-S1193 PolarHBondContact OD1-N 2.99Å; D1191-S1193 PolarHBondContact OD1-OG 3.4Å; D1191-S1193 PolarHBondContact OD2-OG 2.87Å; S1193-Y1196 PolarHBondContact O-N 3.4Å; S1193-N1197 VanDerWaalsContact O-CB 3.28Å; S1193-N1197 WeakPolarHBondContact O-CB 3.49Å; S1193-N1197 PolarHBondContact O-N 2.94Å; S1193-N1197 PolarHBondContact O-ND2 3.35Å
1194	S	75.8	Confident	63.7	Low	56 Å²	56	84.4 Å²	84.4	39%	0.392	41%	0.411	S	S	.	.	H	α-helix	trans	-65.5	-43.1	-176.5	68.3	0	0	0	0	112.6	D1191 P1192 N1197 L1198	D1191-S1194 WeakPolarHBondContact O-CB 2.92Å; D1191-S1194 PolarHBondContact O-N 3.48Å; D1191-S1194 PolarHBondContact O-OG 3.08Å; P1192-S1194 VanDerWaalsContact C-N 3.26Å; P1192-S1194 PolarHBondContact O-N 3.46Å; S1194-N1197 PolarHBondContact O-N 3.38Å; S1194-L1198 WeakPolarHBondContact O-CB 3.24Å; S1194-L1198 PolarHBondContact O-N 2.79Å
1195	S	76.8	Confident	65.5	Low	0 Å²	0	81.1 Å²	81.1	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-69.6	-38.5	179.4	62.7	0	0	0	0	111.7	D1166 P1192 L1198 A1199	D1166-S1195 PolarHBondContact OD2-OG 3.38Å; P1192-S1195 PolarHBondContact O-OG 3.21Å; S1195-L1198 PolarHBondContact O-N 2.73Å; S1195-A1199 WeakPolarHBondContact O-CB 3.24Å; S1195-A1199 PolarHBondContact O-N 2.88Å
1196	Y	77.8	Confident	67	Low	11 Å²	11	75.9 Å²	75.9	4%	0.043	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-47.3	172.7	-176.3	-113.2	0	0	0	111.6	P1142 D1143 S1146 I1148 Y1157 S1193 L1198 A1199 V1200	P1142-Y1196 HydrophobicContact CB-CE2 3.95Å; D1143-Y1196 PolarHBondContact N-OH 2.93Å; S1146-Y1196 PolarHBondContact OG-OH 3.12Å; I1148-Y1196 HydrophobicContact CD1-CE2 4.41Å; Y1157-Y1196 HydrophobicContact CD1-CD2 4.09Å; Y1157-Y1196 AromaticContact CE1-CD2 3.64Å; Y1157-Y1196 HydrophobicContact CE1-CD2 3.64Å; Y1157-Y1196 HydrophobicContact CE1-CE2 4.38Å; Y1157-Y1196 HydrophobicContact CE2-CD2 4.46Å; Y1157-Y1196 AromaticContact CZ-CD2 3.85Å; S1193-Y1196 PolarHBondContact O-N 3.4Å; Y1196-L1198 VanDerWaalsContact C-N 3.29Å; Y1196-L1198 PolarHBondContact O-N 2.77Å; Y1196-A1199 WeakPolarHBondContact O-CB 3.38Å; Y1196-A1199 PolarHBondContact O-N 3.08Å; Y1196-A1199 VanDerWaalsContact O-N 3.14Å; Y1196-V1200 HydrophobicContact CD1-CG2 4.08Å; Y1196-V1200 HydrophobicContact CD2-CG2 4.24Å; Y1196-V1200 HydrophobicContact CE1-CG2 3.66Å; Y1196-V1200 HydrophobicContact CE2-CG2 3.82Å; Y1196-V1200 HydrophobicContact CG-CG2 4.35Å; Y1196-V1200 WeakPolarHBondContact O-CB 3.45Å; Y1196-V1200 VanDerWaalsContact O-CG2 3.31Å; Y1196-V1200 WeakPolarHBondContact O-CG2 3.39Å; Y1196-V1200 PolarHBondContact O-N 3.2Å
1197	N	79.9	Confident	68.6	Low	95 Å²	95	70.7 Å²	70.7	51%	0.508	35%	0.352	S	S	.	.	H	α-helix	trans	-59.1	-39.6	176.8	-77.8	-41.3	0	0	0	112.1	S1193 S1194 R1201	S1193-N1197 VanDerWaalsContact O-CB 3.28Å; S1193-N1197 WeakPolarHBondContact O-CB 3.49Å; S1193-N1197 PolarHBondContact O-N 2.94Å; S1193-N1197 PolarHBondContact O-ND2 3.35Å; S1194-N1197 PolarHBondContact O-N 3.38Å; N1197-R1201 VanDerWaalsContact O-CB 3.26Å; N1197-R1201 WeakPolarHBondContact O-CB 3.44Å; N1197-R1201 PolarHBondContact O-N 3.41Å
1198	L	83.1	Confident	69.6	Low	10 Å²	10	69.1 Å²	69.1	5%	0.052	35%	0.345	C	S	.	.	H	α-helix	trans	-63.4	-47.1	174	179.5	60.7	0	0	0	111.7	A981 I983 Q1003 I1165 S1194 S1195 Y1196 R1201 L1202	A981-L1198 VanDerWaalsContact O-CD2 3.31Å; A981-L1198 WeakPolarHBondContact O-CD2 3.34Å; I983-L1198 HydrophobicContact CD1-CD2 3.8Å; I983-L1198 HydrophobicContact CG1-CD2 3.9Å; Q1003-L1198 HydrophobicContact CG-CD1 4.36Å; I1165-L1198 HydrophobicContact CD1-CG 4.36Å; I1165-L1198 HydrophobicContact CG2-CD2 4.49Å; S1194-L1198 WeakPolarHBondContact O-CB 3.24Å; S1194-L1198 PolarHBondContact O-N 2.79Å; S1195-L1198 PolarHBondContact O-N 2.73Å; Y1196-L1198 VanDerWaalsContact C-N 3.29Å; Y1196-L1198 PolarHBondContact O-N 2.77Å; L1198-R1201 PolarHBondContact O-N 3.05Å; L1198-L1202 HydrophobicContact CD1-CD1 4.01Å; L1198-L1202 HydrophobicContact CD1-CG 4.26Å; L1198-L1202 HydrophobicContact CG-CD1 4.07Å; L1198-L1202 WeakPolarHBondContact O-CG 3.46Å; L1198-L1202 PolarHBondContact O-N 3.16Å
1199	A	80.5	Confident	69.9	Low	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.3	-45.4	177.2	0	0	0	0	0	111.9	I1148 Y1157 V1159 I1165 S1195 Y1196 L1202 R1203	I1148-A1199 HydrophobicContact CD1-CB 3.94Å; Y1157-A1199 HydrophobicContact CD2-CB 4.36Å; Y1157-A1199 HydrophobicContact CG-CB 4.29Å; V1159-A1199 HydrophobicContact CG2-CB 3.69Å; I1165-A1199 HydrophobicContact CD1-CB 4.1Å; S1195-A1199 WeakPolarHBondContact O-CB 3.24Å; S1195-A1199 PolarHBondContact O-N 2.88Å; Y1196-A1199 WeakPolarHBondContact O-CB 3.38Å; Y1196-A1199 PolarHBondContact O-N 3.08Å; Y1196-A1199 VanDerWaalsContact O-N 3.14Å; A1199-L1202 PolarHBondContact O-N 3.06Å; A1199-R1203 WeakPolarHBondContact O-CB 3.39Å; A1199-R1203 PolarHBondContact O-N 2.96Å
1200	V	81.5	Confident	70.1	Confident	20 Å²	20	53.8 Å²	53.8	12%	0.121	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-43.6	174.6	173.4	0	0	0	0	111.2	I1148 Y1196 R1203 K1204	I1148-V1200 HydrophobicContact CD1-CB 4.27Å; I1148-V1200 HydrophobicContact CD1-CG2 3.63Å; Y1196-V1200 HydrophobicContact CD1-CG2 4.08Å; Y1196-V1200 HydrophobicContact CD2-CG2 4.24Å; Y1196-V1200 HydrophobicContact CE1-CG2 3.66Å; Y1196-V1200 HydrophobicContact CE2-CG2 3.82Å; Y1196-V1200 HydrophobicContact CG-CG2 4.35Å; Y1196-V1200 WeakPolarHBondContact O-CB 3.45Å; Y1196-V1200 VanDerWaalsContact O-CG2 3.31Å; Y1196-V1200 WeakPolarHBondContact O-CG2 3.39Å; Y1196-V1200 PolarHBondContact O-N 3.2Å; V1200-R1203 PolarHBondContact O-N 3.42Å; V1200-K1204 HydrophobicContact CG1-CD 3.91Å; V1200-K1204 HydrophobicContact CG1-CG 4.29Å; V1200-K1204 WeakPolarHBondContact O-CB 3.39Å; V1200-K1204 VanDerWaalsContact O-CG 3.28Å; V1200-K1204 WeakPolarHBondContact O-CG 3.34Å; V1200-K1204 PolarHBondContact O-N 3.22Å
1201	R	83.2	Confident	69.9	Low	120 Å²	120	52.9 Å²	52.9	45%	0.453	29%	0.294	S	S	.	.	H	α-helix	trans	-60.8	-46.9	177.6	-177.5	175.7	66.1	157.2	-0.7	111.6	N1197 L1198 K1204 Q1205	N1197-R1201 VanDerWaalsContact O-CB 3.26Å; N1197-R1201 WeakPolarHBondContact O-CB 3.44Å; N1197-R1201 PolarHBondContact O-N 3.41Å; L1198-R1201 PolarHBondContact O-N 3.05Å; R1201-K1204 PolarHBondContact O-N 3.5Å; R1201-Q1205 PolarHBondContact O-N 3.43Å; R1201-Q1205 VanDerWaalsContact O-N 3.09Å
1202	L	82.4	Confident	69.1	Low	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-68.4	-37.6	179.4	-67.9	170.4	0	0	0	111.8	I983 V1006 A1007 I1010 V1159 I1165 L1198 A1199 Q1205 I1206	I983-L1202 HydrophobicContact CD1-CD1 4.34Å; V1006-L1202 HydrophobicContact CG1-CD1 4.4Å; A1007-L1202 HydrophobicContact CB-CD2 3.78Å; I1010-L1202 HydrophobicContact CD1-CB 4.01Å; I1010-L1202 HydrophobicContact CD1-CD1 4.49Å; I1010-L1202 HydrophobicContact CD1-CD2 3.95Å; I1010-L1202 HydrophobicContact CD1-CG 4.36Å; V1159-L1202 HydrophobicContact CG1-CB 4.13Å; I1165-L1202 HydrophobicContact CD1-CD1 3.48Å; I1165-L1202 VanDerWaalsContact CD1-CD1 3.48Å; L1198-L1202 HydrophobicContact CD1-CD1 4.01Å; L1198-L1202 HydrophobicContact CD1-CG 4.26Å; L1198-L1202 HydrophobicContact CG-CD1 4.07Å; L1198-L1202 WeakPolarHBondContact O-CG 3.46Å; L1198-L1202 PolarHBondContact O-N 3.16Å; A1199-L1202 PolarHBondContact O-N 3.06Å; L1202-Q1205 PolarHBondContact O-N 3.19Å; L1202-I1206 WeakPolarHBondContact O-CG1 3.31Å; L1202-I1206 PolarHBondContact O-N 2.84Å
1203	R	78.7	Confident	68	Low	81 Å²	81	62 Å²	62	31%	0.306	34%	0.336	S	S	.	.	H	α-helix	trans	-66	-43	174	-166.7	66.1	163.8	170.3	0.1	112.2	G1147 I1148 V1159 A1199 V1200 Q1205 I1206 A1207	G1147-R1203 PolarHBondContact O-NE 2.68Å; G1147-R1203 PolarHBondContact O-NH2 3.2Å; I1148-R1203 HydrophobicContact CD1-CB 4.21Å; I1148-R1203 HydrophobicContact CG1-CB 4.11Å; I1148-R1203 HydrophobicContact CG1-CG 4.05Å; V1159-R1203 HydrophobicContact CG1-CB 4.14Å; V1159-R1203 WeakPolarHBondContact O-CD 3.24Å; V1159-R1203 PolarHBondContact O-NH1 3.41Å; A1199-R1203 WeakPolarHBondContact O-CB 3.39Å; A1199-R1203 PolarHBondContact O-N 2.96Å; V1200-R1203 PolarHBondContact O-N 3.42Å; R1203-Q1205 VanDerWaalsContact C-N 3.29Å; R1203-Q1205 PolarHBondContact O-N 3.17Å; R1203-I1206 WeakPolarHBondContact O-CB 3.47Å; R1203-I1206 PolarHBondContact O-N 2.9Å; R1203-A1207 PolarHBondContact O-N 2.85Å
1204	K	77.8	Confident	66.6	Low	141 Å²	141	61.8 Å²	61.8	61%	0.613	34%	0.336	S	S	*	.	H	α-helix	trans	-60.1	-39.4	175.6	-79	177.6	179	175.4	0	111.7	V1200 R1201 I1206 A1207 S1208	V1200-K1204 HydrophobicContact CG1-CD 3.91Å; V1200-K1204 HydrophobicContact CG1-CG 4.29Å; V1200-K1204 WeakPolarHBondContact O-CB 3.39Å; V1200-K1204 VanDerWaalsContact O-CG 3.28Å; V1200-K1204 WeakPolarHBondContact O-CG 3.34Å; V1200-K1204 PolarHBondContact O-N 3.22Å; R1201-K1204 PolarHBondContact O-N 3.5Å; K1204-I1206 VanDerWaalsContact C-N 3.27Å; K1204-I1206 PolarHBondContact O-N 2.97Å; K1204-A1207 PolarHBondContact O-N 2.7Å; K1204-S1208 PolarHBondContact O-N 2.78Å; K1204-S1208 PolarHBondContact O-OG 2.87Å; K1204-S1208 VanDerWaalsContact O-OG 3.06Å
1205	Q	71.1	Confident	64.7	Low	85 Å²	85	64.7 Å²	64.7	40%	0.397	36%	0.356	S	S	.	.	H	α-helix	trans	-61.1	-34.6	173.9	-78.2	-177.9	-17.2	0	0	113	R1201 L1202 R1203 S1208 G1209	R1201-Q1205 PolarHBondContact O-N 3.43Å; R1201-Q1205 VanDerWaalsContact O-N 3.09Å; L1202-Q1205 PolarHBondContact O-N 3.19Å; R1203-Q1205 VanDerWaalsContact C-N 3.29Å; R1203-Q1205 PolarHBondContact O-N 3.17Å; Q1205-S1208 WeakPolarHBondContact CA-OG 3.44Å; Q1205-S1208 PolarHBondContact O-OG 2.79Å; Q1205-G1209 WeakPolarHBondContact O-CA 3.46Å; Q1205-G1209 PolarHBondContact O-N 2.81Å
1206	I	68.9	Low	62.6	Low	37 Å²	37	67.7 Å²	67.7	19%	0.19	38%	0.377	C	S	.	.	H	α-helix	trans	-67.5	-46.9	173.6	-62.1	163.6	0	0	0	110.2	I1010 V1159 T1160 L1202 R1203 K1204 G1209 S1210	I1010-I1206 HydrophobicContact CG2-CD1 3.61Å; I1010-I1206 HydrophobicContact CG2-CG1 3.18Å; V1159-I1206 HydrophobicContact CG1-CD1 4.26Å; T1160-I1206 HydrophobicContact CG2-CD1 3.33Å; L1202-I1206 WeakPolarHBondContact O-CG1 3.31Å; L1202-I1206 PolarHBondContact O-N 2.84Å; R1203-I1206 WeakPolarHBondContact O-CB 3.47Å; R1203-I1206 PolarHBondContact O-N 2.9Å; K1204-I1206 VanDerWaalsContact C-N 3.27Å; K1204-I1206 PolarHBondContact O-N 2.97Å; I1206-G1209 CarbonylContact O-C 3.5Å; I1206-G1209 PolarHBondContact O-N 3.16Å; I1206-S1210 PolarHBondContact O-N 2.83Å
1207	A	65.8	Low	60.7	Low	72 Å²	72	72.4 Å²	72.4	60%	0.595	40%	0.403	S	S	*	.	H	α-helix	trans	-62.3	-46.2	-179.4	0	0	0	0	0	111.8	R1203 K1204 G1209 S1210	R1203-A1207 PolarHBondContact O-N 2.85Å; K1204-A1207 PolarHBondContact O-N 2.7Å; A1207-G1209 VanDerWaalsContact C-N 3.32Å; A1207-S1210 WeakPolarHBondContact O-CB 3.38Å; A1207-S1210 PolarHBondContact O-N 3.23Å
1208	S	59	Low	58.6	Low	88 Å²	88	74.2 Å²	74.2	62%	0.615	41%	0.413	S	S	*	.	H	α-helix	trans	-71.1	-28.3	175.5	62.3	0	0	0	0	113	K1204 Q1205 S1210	K1204-S1208 PolarHBondContact O-N 2.78Å; K1204-S1208 PolarHBondContact O-OG 2.87Å; K1204-S1208 VanDerWaalsContact O-OG 3.06Å; Q1205-S1208 WeakPolarHBondContact CA-OG 3.44Å; Q1205-S1208 PolarHBondContact O-OG 2.79Å; S1208-S1210 VanDerWaalsContact C-N 3.3Å
1209	G	51.1	Low	56.1	Low	19 Å²	19	79.9 Å²	79.9	20%	0.196	44%	0.443	C	S	.	.	H	α-helix	trans	-79.3	-9.4	176.9	0	0	0	0	0	113.7	Q1205 I1206 A1207 L1211	Q1205-G1209 WeakPolarHBondContact O-CA 3.46Å; Q1205-G1209 PolarHBondContact O-N 2.81Å; I1206-G1209 CarbonylContact O-C 3.5Å; I1206-G1209 PolarHBondContact O-N 3.16Å; A1207-G1209 VanDerWaalsContact C-N 3.32Å; G1209-L1211 VanDerWaalsContact C-N 3.28Å; G1209-L1211 WeakPolarHBondContact O-CG 3.39Å; G1209-L1211 PolarHBondContact O-N 3.39Å
1210	S	46.9	Very low	53.8	Low	76 Å²	76	83.8 Å²	83.8	53%	0.531	46%	0.458	S	S	.	.	S	Bend	trans	-67.6	91.6	169.5	-165.7	0	0	0	0	108.1	I1206 A1207 S1208 N1212	I1206-S1210 PolarHBondContact O-N 2.83Å; A1207-S1210 WeakPolarHBondContact O-CB 3.38Å; A1207-S1210 PolarHBondContact O-N 3.23Å; S1208-S1210 VanDerWaalsContact C-N 3.3Å; S1210-N1212 PolarHBondContact O-N 3.5Å
1211	L	47	Very low	51.6	Low	50 Å²	50	89.3 Å²	89.3	26%	0.262	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-56.3	14.3	-166.4	-77.6	142.3	0	0	0	117.3	L1071 G1209 E1213 A1214	L1071-L1211 HydrophobicContact CD2-CD1 3.84Å; G1209-L1211 VanDerWaalsContact C-N 3.28Å; G1209-L1211 WeakPolarHBondContact O-CG 3.39Å; G1209-L1211 PolarHBondContact O-N 3.39Å; L1211-E1213 PolarHBondContact O-N 2.88Å; L1211-A1214 HydrophobicContact CD2-CB 3.75Å; L1211-A1214 PolarHBondContact O-N 3Å
1212	N	41.9	Very low	49.1	Very low	136 Å²	136	88.6 Å²	88.6	73%	0.727	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-64.5	-22.2	176	-75.6	-15.9	0	0	0	113.1	S1210	S1210-N1212 PolarHBondContact O-N 3.5Å
1213	E	34.7	Very low	46.6	Very low	169 Å²	169	94.5 Å²	94.5	79%	0.79	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-105.7	1.6	-179.7	-66.8	-174.1	166.8	0	0	114.5	L1211 S1215	L1211-E1213 PolarHBondContact O-N 2.88Å; E1213-S1215 PolarHBondContact O-N 2.88Å
1214	A	33.8	Very low	44.1	Very low	31 Å²	31	96.8 Å²	96.8	26%	0.256	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	29.8	-177.9	0	0	0	0	0	114.5	L1211 S1216	L1211-A1214 HydrophobicContact CD2-CB 3.75Å; L1211-A1214 PolarHBondContact O-N 3Å; A1214-S1216 VanDerWaalsContact C-N 3.26Å
1215	S	36.3	Very low	42.1	Very low	117 Å²	117	95.3 Å²	95.3	82%	0.818	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-15.1	166.7	49.6	0	0	0	0	113	E1213	E1213-S1215 PolarHBondContact O-N 2.88Å
1216	S	32.8	Very low	40.2	Very low	63 Å²	63	98.3 Å²	98.3	44%	0.441	56%	0.556	S	S	.	*	S	Bend	trans	-104.6	125.2	175.3	54	0	0	0	0	111.2	A1214 D1218	A1214-S1216 VanDerWaalsContact C-N 3.26Å; S1216-D1218 PolarHBondContact O-N 3.28Å
1217	D	39.2	Very low	38.1	Very low	109 Å²	109	101.1 Å²	101.1	58%	0.583	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-65.8	-0.4	-176.6	-79.5	-31.3	0	0	0	115.1	R1070 N1219 Y1220	R1070-D1217 IonicContact CZ-OD1 3.83Å; R1070-D1217 IonicContact NH2-OD1 3.68Å; R1070-D1217 PolarHBondContact NH2-OD1 2.74Å; D1217-N1219 PolarHBondContact O-N 3.47Å; D1217-Y1220 PolarHBondContact O-N 2.85Å
1218	D	34.4	Very low	36.2	Very low	133 Å²	133	102.5 Å²	102.5	71%	0.711	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-72.2	-24.9	-172.2	-77.8	-31.9	0	0	0	115.3	S1216 Y1220	S1216-D1218 PolarHBondContact O-N 3.28Å; D1218-Y1220 VanDerWaalsContact C-N 3.28Å; D1218-Y1220 PolarHBondContact O-N 2.91Å
1219	N	30.7	Very low	34.5	Very low	129 Å²	129	106 Å²	106	69%	0.69	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-76.8	-10	-179.7	-89.9	-16.9	0	0	0	114.2	D1217	D1217-N1219 PolarHBondContact O-N 3.47Å
1220	Y	33.6	Very low	33.2	Very low	82 Å²	82	115.9 Å²	115.9	32%	0.322	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-82.7	-22.7	-174.9	-82.4	-83.1	0	0	0	114.8	I1074 D1217 D1218 C1222	I1074-Y1220 HydrophobicContact CD1-CE1 4.34Å; I1074-Y1220 VanDerWaalsContact CD1-OH 3.27Å; I1074-Y1220 WeakPolarHBondContact CD1-OH 3.42Å; D1217-Y1220 PolarHBondContact O-N 2.85Å; D1218-Y1220 VanDerWaalsContact C-N 3.28Å; D1218-Y1220 PolarHBondContact O-N 2.91Å; Y1220-C1222 VanDerWaalsContact C-N 3.3Å; Y1220-C1222 PolarHBondContact O-N 3.49Å
1221	K	34.3	Very low	32.1	Very low	136 Å²	136	121.4 Å²	121.4	59%	0.591	64%	0.642	S	S	*	*	H	α-helix	trans	-68.3	-26.8	-178.3	-79.9	-179.6	177.9	169.8	0	113.5	L1223	K1221-L1223 VanDerWaalsContact C-N 3.3Å; K1221-L1223 PolarHBondContact O-N 2.97Å
1222	C	31.6	Very low	31.1	Very low	105 Å²	105	124.6 Å²	124.6	71%	0.709	67%	0.666	S	S	*	*	H	α-helix	trans	-73.6	-16	-174.3	-125.2	0	0	0	0	114.7	Y1220	Y1220-C1222 VanDerWaalsContact C-N 3.3Å; Y1220-C1222 PolarHBondContact O-N 3.49Å
1223	L	28.3	Very low	30.3	Very low	126 Å²	126	126.2 Å²	126.2	66%	0.66	67%	0.674	S	S	*	*	H	α-helix	trans	-103.9	-31.7	-177.6	-76.3	161.8	0	0	0	113.5	K1221 E1225 N1226	K1221-L1223 VanDerWaalsContact C-N 3.3Å; K1221-L1223 PolarHBondContact O-N 2.97Å; L1223-E1225 PolarHBondContact O-N 3.43Å; L1223-N1226 PolarHBondContact O-N 3.1Å
1224	N	28	Very low	29.8	Very low	129 Å²	129	127.3 Å²	127.3	69%	0.69	68%	0.676	S	S	*	*	H	α-helix	trans	-73.2	-23.5	-179	-98	3.5	0	0	0	114.1	N1226 T1227	N1224-N1226 PolarHBondContact O-N 2.99Å; N1224-N1226 VanDerWaalsContact O-N 3.16Å; N1224-T1227 PolarHBondContact O-N 3.39Å
1225	E	34.9	Very low	29.4	Very low	110 Å²	110	133.1 Å²	133.1	51%	0.514	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	-16.3	177.9	-74.4	-172.9	168.5	0	0	112.9	L1223 T1267	L1223-E1225 PolarHBondContact O-N 3.43Å; E1225-T1267 VanDerWaalsContact OE2-CG2 3.32Å; E1225-T1267 WeakPolarHBondContact OE2-CG2 3.48Å
1226	N	30.6	Very low	28.9	Very low	147 Å²	147	136.1 Å²	136.1	79%	0.786	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	17	-179.7	-70.1	-17.2	0	0	0	114.4	L1223 N1224	L1223-N1226 PolarHBondContact O-N 3.1Å; N1224-N1226 PolarHBondContact O-N 2.99Å; N1224-N1226 VanDerWaalsContact O-N 3.16Å
1227	T	26.1	Very low	28.5	Very low	97 Å²	97	141 Å²	141	60%	0.595	73%	0.725	S	S	*	*			trans	-137.8	18.7	178.5	-27.8	0	0	0	0	114.1	N1224 L1229	N1224-T1227 PolarHBondContact O-N 3.39Å; T1227-L1229 VanDerWaalsContact C-N 3.34Å; T1227-L1229 PolarHBondContact O-N 3.17Å
1228	S	24.3	Very low	27.9	Very low	100 Å²	100	143.8 Å²	143.8	70%	0.699	74%	0.735	S	S	*	*			trans	-79.4	76.3	176.8	71.6	0	0	0	0	112.4
1229	L	24.9	Very low	27.4	Very low	162 Å²	162	146.5 Å²	146.5	85%	0.848	74%	0.743	S	S	*	*			trans	-137.8	48	162.4	-83.5	174.9	0	0	0	110.4	T1227	T1227-L1229 VanDerWaalsContact C-N 3.34Å; T1227-L1229 PolarHBondContact O-N 3.17Å
1230	Y	22.4	Very low	27.2	Very low	227 Å²	227	146.9 Å²	146.9	89%	0.89	75%	0.745	S	S	*	*			trans	-154.2	104.1	163.8	-97.4	-81.1	0	0	0	109
1231	E	23.6	Very low	26.6	Very low	191 Å²	191	148.9 Å²	148.9	89%	0.893	77%	0.77	S	S	*	*			trans	-75.8	122.4	165.2	-74.5	-171.7	153.4	0	0	108.5	N1233	E1231-N1233 PolarHBondContact O-N 2.95Å
1232	P	27.2	Very low	26.1	Very low	118 Å²	118	151.6 Å²	151.6	77%	0.766	78%	0.782	S	S	*	*			trans	-72	127.5	175.9	9.2	1	0	0	0	109.7	K1234	P1232-K1234 PolarHBondContact O-N 3.41Å
1233	N	24.9	Very low	25.8	Very low	169 Å²	169	155.7 Å²	155.7	90%	0.904	79%	0.791	S	S	*	*			trans	-55.3	109.4	172.2	-103.4	-24.9	0	0	0	109.9	E1231 N1235	E1231-N1233 PolarHBondContact O-N 2.95Å; N1233-N1235 PolarHBondContact O-N 3.22Å
1234	K	25	Very low	25.6	Very low	192 Å²	192	156.5 Å²	156.5	84%	0.835	80%	0.796	S	S	*	*			trans	-66.5	107.3	165.1	-67.8	175.1	178.2	175.3	0	107.5	P1232	P1232-K1234 PolarHBondContact O-N 3.41Å
1235	N	23.5	Very low	25.5	Very low	153 Å²	153	157.1 Å²	157.1	82%	0.818	80%	0.799	S	S	*	*			trans	177.2	67.2	152.5	-88.2	-15.3	0	0	0	110.4	N1233	N1233-N1235 PolarHBondContact O-N 3.22Å
1236	E	27	Very low	25.1	Very low	181 Å²	181	159.8 Å²	159.8	85%	0.846	82%	0.817	S	S	*	*			trans	-139.5	106.6	156.7	-69.4	-168.5	165.2	0	0	107.7	E1238	E1236-E1238 PolarHBondContact O-N 3.34Å
1237	N	24.5	Very low	25	Very low	165 Å²	165	161.2 Å²	161.2	88%	0.882	82%	0.816	S	S	*	*			trans	-76.7	96.3	176.1	-70.3	-30.8	0	0	0	108
1238	E	25.4	Very low	25.1	Very low	167 Å²	167	163.8 Å²	163.8	78%	0.78	83%	0.826	S	S	*	*			trans	-101.8	107.5	164.3	-72.6	-169.2	152.9	0	0	108.8	E1236 D1240	E1236-E1238 PolarHBondContact O-N 3.34Å; E1238-D1240 PolarHBondContact O-N 3.01Å
1239	E	24.7	Very low	25.6	Very low	190 Å²	190	165.8 Å²	165.8	89%	0.888	83%	0.829	S	S	*	*			trans	-75.7	97.1	168.9	-68.8	-178.3	161.1	0	0	109
1240	D	25.7	Very low	26.2	Very low	137 Å²	137	166.7 Å²	166.7	73%	0.733	83%	0.829	S	S	*	*			trans	-135.7	95.4	164.9	-96.7	-28.5	0	0	0	110.4	E1238	E1238-D1240 PolarHBondContact O-N 3.01Å
1241	C	22.4	Very low	27.3	Very low	124 Å²	124	158 Å²	158	84%	0.838	81%	0.808	S	S	*	*			trans	31.9	85.9	151.4	-58.5	0	0	0	0	117.8	E1243	C1241-E1243 PolarHBondContact O-N 3.06Å
1242	F	22.6	Very low	28.4	Very low	194 Å²	194	155.5 Å²	155.5	85%	0.851	79%	0.794	S	S	*	*			trans	-74.5	98	160.2	-70.1	-90	0	0	0	110
1243	E	25.5	Very low	29.8	Very low	190 Å²	190	152.6 Å²	152.6	89%	0.888	77%	0.774	S	S	*	*			trans	-89.7	119	155.3	-79.3	-172.6	163.8	0	0	108.4	C1241 D1245	C1241-E1243 PolarHBondContact O-N 3.06Å; E1243-D1245 PolarHBondContact O-N 3.35Å
1244	N	24.9	Very low	31.9	Very low	144 Å²	144	148.7 Å²	148.7	77%	0.77	76%	0.756	S	S	*	*			trans	-68	105.6	-176	-60.1	-51.4	0	0	0	110.7
1245	D	24.6	Very low	34.2	Very low	141 Å²	141	139.9 Å²	139.9	75%	0.754	72%	0.719	S	S	*	*			trans	-106.4	103.7	158.2	-90	-24.7	0	0	0	108.3	E1243 F1247	E1243-D1245 PolarHBondContact O-N 3.35Å; D1245-F1247 HydrophobicContact CB-CD2 4.25Å; D1245-F1247 PolarHBondContact O-N 2.92Å
1246	D	27.9	Very low	36.6	Very low	166 Å²	166	136.7 Å²	136.7	89%	0.888	72%	0.722	S	S	*	*			trans	-60.1	91.9	170.6	-78.8	-38.5	0	0	0	110
1247	F	28.6	Very low	38.5	Very low	178 Å²	178	131.8 Å²	131.8	78%	0.781	71%	0.705	S	S	*	*			trans	-96.5	128.8	169.3	-98	-90.2	0	0	0	111.3	D1245	D1245-F1247 HydrophobicContact CB-CD2 4.25Å; D1245-F1247 PolarHBondContact O-N 2.92Å
1248	L	28.3	Very low	41.1	Very low	151 Å²	151	124.3 Å²	124.3	79%	0.791	67%	0.665	S	S	*	*			trans	-55.5	143.4	-173.1	-69.8	154.1	0	0	0	113.4	E1250	L1248-E1250 VanDerWaalsContact C-N 3.34Å; L1248-E1250 PolarHBondContact O-N 3.37Å
1249	D	34.4	Very low	43.4	Very low	142 Å²	142	118.7 Å²	118.7	76%	0.759	65%	0.653	S	S	*	*			trans	-60.5	77.5	-179.3	-157.2	22.8	0	0	0	112.4	G1251	D1249-G1251 PolarHBondContact O-N 2.7Å
1250	E	37.2	Very low	45.7	Very low	181 Å²	181	116.2 Å²	116.2	85%	0.846	64%	0.639	S	S	*	*			trans	-88.3	97.7	-177.7	-75.5	-176.9	176.6	0	0	112.2	L1248	L1248-E1250 VanDerWaalsContact C-N 3.34Å; L1248-E1250 PolarHBondContact O-N 3.37Å
1251	G	44.9	Very low	48.1	Very low	44 Å²	44	116.6 Å²	116.6	45%	0.454	63%	0.634	S	S	.	*			trans	-169.8	25.1	174.1	0	0	0	0	0	115.3	D1249	D1249-G1251 PolarHBondContact O-N 2.7Å
1252	K	46.6	Very low	50.4	Low	138 Å²	138	111.3 Å²	111.3	60%	0.6	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.6	111.1	-174.5	-63.1	176.4	-172.8	165	0	110.7	F1261	K1252-F1261 HydrophobicContact CB-CD1 3.97Å
1253	T	57.7	Low	52.5	Low	57 Å²	57	110.6 Å²	110.6	35%	0.35	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	139.8	168.1	45.1	0	0	0	0	110.3	I1262 L1268	T1253-I1262 PolarHBondContact O-N 2.87Å; T1253-L1268 HydrophobicContact CG2-CD1 4.41Å; T1253-L1268 WeakPolarHBondContact OG1-CD1 3.45Å
1254	T	68.8	Low	54.2	Low	87 Å²	87	104 Å²	104	53%	0.534	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.4	134.4	-178.7	47.1	0	0	0	0	111.8	G1256 F1261	T1254-G1256 PolarHBondContact O-N 3.21Å; T1254-F1261 HydrophobicContact CG2-CD1 3.36Å; T1254-F1261 HydrophobicContact CG2-CE1 3.17Å; T1254-F1261 HydrophobicContact CG2-CE2 4.41Å; T1254-F1261 HydrophobicContact CG2-CG 4.09Å; T1254-F1261 HydrophobicContact CG2-CZ 3.75Å
1255	C	73.2	Confident	55.6	Low	8 Å²	8	103.6 Å²	103.6	5%	0.054	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-70.6	120.6	171.5	-178.4	0	0	0	0	111.2	T1257 G1259 K1260 I1262 H1275	C1255-T1257 PolarHBondContact O-N 3.42Å; C1255-T1257 VanDerWaalsContact O-N 3.1Å; C1255-T1257 PolarHBondContact SG-N 3.16Å; C1255-T1257 VanDerWaalsContact SG-N 3.42Å; C1255-G1259 VanDerWaalsContact O-CA 3.25Å; C1255-G1259 WeakPolarHBondContact O-CA 3.35Å; C1255-G1259 PolarHBondContact O-N 3.22Å; C1255-K1260 PolarHBondContact N-O 3.02Å; C1255-I1262 HydrophobicContact CB-CD1 4Å; C1255-I1262 HydrophobicContact CB-CG1 4.32Å; C1255-H1275 WeakPolarHBondContact CB-NE2 3.42Å; C1255-H1275 PolarHBondContact SG-CD2 2.98Å; C1255-H1275 PolarHBondContact SG-NE2 2.9Å
1256	G	73.1	Confident	57.6	Low	86 Å²	86	98.9 Å²	98.9	89%	0.887	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-11	176.4	0	0	0	0	0	115.3	T1254	T1254-G1256 PolarHBondContact O-N 3.21Å
1257	T	68.5	Low	59.1	Low	77 Å²	77	93 Å²	93	47%	0.472	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-29.5	-175.7	-38.3	0	0	0	0	113.5	C1255	C1255-T1257 PolarHBondContact O-N 3.42Å; C1255-T1257 VanDerWaalsContact O-N 3.1Å; C1255-T1257 PolarHBondContact SG-N 3.16Å; C1255-T1257 VanDerWaalsContact SG-N 3.42Å
1258	C	77.8	Confident	60.9	Low	8 Å²	8	88.3 Å²	88.3	5%	0.054	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	2.9	178	73.1	0	0	0	0	114.5	K1260 H1275 C1279 Y1282	C1258-K1260 PolarHBondContact O-N 3.42Å; C1258-H1275 PolarHBondContact SG-CE1 2.81Å; C1258-H1275 PolarHBondContact SG-NE2 3.02Å; C1258-C1279 VanDerWaalsContact CB-SG 3.56Å; C1258-Y1282 WeakPolarHBondContact O-CD2 3.36Å
1259	G	73.8	Confident	62.5	Low	50 Å²	50	88 Å²	88	52%	0.515	49%	0.49	S	S	.	.			trans	68.7	-6.3	-179.5	0	0	0	0	0	115.8	C1255	C1255-G1259 VanDerWaalsContact O-CA 3.25Å; C1255-G1259 WeakPolarHBondContact O-CA 3.35Å; C1255-G1259 PolarHBondContact O-N 3.22Å
1260	K	72.7	Confident	64.2	Low	138 Å²	138	84 Å²	84	60%	0.6	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-70.4	139.2	-178.3	-68.5	-177.8	179	175.7	0	111.7	C1255 C1258	C1255-K1260 PolarHBondContact N-O 3.02Å; C1258-K1260 PolarHBondContact O-N 3.42Å
1261	F	76.5	Confident	65.7	Low	145 Å²	145	75.8 Å²	75.8	64%	0.636	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	124.1	171.9	-66.8	-83.8	0	0	0	110.4	K1252 T1254	K1252-F1261 HydrophobicContact CB-CD1 3.97Å; T1254-F1261 HydrophobicContact CG2-CD1 3.36Å; T1254-F1261 HydrophobicContact CG2-CE1 3.17Å; T1254-F1261 HydrophobicContact CG2-CE2 4.41Å; T1254-F1261 HydrophobicContact CG2-CG 4.09Å; T1254-F1261 HydrophobicContact CG2-CZ 3.75Å
1262	I	70	Confident	66.8	Low	13 Å²	13	77.3 Å²	77.3	7%	0.067	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.6	-179.6	-54.4	173.3	0	0	0	108.2	T1253 C1255 I1264 M1272 H1275	T1253-I1262 PolarHBondContact O-N 2.87Å; C1255-I1262 HydrophobicContact CB-CD1 4Å; C1255-I1262 HydrophobicContact CB-CG1 4.32Å; I1262-I1264 PolarHBondContact O-N 3.48Å; I1262-M1272 HydrophobicContact CD1-CG 4.4Å; I1262-H1275 HydrophobicContact CD1-CB 3.81Å; I1262-H1275 HydrophobicContact CG1-CB 4.25Å
1263	K	68	Low	67.9	Low	179 Å²	179	76.3 Å²	76.3	78%	0.778	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	115.4	170	-163.8	173.2	-175	175.7	0	108.2	Q1265	K1263-Q1265 PolarHBondContact O-N 3.21Å
1264	I	61.1	Low	68.5	Low	51 Å²	51	80.8 Å²	80.8	26%	0.262	44%	0.441	S	S	.	.			trans	-73.3	115.9	-174.4	-57	171.8	0	0	0	109.2	I1262 G1266 L1268	I1262-I1264 PolarHBondContact O-N 3.48Å; I1264-G1266 WeakPolarHBondContact CG2-O 3.34Å; I1264-L1268 HydrophobicContact CD1-CD1 3.93Å; I1264-L1268 HydrophobicContact CG1-CD1 4.24Å
1265	Q	53.3	Low	68.9	Low	135 Å²	135	78.4 Å²	78.4	63%	0.631	42%	0.424	S	S	*	.	S	Bend	trans	-122.6	98	168.8	-76	-174.8	-18.3	0	0	108.1	K1263 S1271	K1263-Q1265 PolarHBondContact O-N 3.21Å; Q1265-S1271 PolarHBondContact N-OG 3.5Å; Q1265-S1271 PolarHBondContact O-OG 3.46Å
1266	G	67.6	Low	68.7	Low	43 Å²	43	85.6 Å²	85.6	44%	0.443	45%	0.45	S	S	.	.	S	Bend	trans	99.8	-147.3	-170.4	0	0	0	0	0	112.1	I1264	I1264-G1266 WeakPolarHBondContact CG2-O 3.34Å
1267	T	59.6	Low	68.7	Low	41 Å²	41	92.1 Å²	92.1	25%	0.252	45%	0.447	S	S	.	.			trans	-72.7	149.1	177.6	68.1	0	0	0	0	111.5	E1225 Q1269 T1270 S1271	E1225-T1267 VanDerWaalsContact OE2-CG2 3.32Å; E1225-T1267 WeakPolarHBondContact OE2-CG2 3.48Å; T1267-Q1269 PolarHBondContact O-N 3.01Å; T1267-T1270 PolarHBondContact N-OG1 3.07Å; T1267-T1270 VanDerWaalsContact N-OG1 3.16Å; T1267-T1270 PolarHBondContact O-N 3.43Å; T1267-T1270 PolarHBondContact O-OG1 2.68Å; T1267-T1270 WeakPolarHBondContact OG1-CB 3.4Å; T1267-T1270 PolarHBondContact OG1-N 3.05Å; T1267-T1270 PolarHBondContact OG1-OG1 3.17Å; T1267-S1271 WeakPolarHBondContact O-CB 3.42Å; T1267-S1271 PolarHBondContact O-N 3.26Å; T1267-S1271 PolarHBondContact O-OG 2.98Å
1268	L	65.7	Low	68.9	Low	80 Å²	80	95 Å²	95	42%	0.419	46%	0.46	S	S	.	.	H	α-helix	trans	-55.7	-40.7	173	179.9	67.9	0	0	0	110.2	T1253 I1264 S1271 M1272	T1253-L1268 HydrophobicContact CG2-CD1 4.41Å; T1253-L1268 WeakPolarHBondContact OG1-CD1 3.45Å; I1264-L1268 HydrophobicContact CD1-CD1 3.93Å; I1264-L1268 HydrophobicContact CG1-CD1 4.24Å; L1268-S1271 PolarHBondContact O-N 3.19Å; L1268-M1272 WeakPolarHBondContact O-CB 3.34Å; L1268-M1272 PolarHBondContact O-N 2.9Å
1269	Q	62.9	Low	68.7	Low	144 Å²	144	95.8 Å²	95.8	67%	0.673	47%	0.465	S	S	*	.	H	α-helix	trans	-62	-47	177.1	-76.6	166.1	-15.1	0	0	112.3	T1267 M1272 L1273	T1267-Q1269 PolarHBondContact O-N 3.01Å; Q1269-M1272 PolarHBondContact O-N 2.7Å; Q1269-L1273 VanDerWaalsContact O-CB 3.22Å; Q1269-L1273 WeakPolarHBondContact O-CB 3.35Å; Q1269-L1273 WeakPolarHBondContact O-CD1 3.47Å; Q1269-L1273 WeakPolarHBondContact O-CG 3.5Å; Q1269-L1273 PolarHBondContact O-N 2.89Å
1270	T	68.3	Low	68.4	Low	59 Å²	59	101.3 Å²	101.3	36%	0.362	48%	0.478	S	S	.	.	H	α-helix	trans	-67.9	-39.8	177.5	41	0	0	0	0	112.7	T1267 L1273 R1274	T1267-T1270 PolarHBondContact N-OG1 3.07Å; T1267-T1270 VanDerWaalsContact N-OG1 3.16Å; T1267-T1270 PolarHBondContact O-N 3.43Å; T1267-T1270 PolarHBondContact O-OG1 2.68Å; T1267-T1270 WeakPolarHBondContact OG1-CB 3.4Å; T1267-T1270 PolarHBondContact OG1-N 3.05Å; T1267-T1270 PolarHBondContact OG1-OG1 3.17Å; T1270-L1273 PolarHBondContact O-N 2.98Å; T1270-R1274 WeakPolarHBondContact O-CB 3.3Å; T1270-R1274 PolarHBondContact O-N 3.13Å
1271	S	69.8	Low	67.9	Low	9 Å²	9	99 Å²	99	6%	0.063	48%	0.477	C	S	.	.	H	α-helix	trans	-64.5	-41.5	176.1	-62.6	0	0	0	0	111.3	Q1265 T1267 L1268 H1275	Q1265-S1271 PolarHBondContact N-OG 3.5Å; Q1265-S1271 PolarHBondContact O-OG 3.46Å; T1267-S1271 WeakPolarHBondContact O-CB 3.42Å; T1267-S1271 PolarHBondContact O-N 3.26Å; T1267-S1271 PolarHBondContact O-OG 2.98Å; L1268-S1271 PolarHBondContact O-N 3.19Å; S1271-H1275 VanDerWaalsContact O-CB 3.23Å; S1271-H1275 WeakPolarHBondContact O-CB 3.38Å; S1271-H1275 PolarHBondContact O-N 3.15Å
1272	M	67.7	Low	66.7	Low	76 Å²	76	100.1 Å²	100.1	37%	0.374	48%	0.478	S	S	.	.	H	α-helix	trans	-74.3	-32.8	179.1	-159.9	157.9	73.6	0	0	112	I1262 L1268 Q1269 R1276	I1262-M1272 HydrophobicContact CD1-CG 4.4Å; L1268-M1272 WeakPolarHBondContact O-CB 3.34Å; L1268-M1272 PolarHBondContact O-N 2.9Å; Q1269-M1272 PolarHBondContact O-N 2.7Å; M1272-R1276 VanDerWaalsContact O-CB 3.24Å; M1272-R1276 WeakPolarHBondContact O-CB 3.21Å; M1272-R1276 WeakPolarHBondContact O-CG 3.4Å; M1272-R1276 PolarHBondContact O-N 3.31Å
1273	L	69.5	Low	66	Low	116 Å²	116	106.6 Å²	106.6	61%	0.607	51%	0.513	S	S	*	.	H	α-helix	trans	-68.8	-45.6	171.2	-76.4	166.5	0	0	0	111.8	Q1269 T1270 H1275 R1276 R1277	Q1269-L1273 VanDerWaalsContact O-CB 3.22Å; Q1269-L1273 WeakPolarHBondContact O-CB 3.35Å; Q1269-L1273 WeakPolarHBondContact O-CD1 3.47Å; Q1269-L1273 WeakPolarHBondContact O-CG 3.5Å; Q1269-L1273 PolarHBondContact O-N 2.89Å; T1270-L1273 PolarHBondContact O-N 2.98Å; L1273-H1275 VanDerWaalsContact C-N 3.31Å; L1273-H1275 PolarHBondContact O-N 3.27Å; L1273-R1276 PolarHBondContact O-N 3.04Å; L1273-R1277 VanDerWaalsContact O-CB 3.3Å; L1273-R1277 WeakPolarHBondContact O-CB 3.48Å; L1273-R1277 PolarHBondContact O-N 3.45Å
1274	R	71.8	Confident	64.7	Low	151 Å²	151	108.7 Å²	108.7	57%	0.57	53%	0.532	S	S	*	.	H	α-helix	trans	-59.1	-44.4	172.4	-90.6	-172	-136.8	150.8	7.1	111.2	T1270 R1277 N1278	T1270-R1274 WeakPolarHBondContact O-CB 3.3Å; T1270-R1274 PolarHBondContact O-N 3.13Å; R1274-R1277 PolarHBondContact O-N 3.33Å; R1274-N1278 PolarHBondContact O-N 3.48Å
1275	H	76.4	Confident	64.9	Low	38 Å²	38	111.6 Å²	111.6	18%	0.176	55%	0.546	C	S	.	.	H	α-helix	trans	-63.8	-51.4	177.6	-178.5	77.8	0	0	0	110.8	C1255 C1258 I1262 S1271 L1273 R1277 N1278 C1279	C1255-H1275 WeakPolarHBondContact CB-NE2 3.42Å; C1255-H1275 PolarHBondContact SG-CD2 2.98Å; C1255-H1275 PolarHBondContact SG-NE2 2.9Å; C1258-H1275 PolarHBondContact SG-CE1 2.81Å; C1258-H1275 PolarHBondContact SG-NE2 3.02Å; I1262-H1275 HydrophobicContact CD1-CB 3.81Å; I1262-H1275 HydrophobicContact CG1-CB 4.25Å; S1271-H1275 VanDerWaalsContact O-CB 3.23Å; S1271-H1275 WeakPolarHBondContact O-CB 3.38Å; S1271-H1275 PolarHBondContact O-N 3.15Å; L1273-H1275 VanDerWaalsContact C-N 3.31Å; L1273-H1275 PolarHBondContact O-N 3.27Å; H1275-R1277 VanDerWaalsContact C-N 3.26Å; H1275-R1277 PolarHBondContact O-N 2.94Å; H1275-N1278 CarbonylContact O-C 3.37Å; H1275-N1278 PolarHBondContact O-N 3.47Å; H1275-C1279 WeakPolarHBondContact O-CA 3.34Å; H1275-C1279 WeakPolarHBondContact O-CB 3.36Å; H1275-C1279 PolarHBondContact O-N 2.88Å
1276	R	69.8	Low	65.5	Low	159 Å²	159	110.3 Å²	110.3	60%	0.6	54%	0.542	S	S	*	.	H	α-helix	trans	-56.4	-38.3	177.6	-85.3	-174.8	169.1	-176.8	-1.7	112.6	M1272 L1273 N1278 C1279	M1272-R1276 VanDerWaalsContact O-CB 3.24Å; M1272-R1276 WeakPolarHBondContact O-CB 3.21Å; M1272-R1276 WeakPolarHBondContact O-CG 3.4Å; M1272-R1276 PolarHBondContact O-N 3.31Å; L1273-R1276 PolarHBondContact O-N 3.04Å; R1276-N1278 PolarHBondContact O-N 2.88Å; R1276-C1279 PolarHBondContact O-N 2.72Å
1277	R	72	Confident	65.4	Low	222 Å²	222	114.1 Å²	114.1	84%	0.838	55%	0.547	S	S	*	.	H	α-helix	trans	-62.3	-28.3	177.5	-170.3	174.8	162.2	174.2	-3.9	113	L1273 R1274 H1275	L1273-R1277 VanDerWaalsContact O-CB 3.3Å; L1273-R1277 WeakPolarHBondContact O-CB 3.48Å; L1273-R1277 PolarHBondContact O-N 3.45Å; R1274-R1277 PolarHBondContact O-N 3.33Å; H1275-R1277 VanDerWaalsContact C-N 3.26Å; H1275-R1277 PolarHBondContact O-N 2.94Å
1278	N	73.5	Confident	65.7	Low	138 Å²	138	118.4 Å²	118.4	74%	0.738	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	7.8	178.3	-63.1	-13.3	0	0	0	112.8	R1274 H1275 R1276 Q1280	R1274-N1278 PolarHBondContact O-N 3.48Å; H1275-N1278 CarbonylContact O-C 3.37Å; H1275-N1278 PolarHBondContact O-N 3.47Å; R1276-N1278 PolarHBondContact O-N 2.88Å; N1278-Q1280 PolarHBondContact O-N 3.43Å
1279	C	73.3	Confident	65.8	Low	25 Å²	25	120.8 Å²	120.8	17%	0.169	57%	0.574	C	S	.	*			trans	-84.7	108.5	-172.2	-170.8	0	0	0	0	109.3	C1258 H1275 R1276	C1258-C1279 VanDerWaalsContact CB-SG 3.56Å; H1275-C1279 WeakPolarHBondContact O-CA 3.34Å; H1275-C1279 WeakPolarHBondContact O-CB 3.36Å; H1275-C1279 PolarHBondContact O-N 2.88Å; R1276-C1279 PolarHBondContact O-N 2.72Å
1280	Q	68.1	Low	65.9	Low	165 Å²	165	119.2 Å²	119.2	77%	0.771	57%	0.567	S	S	*	*			trans	-89	138.6	167.3	-70.7	-176	-17.1	0	0	109.6	N1278	N1278-Q1280 PolarHBondContact O-N 3.43Å
1281	P	61	Low	65.8	Low	91 Å²	91	123.5 Å²	123.5	59%	0.591	58%	0.582	S	S	*	*			trans	-60.8	140.2	177.1	24.4	-31.3	0	0	0	110.2	N1283	P1281-N1283 PolarHBondContact O-N 2.95Å; P1281-N1283 VanDerWaalsContact O-N 3.11Å
1282	Y	51.6	Low	65.5	Low	167 Å²	167	132.3 Å²	132.3	66%	0.655	62%	0.621	S	S	*	*			trans	-65.8	107.5	176.3	-146.5	-94.1	0	0	0	107.6	C1258	C1258-Y1282 WeakPolarHBondContact O-CD2 3.36Å
1283	N	55.9	Low	65.3	Low	149 Å²	149	137 Å²	137	80%	0.797	64%	0.642	S	S	*	*			trans	-80.7	119.7	165.8	-83.1	-10.6	0	0	0	106.6	P1281	P1281-N1283 PolarHBondContact O-N 2.95Å; P1281-N1283 VanDerWaalsContact O-N 3.11Å
1284	D	40.6	Very low	64.9	Low	223 Å²	223	138.9 Å²	138.9	100%	1.193	65%	0.645	S	S	*	*			trans	-47	0	177.2	-78.5	-34.2	0	0	0	114.1

Retrieved 1,284 of 1,284 residues in 779.1 ms (Link to these results)

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