A0A3Q0KPE3_SCHMA Loading...

Putative voltage-gated potassium channel

AlphaFold DB , UniProt , Accession A0A3Q0KPE3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 895 aa.

						>A0A3Q0KPE3_SCHMA|A0A3Q0KPE3
MAGSRRGLVAPQNIFLETVLRRFSTPQTGLLIANARIVDHPIIYVNESFTKMTNYTSREMMHQNAICRQLHGKRTSINSIERLKNALDEGYFDQVEITLYKKNRSMIWVIMCVAPVENDKHEIPLYLILFYDISPLRQPLDDETLSGSFSKFAKLARSVARNKTVLTQVELDDSLVAVAPIQSNSIPKYRQESPKTPPHVVLHYLTFKTAWDWIIFLLTGYTCIIIPYSVAFGHDTLSEESIYFAVEHIVDIIFFIDIVLNFHTTFVGSSGAVISDPVLIRLNYLKGWFIVDLISSLPFGILAVFSDHTTLVNLSSILKLARLLRLCRVLRKLDQYLEYVASILLIMLFCFILLAHWLACVWYLIGMHDLKDKIYHGWIIHLMNETTGPKNWTNTSLEEYLPSQSMLYMTSFYFTLSVITSIGFGNVAANTISEKVVSIIFMLIGALVYATIFGNVATILQQTHATRARLRQLMSSVKDFLRIHEVPKELAERVIDYVTSSWSITKGVDTQTVLNHCPKDMKADLCVHLYRAVFSEHPAFRLASESCLRALAVSFTVQHNAPGDLIFHQGESIDQLCFVVSGSLEVIQDDEIVAILSKGDIFGQPIFKDTDVGQSAASVRALTYCDLQCIKRDKLIDILKFYSQFAVSFSRTLVLSYNLRNRLIFRKISDVRREQELNELRRSQPPISSLAPDHPVRRLISRFCSAATSNLSRSSSFSSNEPRESGKTSGKSNDTSLSATNPIPETTSSPEAFTSSTKPKLSWSRLLDVPKTTSSTQTTVKLTTTTTMAATVLTTNTQQSIKTNNETIQETKQHDDKIQFNSSNPLMNKFNNKDVIEGEQERFHKTIMQHIDLLRNNFLTNIRILSSRIDLIDQRITRIAQFINHHNNKQEMKGL
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	50.5	Low	152 Å²	152	86.8 Å²	86.8	75%	0.749	51%	0.51	S	S	*	.				0	1.7	0	-93.3	-156	-130.3	0	0	113.6	G3 S4 E338	M1-G3 PolarHBondContact O-N 2.96Å; M1-S4 PolarHBondContact O-N 3.37Å; M1-S4 VanDerWaalsContact O-N 3.08Å; M1-E338 VanDerWaalsContact CA-OE1 3.32Å; M1-E338 WeakPolarHBondContact CA-OE1 3.47Å; M1-E338 PolarHBondContact N-OE1 2.97Å
2	A	33.7	Very low	51.7	Low	60 Å²	60	88.3 Å²	88.3	50%	0.496	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-28.4	172.8	0	0	0	0	0	116.5	E338	A2-E338 PolarHBondContact N-OE1 3.13Å
3	G	37.8	Very low	53.3	Low	61 Å²	61	86.2 Å²	86.2	63%	0.629	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-32.8	179.1	0	0	0	0	0	115.5	M1 R5	M1-G3 PolarHBondContact O-N 2.96Å; G3-R5 PolarHBondContact O-N 3.06Å; G3-R5 VanDerWaalsContact O-N 3.16Å
4	S	43.8	Very low	54.9	Low	95 Å²	95	84.4 Å²	84.4	66%	0.664	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-66.4	-20.8	-178.1	-169	0	0	0	0	112.3	M1	M1-S4 PolarHBondContact O-N 3.37Å; M1-S4 VanDerWaalsContact O-N 3.08Å
5	R	51.6	Low	56.8	Low	99 Å²	99	79.6 Å²	79.6	37%	0.374	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-98.1	-7.2	-169.2	-60	-173.8	-174.5	178.3	2.6	114.8	G3 G7 H203 D334	G3-R5 PolarHBondContact O-N 3.06Å; G3-R5 VanDerWaalsContact O-N 3.16Å; R5-G7 PolarHBondContact O-N 3.38Å; R5-H203 PolarHBondContact O-NE2 3.25Å; R5-H203 VanDerWaalsContact O-NE2 3.17Å; R5-D334 PolarHBondContact NH1-O 3.26Å; R5-D334 PolarHBondContact NH2-O 3.2Å
6	R	56.1	Low	58.5	Low	157 Å²	157	79 Å²	79	59%	0.592	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-71.3	-11.5	168.1	-70.6	-173.5	175	-179.5	-1.7	111.9	V9 V273	R6-V9 WeakPolarHBondContact O-CG2 3.45Å; R6-V273 WeakPolarHBondContact O-CG2 3.35Å
7	G	53.9	Low	59.9	Low	13 Å²	13	82.2 Å²	82.2	13%	0.134	46%	0.458	C	S	.	.			trans	70.1	172.3	-161.6	0	0	0	0	0	111	R5 V9 G271	R5-G7 PolarHBondContact O-N 3.38Å; G7-V9 PolarHBondContact O-N 3.26Å; G7-G271 CarbonylContact C-O 3.55Å; G7-G271 WeakPolarHBondContact CA-O 3.5Å
8	L	57.2	Low	61.1	Low	131 Å²	131	80 Å²	80	69%	0.686	45%	0.447	S	S	*	.	S	Bend	trans	-70.9	74.9	172.9	-67.6	169	0	0	0	109.6	G271	L8-G271 PolarHBondContact N-O 3.19Å
9	V	59.1	Low	62.3	Low	46 Å²	46	75.8 Å²	75.8	28%	0.279	42%	0.423	S	S	.	.			trans	-112.1	86.6	178.3	-168.7	0	0	0	0	108.3	R6 G7 P194 Y204 V273	R6-V9 WeakPolarHBondContact O-CG2 3.45Å; G7-V9 PolarHBondContact O-N 3.26Å; V9-P194 HydrophobicContact CG1-CG 3.87Å; V9-Y204 HydrophobicContact CG2-CE1 4.12Å; V9-V273 HydrophobicContact CG2-CB 4.14Å; V9-V273 HydrophobicContact CG2-CG2 3.27Å
10	A	63.9	Low	63.4	Low	52 Å²	52	74.4 Å²	74.4	43%	0.43	41%	0.414	S	S	.	.			trans	-109.8	150.5	164.3	0	0	0	0	0	108.2	Q12	A10-Q12 WeakPolarHBondContact O-CG 3.32Å; A10-Q12 PolarHBondContact O-N 3.13Å
11	P	63.3	Low	64.1	Low	89 Å²	89	81.5 Å²	81.5	58%	0.578	44%	0.435	S	S	*	.			trans	-55.4	126.8	165.8	-19.4	31.2	0	0	0	109.1
12	Q	65.4	Low	66.2	Low	104 Å²	104	81.3 Å²	81.3	49%	0.486	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-125	146.4	-178.3	-70.9	177.9	18.2	0	0	109.8	A10 I14 E192	A10-Q12 WeakPolarHBondContact O-CG 3.32Å; A10-Q12 PolarHBondContact O-N 3.13Å; Q12-I14 HydrophobicContact CB-CD1 4.47Å; Q12-I14 HydrophobicContact CB-CG1 3.99Å; Q12-I14 PolarHBondContact O-N 3.4Å; Q12-E192 PolarHBondContact N-O 2.95Å; Q12-E192 VanDerWaalsContact N-O 3.07Å; Q12-E192 PolarHBondContact O-N 2.99Å
13	N	72.6	Confident	68.5	Low	61 Å²	61	79.5 Å²	79.5	33%	0.326	41%	0.407	S	S	.	.			trans	-92.1	96.7	169.5	-170.9	-12.3	0	0	0	108.9	F15 Y189 R190 Q191	N13-F15 VanDerWaalsContact C-N 3.28Å; N13-F15 WeakPolarHBondContact OD1-CB 3.35Å; N13-F15 PolarHBondContact OD1-N 2.97Å; N13-Y189 VanDerWaalsContact ND2-CE2 3.26Å; N13-Y189 WeakPolarHBondContact ND2-CE2 2.86Å; N13-Y189 VanDerWaalsContact ND2-CZ 3.27Å; N13-R190 PolarHBondContact OD1-O 2.86Å; N13-Q191 HydrophobicContact CB-CG 4.13Å
14	I	76	Confident	70.3	Confident	61 Å²	61	79 Å²	79	31%	0.313	39%	0.393	S	S	.	.			trans	-94	15.8	-176.8	-42.4	172.1	0	0	0	110.7	Q12 L16 E17 T18	Q12-I14 HydrophobicContact CB-CD1 4.47Å; Q12-I14 HydrophobicContact CB-CG1 3.99Å; Q12-I14 PolarHBondContact O-N 3.4Å; I14-L16 PolarHBondContact O-N 3.05Å; I14-E17 HydrophobicContact CG2-CB 3.84Å; I14-E17 HydrophobicContact CG2-CG 4.34Å; I14-E17 WeakPolarHBondContact CG2-OE2 3.34Å; I14-E17 PolarHBondContact O-N 3.31Å; I14-T18 WeakPolarHBondContact O-CB 3.44Å; I14-T18 PolarHBondContact O-N 3.19Å; I14-T18 PolarHBondContact O-OG1 3.01Å
15	F	83.3	Confident	71.9	Confident	13 Å²	13	77.5 Å²	77.5	6%	0.057	38%	0.381	C	S	.	.	H	α-helix	trans	-55.1	-52.9	-175.6	167.8	-101.6	0	0	0	112.5	N13 E17 T18 V19 I32 V116 L125 P187 Y189	N13-F15 VanDerWaalsContact C-N 3.28Å; N13-F15 WeakPolarHBondContact OD1-CB 3.35Å; N13-F15 PolarHBondContact OD1-N 2.97Å; F15-E17 PolarHBondContact O-N 3.06Å; F15-T18 WeakPolarHBondContact O-CB 3.37Å; F15-T18 PolarHBondContact O-N 2.73Å; F15-V19 HydrophobicContact CD2-CG2 4.04Å; F15-V19 HydrophobicContact CE1-CG2 4.14Å; F15-V19 HydrophobicContact CE2-CG2 3.57Å; F15-V19 HydrophobicContact CG-CG2 4.49Å; F15-V19 HydrophobicContact CZ-CG2 3.63Å; F15-V19 WeakPolarHBondContact O-CG2 3.33Å; F15-V19 PolarHBondContact O-N 2.86Å; F15-I32 HydrophobicContact CE1-CD1 4.2Å; F15-V116 HydrophobicContact CD2-CG1 4.39Å; F15-V116 HydrophobicContact CE2-CG1 3.47Å; F15-V116 VanDerWaalsContact CE2-CG1 3.47Å; F15-V116 HydrophobicContact CE2-CG2 4.31Å; F15-V116 HydrophobicContact CZ-CB 4.46Å; F15-V116 HydrophobicContact CZ-CG1 3.76Å; F15-V116 HydrophobicContact CZ-CG2 4.04Å; F15-L125 HydrophobicContact CD1-CD1 4.45Å; F15-L125 HydrophobicContact CE1-CD1 3.81Å; F15-L125 HydrophobicContact CZ-CD1 4.27Å; F15-P187 HydrophobicContact CD2-CB 4.37Å; F15-P187 HydrophobicContact CD2-CG 4.14Å; F15-P187 HydrophobicContact CE2-CG 4.06Å; F15-P187 VanDerWaalsContact CE2-O 3.32Å; F15-P187 WeakPolarHBondContact CE2-O 3.48Å; F15-Y189 HydrophobicContact CB-CD2 4.03Å; F15-Y189 AromaticContact CD1-CD2 3.63Å; F15-Y189 HydrophobicContact CD1-CD2 3.63Å; F15-Y189 HydrophobicContact CD1-CE2 4.14Å; F15-Y189 HydrophobicContact CD2-CD2 4.37Å; F15-Y189 HydrophobicContact CE1-CD2 4.16Å; F15-Y189 AromaticContact CG-CD2 3.74Å; F15-Y189 HydrophobicContact CG-CD2 3.74Å
16	L	83.8	Confident	73	Confident	70 Å²	70	78.7 Å²	78.7	37%	0.366	40%	0.401	S	S	.	.	H	α-helix	trans	-63.2	-43.4	-175.9	-176.9	64.8	0	0	0	111.9	I14 T18 V19 L20 I32 Y44	I14-L16 PolarHBondContact O-N 3.05Å; L16-T18 VanDerWaalsContact C-N 3.3Å; L16-T18 PolarHBondContact O-N 2.87Å; L16-V19 PolarHBondContact O-N 3.21Å; L16-L20 HydrophobicContact CD1-CD1 4.29Å; L16-L20 HydrophobicContact CD1-CG 4.34Å; L16-L20 HydrophobicContact CG-CD1 4Å; L16-L20 HydrophobicContact CG-CG 4.44Å; L16-L20 WeakPolarHBondContact O-CB 3.45Å; L16-L20 VanDerWaalsContact O-CG 3.31Å; L16-L20 WeakPolarHBondContact O-CG 3.45Å; L16-L20 PolarHBondContact O-N 3.26Å; L16-I32 HydrophobicContact CD1-CD1 3.59Å; L16-Y44 HydrophobicContact CD1-CD1 3.94Å; L16-Y44 HydrophobicContact CD1-CD2 4.46Å; L16-Y44 HydrophobicContact CD1-CE1 3.94Å; L16-Y44 HydrophobicContact CD1-CE2 4.45Å; L16-Y44 HydrophobicContact CD1-CG 4.21Å; L16-Y44 HydrophobicContact CD2-CD2 4.47Å; L16-Y44 HydrophobicContact CD2-CE2 4.31Å
17	E	81.7	Confident	73.8	Confident	134 Å²	134	77.5 Å²	77.5	63%	0.626	40%	0.402	S	S	*	.	H	α-helix	trans	-62.7	-39.7	177.2	-173.7	-179	170.7	0	0	111.2	I14 F15 R21	I14-E17 HydrophobicContact CG2-CB 3.84Å; I14-E17 HydrophobicContact CG2-CG 4.34Å; I14-E17 WeakPolarHBondContact CG2-OE2 3.34Å; I14-E17 PolarHBondContact O-N 3.31Å; F15-E17 PolarHBondContact O-N 3.06Å; E17-R21 VanDerWaalsContact O-CB 3.23Å; E17-R21 WeakPolarHBondContact O-CB 3.47Å; E17-R21 PolarHBondContact O-N 3.48Å
18	T	81.7	Confident	75.2	Confident	42 Å²	42	77.1 Å²	77.1	26%	0.258	40%	0.398	S	S	.	.	H	α-helix	trans	-65.3	-44	176.6	-54.2	0	0	0	0	111.7	I14 F15 L16 R22 P187	I14-T18 WeakPolarHBondContact O-CB 3.44Å; I14-T18 PolarHBondContact O-N 3.19Å; I14-T18 PolarHBondContact O-OG1 3.01Å; F15-T18 WeakPolarHBondContact O-CB 3.37Å; F15-T18 PolarHBondContact O-N 2.73Å; L16-T18 VanDerWaalsContact C-N 3.3Å; L16-T18 PolarHBondContact O-N 2.87Å; T18-R22 WeakPolarHBondContact O-CB 3.43Å; T18-R22 WeakPolarHBondContact O-CG 3.47Å; T18-R22 PolarHBondContact O-N 3Å; T18-R22 VanDerWaalsContact O-N 3.07Å; T18-P187 HydrophobicContact CG2-CB 3.88Å; T18-P187 HydrophobicContact CG2-CG 4.06Å
19	V	84	Confident	76.7	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63.2	-48.2	177.2	168.7	0	0	0	0	110.8	F15 L16 R21 R22 F23 L30 L127 P187	F15-V19 HydrophobicContact CD2-CG2 4.04Å; F15-V19 HydrophobicContact CE1-CG2 4.14Å; F15-V19 HydrophobicContact CE2-CG2 3.57Å; F15-V19 HydrophobicContact CG-CG2 4.49Å; F15-V19 HydrophobicContact CZ-CG2 3.63Å; F15-V19 WeakPolarHBondContact O-CG2 3.33Å; F15-V19 PolarHBondContact O-N 2.86Å; L16-V19 PolarHBondContact O-N 3.21Å; V19-R21 PolarHBondContact O-N 3.12Å; V19-R22 PolarHBondContact O-N 2.8Å; V19-F23 HydrophobicContact CG1-CD2 4.19Å; V19-F23 WeakPolarHBondContact O-CD2 3.46Å; V19-F23 PolarHBondContact O-N 3.23Å; V19-L30 HydrophobicContact CG1-CD1 3.68Å; V19-L30 HydrophobicContact CG1-CD2 4.36Å; V19-L127 HydrophobicContact CG1-CD1 3.8Å; V19-L127 HydrophobicContact CG1-CD2 4.31Å; V19-P187 HydrophobicContact CG2-CG 3.44Å; V19-P187 VanDerWaalsContact CG2-CG 3.44Å
20	L	83.8	Confident	78.3	Confident	47 Å²	47	68.7 Å²	68.7	25%	0.246	35%	0.352	C	S	.	.	H	α-helix	trans	-62.1	-43.3	178.8	-72.7	173.5	0	0	0	111.7	L16 R22 S24 Y44 N46	L16-L20 HydrophobicContact CD1-CD1 4.29Å; L16-L20 HydrophobicContact CD1-CG 4.34Å; L16-L20 HydrophobicContact CG-CD1 4Å; L16-L20 HydrophobicContact CG-CG 4.44Å; L16-L20 WeakPolarHBondContact O-CB 3.45Å; L16-L20 VanDerWaalsContact O-CG 3.31Å; L16-L20 WeakPolarHBondContact O-CG 3.45Å; L16-L20 PolarHBondContact O-N 3.26Å; L20-R22 VanDerWaalsContact C-N 3.31Å; L20-R22 PolarHBondContact O-N 3.2Å; L20-S24 WeakPolarHBondContact O-CB 3.42Å; L20-S24 PolarHBondContact O-N 3.28Å; L20-Y44 HydrophobicContact CD2-CE1 3.98Å; L20-Y44 WeakPolarHBondContact CD2-OH 3.42Å; L20-N46 HydrophobicContact CD2-CB 4.3Å
21	R	79.4	Confident	79.7	Confident	224 Å²	224	66.2 Å²	66.2	85%	0.845	33%	0.331	S	S	*	.	H	α-helix	trans	-64.1	-34.1	178.1	-173.4	175.6	178.5	177.6	0.4	112.9	E17 V19	E17-R21 VanDerWaalsContact O-CB 3.23Å; E17-R21 WeakPolarHBondContact O-CB 3.47Å; E17-R21 PolarHBondContact O-N 3.48Å; V19-R21 PolarHBondContact O-N 3.12Å
22	R	79	Confident	81.1	Confident	148 Å²	148	62.2 Å²	62.2	56%	0.558	31%	0.305	S	S	*	.	H	α-helix	trans	-84.8	-42	-177.9	-73.9	-176.6	-177.2	-178.6	2.4	113.6	T18 V19 L20 S185	T18-R22 WeakPolarHBondContact O-CB 3.43Å; T18-R22 WeakPolarHBondContact O-CG 3.47Å; T18-R22 PolarHBondContact O-N 3Å; T18-R22 VanDerWaalsContact O-N 3.07Å; V19-R22 PolarHBondContact O-N 2.8Å; L20-R22 VanDerWaalsContact C-N 3.31Å; L20-R22 PolarHBondContact O-N 3.2Å; R22-S185 PolarHBondContact NH1-O 2.91Å
23	F	80.4	Confident	82.5	Confident	23 Å²	23	57.3 Å²	57.3	10%	0.101	28%	0.282	C	S	.	.	H	α-helix	trans	-113.8	-15.5	-166.8	-60.5	-73.1	0	0	0	114.3	V19 T25 T28 L30 L127 L129 I181	V19-F23 HydrophobicContact CG1-CD2 4.19Å; V19-F23 WeakPolarHBondContact O-CD2 3.46Å; V19-F23 PolarHBondContact O-N 3.23Å; F23-T25 PolarHBondContact O-N 3.11Å; F23-T25 VanDerWaalsContact O-N 3.11Å; F23-T28 PolarHBondContact O-OG1 2.9Å; F23-L30 HydrophobicContact CB-CD1 3.87Å; F23-L127 HydrophobicContact CD2-CD2 4.05Å; F23-L127 HydrophobicContact CE2-CD2 4.05Å; F23-L129 HydrophobicContact CB-CD1 4.38Å; F23-L129 HydrophobicContact CB-CD2 4.04Å; F23-L129 HydrophobicContact CD1-CD1 3.84Å; F23-L129 HydrophobicContact CE1-CD1 4.41Å; F23-L129 HydrophobicContact CG-CD1 4.21Å; F23-I181 HydrophobicContact CE1-CG1 4.38Å
24	S	76.2	Confident	83.5	Confident	49 Å²	49	56 Å²	56	34%	0.343	28%	0.275	S	S	.	.			trans	-84.6	89.2	-177.4	-164.1	0	0	0	0	111.4	L20 N46	L20-S24 WeakPolarHBondContact O-CB 3.42Å; L20-S24 PolarHBondContact O-N 3.28Å; S24-N46 PolarHBondContact OG-ND2 2.9Å
25	T	76.9	Confident	84.3	Confident	65 Å²	65	54 Å²	54	40%	0.399	27%	0.267	S	S	.	.			trans	-94.6	163.6	163.6	75.3	0	0	0	0	111	F23 Q27 T28 S48	F23-T25 PolarHBondContact O-N 3.11Å; F23-T25 VanDerWaalsContact O-N 3.11Å; T25-Q27 PolarHBondContact O-N 3.25Å; T25-Q27 VanDerWaalsContact O-N 3.09Å; T25-T28 WeakPolarHBondContact CA-OG1 3.12Å; T25-T28 PolarHBondContact N-OG1 3.4Å; T25-T28 PolarHBondContact O-N 3.1Å; T25-T28 PolarHBondContact O-OG1 3.4Å; T25-T28 WeakPolarHBondContact OG1-CB 3.47Å; T25-T28 WeakPolarHBondContact OG1-CG2 3.28Å; T25-T28 PolarHBondContact OG1-N 2.94Å; T25-T28 PolarHBondContact OG1-OG1 2.69Å; T25-S48 PolarHBondContact O-OG 2.98Å
26	P	75.4	Confident	84.7	Confident	123 Å²	123	60.8 Å²	60.8	80%	0.799	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.8	-179.8	-23.3	33.6	0	0	0	114.6
27	Q	72.2	Confident	85.1	Confident	132 Å²	132	61.7 Å²	61.7	62%	0.617	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-6	-177.2	-65.9	-178.5	-20.1	0	0	113.3	T25	T25-Q27 PolarHBondContact O-N 3.25Å; T25-Q27 VanDerWaalsContact O-N 3.09Å
28	T	84.3	Confident	85.5	Confident	6 Å²	6	61.2 Å²	61.2	4%	0.037	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	111.1	-179	49.8	0	0	0	0	110.7	F23 T25 N46 S48 F130 Y131	F23-T28 PolarHBondContact O-OG1 2.9Å; T25-T28 WeakPolarHBondContact CA-OG1 3.12Å; T25-T28 PolarHBondContact N-OG1 3.4Å; T25-T28 PolarHBondContact O-N 3.1Å; T25-T28 PolarHBondContact O-OG1 3.4Å; T25-T28 WeakPolarHBondContact OG1-CB 3.47Å; T25-T28 WeakPolarHBondContact OG1-CG2 3.28Å; T25-T28 PolarHBondContact OG1-N 2.94Å; T25-T28 PolarHBondContact OG1-OG1 2.69Å; T28-N46 PolarHBondContact O-ND2 2.93Å; T28-S48 WeakPolarHBondContact O-CB 3.29Å; T28-F130 WeakPolarHBondContact CA-O 3.14Å; T28-Y131 HydrophobicContact CG2-CD1 3.62Å; T28-Y131 HydrophobicContact CG2-CE1 3.3Å
29	G	88.3	Confident	85.8	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	136.8	165.2	0	0	0	0	0	110.2	L129 F130	G29-L129 CarbonylContact O-C 3.49Å; G29-L129 WeakPolarHBondContact O-CA 3.31Å; G29-F130 PolarHBondContact N-O 2.93Å; G29-F130 PolarHBondContact O-N 3.01Å
30	L	92	Very high	86.2	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.1	179.4	-176.6	156.3	0	0	0	109	V19 F23 I32 Y44 V45 N46 L127 L129	V19-L30 HydrophobicContact CG1-CD1 3.68Å; V19-L30 HydrophobicContact CG1-CD2 4.36Å; F23-L30 HydrophobicContact CB-CD1 3.87Å; L30-I32 HydrophobicContact CD2-CD1 4.35Å; L30-I32 HydrophobicContact CD2-CG1 3.92Å; L30-Y44 HydrophobicContact CD2-CD1 4.15Å; L30-Y44 HydrophobicContact CD2-CE1 4.13Å; L30-V45 CarbonylContact O-C 3.53Å; L30-V45 WeakPolarHBondContact O-CA 3.42Å; L30-N46 HydrophobicContact CB-CB 4.07Å; L30-N46 VanDerWaalsContact N-CG 3.35Å; L30-N46 PolarHBondContact N-OD1 2.85Å; L30-N46 PolarHBondContact O-N 3.2Å; L30-N46 PolarHBondContact O-OD1 3.31Å; L30-L127 HydrophobicContact CD1-CD1 3.9Å; L30-L127 HydrophobicContact CD2-CD1 3.89Å; L30-L127 HydrophobicContact CG-CD1 3.72Å; L30-L129 HydrophobicContact CB-CD2 3.83Å; L30-L129 HydrophobicContact CD1-CD2 3.63Å; L30-L129 HydrophobicContact CG-CD2 3.65Å
31	L	93.3	Very high	86.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.1	168.6	71.6	78.8	0	0	0	110.6	A33 I42 Y44 V45 F49 I128 F130	L31-A33 HydrophobicContact CD1-CB 4.41Å; L31-I42 HydrophobicContact CB-CG2 4.28Å; L31-I42 HydrophobicContact CD1-CG1 4.27Å; L31-I42 HydrophobicContact CD2-CD1 4.14Å; L31-I42 HydrophobicContact CD2-CG1 4.5Å; L31-Y44 CarbonylContact C-O 3.5Å; L31-Y44 VanDerWaalsContact CA-O 3.27Å; L31-Y44 WeakPolarHBondContact CA-O 3.41Å; L31-V45 HydrophobicContact CB-CG2 4.15Å; L31-F49 HydrophobicContact CD2-CE2 4.12Å; L31-F49 HydrophobicContact CD2-CZ 4.36Å; L31-I128 HydrophobicContact CD1-CB 3.55Å; L31-I128 HydrophobicContact CD1-CD1 3.73Å; L31-I128 HydrophobicContact CD1-CG1 3.66Å; L31-I128 HydrophobicContact CD2-CB 4.33Å; L31-I128 HydrophobicContact CG-CB 3.74Å; L31-I128 HydrophobicContact CG-CG1 4.4Å; L31-I128 PolarHBondContact N-O 2.81Å; L31-I128 PolarHBondContact O-N 2.8Å; L31-F130 HydrophobicContact CD2-CD2 4.42Å; L31-F130 HydrophobicContact CD2-CE2 3.35Å; L31-F130 HydrophobicContact CD2-CZ 3.76Å; L31-F130 HydrophobicContact CG-CE2 3.94Å
32	I	93.9	Very high	87.5	Confident	5 Å²	5	52.7 Å²	52.7	3%	0.026	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.6	173.9	-54.2	173.1	0	0	0	107.3	F15 L16 L30 I43 Y44 L125 Y126 L127	F15-I32 HydrophobicContact CE1-CD1 4.2Å; L16-I32 HydrophobicContact CD1-CD1 3.59Å; L30-I32 HydrophobicContact CD2-CD1 4.35Å; L30-I32 HydrophobicContact CD2-CG1 3.92Å; I32-I43 HydrophobicContact CB-CG1 4.19Å; I32-I43 HydrophobicContact CG2-CD1 3.94Å; I32-I43 HydrophobicContact CG2-CG1 3.97Å; I32-I43 VanDerWaalsContact O-CG1 3.25Å; I32-I43 WeakPolarHBondContact O-CG1 3.27Å; I32-I43 PolarHBondContact O-N 2.9Å; I32-Y44 HydrophobicContact CD1-CD1 3.88Å; I32-Y44 HydrophobicContact CD1-CG 4.37Å; I32-Y44 HydrophobicContact CG1-CD1 4.14Å; I32-Y44 PolarHBondContact N-O 3.32Å; I32-Y44 PolarHBondContact O-N 3.23Å; I32-L125 HydrophobicContact CG2-CB 4.18Å; I32-L125 HydrophobicContact CG2-CD1 4.17Å; I32-L125 HydrophobicContact CG2-CD2 4.19Å; I32-L125 HydrophobicContact CG2-CG 4.42Å; I32-Y126 CarbonylContact C-O 3.59Å; I32-Y126 VanDerWaalsContact CA-O 3.3Å; I32-Y126 WeakPolarHBondContact CA-O 3.39Å; I32-L127 HydrophobicContact CG1-CD1 4.19Å
33	A	94.2	Very high	88.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	151.2	178.4	0	0	0	0	0	111.4	L31 H40 P41 A65 L125 Y126	L31-A33 HydrophobicContact CD1-CB 4.41Å; A33-H40 HydrophobicContact CB-CB 4.41Å; A33-P41 WeakPolarHBondContact CA-O 3.39Å; A33-A65 HydrophobicContact CB-CB 3.71Å; A33-L125 CarbonylContact O-C 3.56Å; A33-L125 VanDerWaalsContact O-CA 3.31Å; A33-L125 WeakPolarHBondContact O-CA 3.34Å; A33-Y126 PolarHBondContact N-O 3.09Å; A33-Y126 PolarHBondContact O-N 2.82Å
34	N	94.6	Very high	88.9	Confident	35 Å²	35	51 Å²	51	19%	0.187	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	118.6	176.4	-169.2	-31.8	0	0	0	110.3	R36 I37 H40 P41 I43 P124	N34-R36 VanDerWaalsContact C-N 3.33Å; N34-R36 PolarHBondContact O-N 3.36Å; N34-R36 PolarHBondContact OD1-N 3Å; N34-I37 HydrophobicContact CB-CD1 4.19Å; N34-I37 HydrophobicContact CB-CG1 4.36Å; N34-I37 VanDerWaalsContact ND2-CD1 3.29Å; N34-I37 WeakPolarHBondContact ND2-CD1 3.26Å; N34-H40 WeakPolarHBondContact O-CA 3.45Å; N34-H40 PolarHBondContact O-ND1 2.86Å; N34-P41 HydrophobicContact CB-CG 4.33Å; N34-P41 PolarHBondContact N-O 3.13Å; N34-I43 HydrophobicContact CB-CG2 4.16Å; N34-P124 PolarHBondContact OD1-O 3.48Å
35	A	92.7	Very high	89.7	Confident	18 Å²	18	49 Å²	49	15%	0.149	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-22	-177.9	0	0	0	0	0	113	H40 I123 P124 Y126	A35-H40 PolarHBondContact O-CE1 2.89Å; A35-H40 PolarHBondContact O-ND1 2.96Å; A35-I123 HydrophobicContact CB-CG2 3.96Å; A35-I123 WeakPolarHBondContact CB-O 3.43Å; A35-P124 PolarHBondContact N-O 2.85Å; A35-Y126 HydrophobicContact CB-CD2 3.62Å; A35-Y126 HydrophobicContact CB-CE2 3.45Å; A35-Y126 VanDerWaalsContact CB-CE2 3.45Å; A35-Y126 HydrophobicContact CB-CG 4.39Å
36	R	91.1	Very high	90.4	Very high	155 Å²	155	46 Å²	46	59%	0.585	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.6	-174.8	-62.4	-174.1	179.3	-172	-4	114.9	N34 E122	N34-R36 VanDerWaalsContact C-N 3.33Å; N34-R36 PolarHBondContact O-N 3.36Å; N34-R36 PolarHBondContact OD1-N 3Å; R36-E122 IonicContact CZ-OE2 2.81Å; R36-E122 IonicContact NH2-OE2 3.81Å; R36-E122 PolarHBondContact NH2-OE2 2.87Å
37	I	92.8	Very high	91.2	Very high	89 Å²	89	46.3 Å²	46.3	46%	0.456	23%	0.229	S	C	.	.	S	Bend	trans	-100.5	138.6	-179.2	-57.2	174.9	0	0	0	108.3	N34 H40 P41	N34-I37 HydrophobicContact CB-CD1 4.19Å; N34-I37 HydrophobicContact CB-CG1 4.36Å; N34-I37 VanDerWaalsContact ND2-CD1 3.29Å; N34-I37 WeakPolarHBondContact ND2-CD1 3.26Å; I37-H40 PolarHBondContact O-N 2.75Å; I37-H40 VanDerWaalsContact O-N 3.13Å; I37-P41 HydrophobicContact CB-CG 3.85Å; I37-P41 HydrophobicContact CD1-CG 4.19Å; I37-P41 HydrophobicContact CG2-CG 3.79Å
38	V	89.1	Confident	92	Very high	124 Å²	124	40.8 Å²	40.8	75%	0.752	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	144.4	174.5	-178.2	0	0	0	0	110.4	H40	V38-H40 PolarHBondContact O-N 3.23Å
39	D	88.2	Confident	92.3	Very high	90 Å²	90	40.5 Å²	40.5	48%	0.481	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	3.1	-175	-71.3	-58.2	0	0	0	116.1	N64 R68	D39-N64 HydrophobicContact CB-CB 4.48Å; D39-N64 WeakPolarHBondContact O-CA 3.41Å; D39-N64 PolarHBondContact O-ND2 3.12Å; D39-N64 PolarHBondContact O-OD1 2.92Å; D39-N64 PolarHBondContact OD1-ND2 2.83Å; D39-N64 VanDerWaalsContact OD1-ND2 3.16Å; D39-R68 IonicContact OD1-NH2 2.62Å
40	H	92.9	Very high	92.5	Very high	25 Å²	25	41.9 Å²	41.9	12%	0.116	21%	0.212	C	C	.	.			trans	47	67.6	179.8	-54.8	-51.8	0	0	0	112.4	A33 N34 A35 I37 V38 I42 A65 L87 D88 Y126	A33-H40 HydrophobicContact CB-CB 4.41Å; N34-H40 WeakPolarHBondContact O-CA 3.45Å; N34-H40 PolarHBondContact O-ND1 2.86Å; A35-H40 PolarHBondContact O-CE1 2.89Å; A35-H40 PolarHBondContact O-ND1 2.96Å; I37-H40 PolarHBondContact O-N 2.75Å; I37-H40 VanDerWaalsContact O-N 3.13Å; V38-H40 PolarHBondContact O-N 3.23Å; H40-I42 PolarHBondContact O-N 3.39Å; H40-A65 HydrophobicContact CB-CB 3.86Å; H40-A65 WeakPolarHBondContact O-CB 3.37Å; H40-A65 PolarHBondContact O-N 3.41Å; H40-L87 PolarHBondContact NE2-O 2.78Å; H40-D88 IonicContact NE2-OD1 2.79Å; H40-Y126 AromaticContact CE1-CE2 3.91Å; H40-Y126 AromaticContact ND1-CE2 3.93Å
41	P	95	Very high	92.4	Very high	19 Å²	19	48.4 Å²	48.4	12%	0.123	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-64.6	136.9	-175	27.1	-34.4	0	0	0	111	A33 N34 I37 I43 Q63	A33-P41 WeakPolarHBondContact CA-O 3.39Å; N34-P41 HydrophobicContact CB-CG 4.33Å; N34-P41 PolarHBondContact N-O 3.13Å; I37-P41 HydrophobicContact CB-CG 3.85Å; I37-P41 HydrophobicContact CD1-CG 4.19Å; I37-P41 HydrophobicContact CG2-CG 3.79Å; P41-I43 PolarHBondContact O-N 3.32Å; P41-Q63 WeakPolarHBondContact CA-O 3.43Å
42	I	95	Very high	92.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	121.7	175.4	-61.6	165.2	0	0	0	109.2	L31 H40 Y44 V45 M60 H62 Q63	L31-I42 HydrophobicContact CB-CG2 4.28Å; L31-I42 HydrophobicContact CD1-CG1 4.27Å; L31-I42 HydrophobicContact CD2-CD1 4.14Å; L31-I42 HydrophobicContact CD2-CG1 4.5Å; H40-I42 PolarHBondContact O-N 3.39Å; I42-Y44 WeakPolarHBondContact CG2-O 3.41Å; I42-V45 HydrophobicContact CG2-CG2 3.46Å; I42-V45 VanDerWaalsContact CG2-CG2 3.46Å; I42-M60 HydrophobicContact CD1-CE 3.78Å; I42-H62 PolarHBondContact O-N 2.92Å; I42-Q63 HydrophobicContact CD1-CB 4.46Å; I42-Q63 WeakPolarHBondContact CG1-O 3.28Å; I42-Q63 PolarHBondContact N-O 2.92Å
43	I	93.8	Very high	92.1	Very high	73 Å²	73	49.2 Å²	49.2	37%	0.374	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-20	179.1	59.2	166.9	0	0	0	112.9	I32 N34 P41 L125	I32-I43 HydrophobicContact CB-CG1 4.19Å; I32-I43 HydrophobicContact CG2-CD1 3.94Å; I32-I43 HydrophobicContact CG2-CG1 3.97Å; I32-I43 VanDerWaalsContact O-CG1 3.25Å; I32-I43 WeakPolarHBondContact O-CG1 3.27Å; I32-I43 PolarHBondContact O-N 2.9Å; N34-I43 HydrophobicContact CB-CG2 4.16Å; P41-I43 PolarHBondContact O-N 3.32Å; I43-L125 HydrophobicContact CD1-CD2 3.47Å; I43-L125 VanDerWaalsContact CD1-CD2 3.47Å
44	Y	94.2	Very high	91.9	Very high	63 Å²	63	52.6 Å²	52.6	25%	0.247	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	147	-179.7	178.4	-94.6	0	0	0	111.4	L16 L20 L30 L31 I32 I42 N46	L16-Y44 HydrophobicContact CD1-CD1 3.94Å; L16-Y44 HydrophobicContact CD1-CD2 4.46Å; L16-Y44 HydrophobicContact CD1-CE1 3.94Å; L16-Y44 HydrophobicContact CD1-CE2 4.45Å; L16-Y44 HydrophobicContact CD1-CG 4.21Å; L16-Y44 HydrophobicContact CD2-CD2 4.47Å; L16-Y44 HydrophobicContact CD2-CE2 4.31Å; L20-Y44 HydrophobicContact CD2-CE1 3.98Å; L20-Y44 WeakPolarHBondContact CD2-OH 3.42Å; L30-Y44 HydrophobicContact CD2-CD1 4.15Å; L30-Y44 HydrophobicContact CD2-CE1 4.13Å; L31-Y44 CarbonylContact C-O 3.5Å; L31-Y44 VanDerWaalsContact CA-O 3.27Å; L31-Y44 WeakPolarHBondContact CA-O 3.41Å; I32-Y44 HydrophobicContact CD1-CD1 3.88Å; I32-Y44 HydrophobicContact CD1-CG 4.37Å; I32-Y44 HydrophobicContact CG1-CD1 4.14Å; I32-Y44 PolarHBondContact N-O 3.32Å; I32-Y44 PolarHBondContact O-N 3.23Å; I42-Y44 WeakPolarHBondContact CG2-O 3.41Å; Y44-N46 HydrophobicContact CE1-CB 4.3Å
45	V	92.9	Very high	91.8	Very high	8 Å²	8	53 Å²	53	5%	0.048	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	134.6	177.2	-180	0	0	0	0	108.4	L30 L31 I42 F49 T50 M60	L30-V45 CarbonylContact O-C 3.53Å; L30-V45 WeakPolarHBondContact O-CA 3.42Å; L31-V45 HydrophobicContact CB-CG2 4.15Å; I42-V45 HydrophobicContact CG2-CG2 3.46Å; I42-V45 VanDerWaalsContact CG2-CG2 3.46Å; V45-F49 HydrophobicContact CG1-CB 3.57Å; V45-F49 HydrophobicContact CG1-CD1 3.21Å; V45-F49 HydrophobicContact CG1-CE1 4.04Å; V45-F49 HydrophobicContact CG1-CG 3.57Å; V45-T50 HydrophobicContact CG1-CG2 4.08Å; V45-M60 HydrophobicContact CG2-CB 3.97Å
46	N	92.3	Very high	91.9	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.011	28%	0.275	C	S	.	.			trans	-80.2	164.3	176.2	80.9	-18.6	0	0	0	112.5	L20 S24 T28 L30 Y44 S48 F49 T50	L20-N46 HydrophobicContact CD2-CB 4.3Å; S24-N46 PolarHBondContact OG-ND2 2.9Å; T28-N46 PolarHBondContact O-ND2 2.93Å; L30-N46 HydrophobicContact CB-CB 4.07Å; L30-N46 VanDerWaalsContact N-CG 3.35Å; L30-N46 PolarHBondContact N-OD1 2.85Å; L30-N46 PolarHBondContact O-N 3.2Å; L30-N46 PolarHBondContact O-OD1 3.31Å; Y44-N46 HydrophobicContact CE1-CB 4.3Å; N46-S48 VanDerWaalsContact C-N 3.31Å; N46-S48 PolarHBondContact O-N 2.97Å; N46-F49 PolarHBondContact O-N 3.41Å; N46-F49 VanDerWaalsContact OD1-CB 3.23Å; N46-F49 WeakPolarHBondContact OD1-CB 3.35Å; N46-F49 PolarHBondContact OD1-N 3.07Å; N46-T50 PolarHBondContact O-N 2.61Å
47	E	92	Very high	91.9	Very high	128 Å²	128	50.1 Å²	50.1	60%	0.598	26%	0.261	S	S	*	.	H	α-helix	trans	-66.3	-30.6	-179	-161.8	-168.9	149.7	0	0	113.2	F49 T50 K51	E47-F49 VanDerWaalsContact C-N 3.31Å; E47-F49 PolarHBondContact O-N 3.27Å; E47-T50 PolarHBondContact O-N 3.04Å; E47-T50 PolarHBondContact O-OG1 2.98Å; E47-K51 HydrophobicContact CG-CD 4.49Å; E47-K51 WeakPolarHBondContact O-CG 3.14Å; E47-K51 PolarHBondContact O-N 3.38Å; E47-K51 VanDerWaalsContact O-N 3.1Å; E47-K51 WeakPolarHBondContact OE1-CE 3.09Å; E47-K51 IonicContact OE1-NZ 3.22Å; E47-K51 PolarHBondContact OE1-NZ 2.65Å
48	S	89.2	Confident	91.9	Very high	16 Å²	16	56.5 Å²	56.5	11%	0.112	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-37.7	176.3	-56.4	0	0	0	0	111.7	T25 T28 N46 K51 M52	T25-S48 PolarHBondContact O-OG 2.98Å; T28-S48 WeakPolarHBondContact O-CB 3.29Å; N46-S48 VanDerWaalsContact C-N 3.31Å; N46-S48 PolarHBondContact O-N 2.97Å; S48-K51 PolarHBondContact O-N 2.87Å; S48-M52 VanDerWaalsContact O-CB 3.3Å; S48-M52 WeakPolarHBondContact O-CB 3.18Å; S48-M52 PolarHBondContact O-N 2.94Å
49	F	91.9	Very high	92.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-42.6	176.8	-178.6	-83.2	0	0	0	112.1	L31 V45 N46 E47 K51 M52 T53 M60 L70 F130	L31-F49 HydrophobicContact CD2-CE2 4.12Å; L31-F49 HydrophobicContact CD2-CZ 4.36Å; V45-F49 HydrophobicContact CG1-CB 3.57Å; V45-F49 HydrophobicContact CG1-CD1 3.21Å; V45-F49 HydrophobicContact CG1-CE1 4.04Å; V45-F49 HydrophobicContact CG1-CG 3.57Å; N46-F49 PolarHBondContact O-N 3.41Å; N46-F49 VanDerWaalsContact OD1-CB 3.23Å; N46-F49 WeakPolarHBondContact OD1-CB 3.35Å; N46-F49 PolarHBondContact OD1-N 3.07Å; E47-F49 VanDerWaalsContact C-N 3.31Å; E47-F49 PolarHBondContact O-N 3.27Å; F49-K51 VanDerWaalsContact C-N 3.34Å; F49-K51 PolarHBondContact O-N 3.46Å; F49-M52 HydrophobicContact CD2-CE 4.07Å; F49-M52 HydrophobicContact CE2-CE 4.43Å; F49-M52 PolarHBondContact O-N 3.38Å; F49-T53 HydrophobicContact CD1-CG2 4.2Å; F49-T53 HydrophobicContact CD2-CG2 4.42Å; F49-T53 HydrophobicContact CE1-CG2 3.84Å; F49-T53 HydrophobicContact CE2-CG2 4.07Å; F49-T53 HydrophobicContact CG-CG2 4.49Å; F49-T53 HydrophobicContact CZ-CG2 3.79Å; F49-T53 WeakPolarHBondContact O-CG2 3.32Å; F49-T53 PolarHBondContact O-N 3.28Å; F49-T53 PolarHBondContact O-OG1 2.93Å; F49-M60 HydrophobicContact CE1-CE 3.88Å; F49-M60 HydrophobicContact CE1-CG 3.92Å; F49-M60 HydrophobicContact CE1-SD 4.16Å; F49-M60 HydrophobicContact CZ-CE 3.92Å; F49-L70 HydrophobicContact CZ-CD1 3.98Å; F49-F130 HydrophobicContact CD2-CD1 4.5Å; F49-F130 AromaticContact CD2-CD2 3.8Å; F49-F130 HydrophobicContact CD2-CD2 3.8Å; F49-F130 HydrophobicContact CD2-CE2 4.15Å; F49-F130 HydrophobicContact CD2-CG 4.03Å; F49-F130 AromaticContact CE2-CD1 3.94Å; F49-F130 HydrophobicContact CE2-CD1 3.94Å; F49-F130 AromaticContact CE2-CD2 3.66Å; F49-F130 HydrophobicContact CE2-CD2 3.66Å; F49-F130 AromaticContact CE2-CE1 3.87Å; F49-F130 HydrophobicContact CE2-CE1 3.87Å; F49-F130 AromaticContact CE2-CE2 3.6Å; F49-F130 HydrophobicContact CE2-CE2 3.6Å; F49-F130 AromaticContact CE2-CG 3.87Å; F49-F130 HydrophobicContact CE2-CG 3.87Å; F49-F130 AromaticContact CE2-CZ 3.71Å; F49-F130 HydrophobicContact CE2-CZ 3.71Å; F49-F130 HydrophobicContact CZ-CZ 4.48Å
50	T	92	Very high	92.2	Very high	30 Å²	30	50 Å²	50	18%	0.184	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-40	179.4	59.8	0	0	0	0	111.1	V45 N46 E47 N54 Y55	V45-T50 HydrophobicContact CG1-CG2 4.08Å; N46-T50 PolarHBondContact O-N 2.61Å; E47-T50 PolarHBondContact O-N 3.04Å; E47-T50 PolarHBondContact O-OG1 2.98Å; T50-N54 VanDerWaalsContact O-CA 3.29Å; T50-N54 WeakPolarHBondContact O-CA 3.41Å; T50-N54 PolarHBondContact O-N 3.22Å; T50-Y55 VanDerWaalsContact CA-O 3.27Å; T50-Y55 WeakPolarHBondContact CA-O 3.4Å; T50-Y55 WeakPolarHBondContact CB-O 3.49Å; T50-Y55 WeakPolarHBondContact CG2-O 3.33Å
51	K	90.3	Very high	92.2	Very high	137 Å²	137	51.9 Å²	51.9	60%	0.596	25%	0.248	S	C	*	.	H	α-helix	trans	-63.9	-39.5	172.3	-76.1	170.4	168.6	163	0	112.9	E47 S48 F49 N54	E47-K51 HydrophobicContact CG-CD 4.49Å; E47-K51 WeakPolarHBondContact O-CG 3.14Å; E47-K51 PolarHBondContact O-N 3.38Å; E47-K51 VanDerWaalsContact O-N 3.1Å; E47-K51 WeakPolarHBondContact OE1-CE 3.09Å; E47-K51 IonicContact OE1-NZ 3.22Å; E47-K51 PolarHBondContact OE1-NZ 2.65Å; S48-K51 PolarHBondContact O-N 2.87Å; F49-K51 VanDerWaalsContact C-N 3.34Å; F49-K51 PolarHBondContact O-N 3.46Å; K51-N54 PolarHBondContact O-OD1 3.2Å
52	M	88.2	Confident	92	Very high	17 Å²	17	58 Å²	58	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-69.8	-41	-178.5	-177.6	-176.9	67.8	0	0	112.2	S48 F49 K101 I107 F130 D132	S48-M52 VanDerWaalsContact O-CB 3.3Å; S48-M52 WeakPolarHBondContact O-CB 3.18Å; S48-M52 PolarHBondContact O-N 2.94Å; F49-M52 HydrophobicContact CD2-CE 4.07Å; F49-M52 HydrophobicContact CE2-CE 4.43Å; F49-M52 PolarHBondContact O-N 3.38Å; M52-K101 WeakPolarHBondContact O-CD 3.45Å; M52-K101 WeakPolarHBondContact O-CE 3.27Å; M52-K101 PolarHBondContact O-NZ 3.07Å; M52-I107 HydrophobicContact CG-CD1 3.43Å; M52-I107 VanDerWaalsContact CG-CD1 3.43Å; M52-I107 HydrophobicContact SD-CD1 3.91Å; M52-F130 HydrophobicContact CE-CB 3.31Å; M52-F130 HydrophobicContact CE-CD1 3.98Å; M52-F130 HydrophobicContact CE-CG 3.87Å; M52-F130 HydrophobicContact SD-CB 4.18Å; M52-D132 HydrophobicContact SD-CB 4.22Å
53	T	91.2	Very high	91.9	Very high	4 Å²	4	61.4 Å²	61.4	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-97	-15.5	-173.3	61.3	0	0	0	0	114.3	F49 Y55 L70 K101 K102	F49-T53 HydrophobicContact CD1-CG2 4.2Å; F49-T53 HydrophobicContact CD2-CG2 4.42Å; F49-T53 HydrophobicContact CE1-CG2 3.84Å; F49-T53 HydrophobicContact CE2-CG2 4.07Å; F49-T53 HydrophobicContact CG-CG2 4.49Å; F49-T53 HydrophobicContact CZ-CG2 3.79Å; F49-T53 WeakPolarHBondContact O-CG2 3.32Å; F49-T53 PolarHBondContact O-N 3.28Å; F49-T53 PolarHBondContact O-OG1 2.93Å; T53-Y55 WeakPolarHBondContact O-CD2 3.09Å; T53-Y55 PolarHBondContact O-N 3.15Å; T53-Y55 PolarHBondContact OG1-N 3.29Å; T53-L70 HydrophobicContact CG2-CD1 3.78Å; T53-L70 HydrophobicContact CG2-CD2 4.06Å; T53-K101 CarbonylContact O-C 3.31Å; T53-K101 WeakPolarHBondContact O-CA 3.35Å; T53-K101 WeakPolarHBondContact O-CB 3.23Å; T53-K102 PolarHBondContact O-N 3.4Å
54	N	91	Very high	91.8	Very high	71 Å²	71	58.8 Å²	58.8	38%	0.38	28%	0.277	S	S	.	.			trans	63.3	13.1	-169	-62.6	-27.5	0	0	0	114.7	T50 K51 K102	T50-N54 VanDerWaalsContact O-CA 3.29Å; T50-N54 WeakPolarHBondContact O-CA 3.41Å; T50-N54 PolarHBondContact O-N 3.22Å; K51-N54 PolarHBondContact O-OD1 3.2Å; N54-K102 HydrophobicContact CB-CB 3.81Å; N54-K102 WeakPolarHBondContact O-CD 3.13Å
55	Y	92.6	Very high	91.7	Very high	44 Å²	44	55.8 Å²	55.8	17%	0.173	27%	0.265	C	S	.	.			trans	-91.9	142.3	170.7	-75.7	-94.9	0	0	0	110.7	T50 T53 E59 M60 Q69 L70 K102	T50-Y55 VanDerWaalsContact CA-O 3.27Å; T50-Y55 WeakPolarHBondContact CA-O 3.4Å; T50-Y55 WeakPolarHBondContact CB-O 3.49Å; T50-Y55 WeakPolarHBondContact CG2-O 3.33Å; T53-Y55 WeakPolarHBondContact O-CD2 3.09Å; T53-Y55 PolarHBondContact O-N 3.15Å; T53-Y55 PolarHBondContact OG1-N 3.29Å; Y55-E59 HydrophobicContact CD1-CB 4.25Å; Y55-M60 HydrophobicContact CD1-SD 4.27Å; Y55-M60 HydrophobicContact CG-SD 4.01Å; Y55-Q69 HydrophobicContact CE1-CB 4.32Å; Y55-Q69 PolarHBondContact OH-O 2.86Å; Y55-L70 HydrophobicContact CD2-CD2 3.57Å; Y55-L70 HydrophobicContact CE2-CD2 3.39Å; Y55-K102 HydrophobicContact CD1-CD 4.37Å; Y55-K102 HydrophobicContact CD2-CB 3.88Å; Y55-K102 HydrophobicContact CE1-CB 4.47Å; Y55-K102 HydrophobicContact CE1-CG 4.25Å; Y55-K102 HydrophobicContact CE2-CB 3.64Å; Y55-K102 HydrophobicContact CE2-CG 4.28Å; Y55-K102 HydrophobicContact CG-CB 4.39Å
56	T	93.3	Very high	91.6	Very high	70 Å²	70	56.1 Å²	56.1	43%	0.429	27%	0.266	S	S	.	.			trans	-79.1	155.4	175.4	64.1	0	0	0	0	110.9	R58 E59 M60	T56-R58 PolarHBondContact O-N 2.92Å; T56-E59 PolarHBondContact N-OE2 2.81Å; T56-E59 PolarHBondContact O-N 3.38Å; T56-E59 VanDerWaalsContact OG1-CD 3.27Å; T56-E59 VanDerWaalsContact OG1-CG 3.25Å; T56-E59 WeakPolarHBondContact OG1-CG 3.49Å; T56-E59 PolarHBondContact OG1-N 3.37Å; T56-E59 PolarHBondContact OG1-OE2 2.86Å; T56-E59 VanDerWaalsContact OG1-OE2 3.1Å; T56-M60 PolarHBondContact O-N 3.44Å
57	S	92	Very high	91.4	Very high	42 Å²	42	56 Å²	56	29%	0.294	27%	0.266	S	S	.	.	H	α-helix	trans	-56.9	-33.9	177.4	-175.6	0	0	0	0	112.4	E59 M60 M61	S57-E59 VanDerWaalsContact C-N 3.34Å; S57-M60 PolarHBondContact O-N 2.91Å; S57-M61 WeakPolarHBondContact O-CB 3.5Å; S57-M61 VanDerWaalsContact O-CG 3.27Å; S57-M61 WeakPolarHBondContact O-CG 3.17Å; S57-M61 PolarHBondContact O-N 3.17Å
58	R	92.9	Very high	91.3	Very high	224 Å²	224	57.2 Å²	57.2	85%	0.845	27%	0.265	S	S	*	.	H	α-helix	trans	-66.9	-34.3	177.7	-174.7	-177.6	-69.2	165.7	-1.4	112.5	T56	T56-R58 PolarHBondContact O-N 2.92Å
59	E	92.4	Very high	91.3	Very high	76 Å²	76	59.5 Å²	59.5	36%	0.355	27%	0.274	S	S	.	.	H	α-helix	trans	-75	-30.8	178.8	-71.6	167.3	155.8	0	0	112.1	Y55 T56 S57 Q63 K102	Y55-E59 HydrophobicContact CD1-CB 4.25Å; T56-E59 PolarHBondContact N-OE2 2.81Å; T56-E59 PolarHBondContact O-N 3.38Å; T56-E59 VanDerWaalsContact OG1-CD 3.27Å; T56-E59 VanDerWaalsContact OG1-CG 3.25Å; T56-E59 WeakPolarHBondContact OG1-CG 3.49Å; T56-E59 PolarHBondContact OG1-N 3.37Å; T56-E59 PolarHBondContact OG1-OE2 2.86Å; T56-E59 VanDerWaalsContact OG1-OE2 3.1Å; S57-E59 VanDerWaalsContact C-N 3.34Å; E59-Q63 WeakPolarHBondContact O-CG 3.37Å; E59-K102 IonicContact OE1-NZ 2.96Å; E59-K102 PolarHBondContact OE1-NZ 3.24Å; E59-K102 IonicContact OE2-NZ 3.61Å; E59-K102 PolarHBondContact OE2-NZ 3.35Å
60	M	91.8	Very high	91.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-87.3	-29.9	-179.7	-66.1	-59.8	-51.5	0	0	113.7	I42 V45 F49 Y55 T56 S57 Q63 C67	I42-M60 HydrophobicContact CD1-CE 3.78Å; V45-M60 HydrophobicContact CG2-CB 3.97Å; F49-M60 HydrophobicContact CE1-CE 3.88Å; F49-M60 HydrophobicContact CE1-CG 3.92Å; F49-M60 HydrophobicContact CE1-SD 4.16Å; F49-M60 HydrophobicContact CZ-CE 3.92Å; Y55-M60 HydrophobicContact CD1-SD 4.27Å; Y55-M60 HydrophobicContact CG-SD 4.01Å; T56-M60 PolarHBondContact O-N 3.44Å; S57-M60 PolarHBondContact O-N 2.91Å; M60-Q63 WeakPolarHBondContact O-CB 3.47Å; M60-Q63 WeakPolarHBondContact O-CG 3.36Å; M60-Q63 PolarHBondContact O-N 3.23Å; M60-Q63 VanDerWaalsContact O-N 3.15Å; M60-C67 HydrophobicContact CE-CB 4.39Å
61	M	91.7	Very high	91.2	Very high	65 Å²	65	60.5 Å²	60.5	32%	0.32	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	138.6	177.5	-83.3	-179.1	176	0	0	111.4	S57 Q63	S57-M61 WeakPolarHBondContact O-CB 3.5Å; S57-M61 VanDerWaalsContact O-CG 3.27Å; S57-M61 WeakPolarHBondContact O-CG 3.17Å; S57-M61 PolarHBondContact O-N 3.17Å; M61-Q63 PolarHBondContact O-N 3.16Å
62	H	91.3	Very high	91.1	Very high	149 Å²	149	55.4 Å²	55.4	69%	0.69	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	7.2	-175.1	-47.3	97.1	0	0	0	115.5	I42	I42-H62 PolarHBondContact O-N 2.92Å
63	Q	92.5	Very high	91	Very high	71 Å²	71	64.8 Å²	64.8	33%	0.332	30%	0.303	S	S	.	.	S	Bend	trans	-81.9	160.1	168.2	-57.2	-58.3	-21.8	0	0	110.9	P41 I42 E59 M60 M61	P41-Q63 WeakPolarHBondContact CA-O 3.43Å; I42-Q63 HydrophobicContact CD1-CB 4.46Å; I42-Q63 WeakPolarHBondContact CG1-O 3.28Å; I42-Q63 PolarHBondContact N-O 2.92Å; E59-Q63 WeakPolarHBondContact O-CG 3.37Å; M60-Q63 WeakPolarHBondContact O-CB 3.47Å; M60-Q63 WeakPolarHBondContact O-CG 3.36Å; M60-Q63 PolarHBondContact O-N 3.23Å; M60-Q63 VanDerWaalsContact O-N 3.15Å; M61-Q63 PolarHBondContact O-N 3.16Å
64	N	92.1	Very high	90.8	Very high	18 Å²	18	73.7 Å²	73.7	10%	0.096	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-63.2	136	178.3	-177.6	-50.9	0	0	0	110.8	D39 I66 C67 R68	D39-N64 HydrophobicContact CB-CB 4.48Å; D39-N64 WeakPolarHBondContact O-CA 3.41Å; D39-N64 PolarHBondContact O-ND2 3.12Å; D39-N64 PolarHBondContact O-OD1 2.92Å; D39-N64 PolarHBondContact OD1-ND2 2.83Å; D39-N64 VanDerWaalsContact OD1-ND2 3.16Å; N64-I66 PolarHBondContact O-N 3.31Å; N64-I66 VanDerWaalsContact O-N 3.12Å; N64-I66 WeakPolarHBondContact OD1-CB 3.4Å; N64-I66 WeakPolarHBondContact OD1-CG1 3.37Å; N64-I66 PolarHBondContact OD1-N 3.34Å; N64-C67 WeakPolarHBondContact O-CA 3.3Å; N64-C67 PolarHBondContact O-N 2.9Å; N64-R68 PolarHBondContact ND2-NH2 2.92Å
65	A	91.5	Very high	90.7	Very high	0 Å²	0	71 Å²	71	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.8	-178.9	0	0	0	0	0	114.9	A33 H40 C67 L87 I128	A33-A65 HydrophobicContact CB-CB 3.71Å; H40-A65 HydrophobicContact CB-CB 3.86Å; H40-A65 WeakPolarHBondContact O-CB 3.37Å; H40-A65 PolarHBondContact O-N 3.41Å; A65-C67 PolarHBondContact O-N 3.18Å; A65-C67 PolarHBondContact O-SG 3.45Å; A65-C67 VanDerWaalsContact O-SG 3.41Å; A65-L87 HydrophobicContact CB-CD1 3.95Å; A65-I128 HydrophobicContact CB-CD1 3.87Å
66	I	91.2	Very high	90.5	Very high	14 Å²	14	71.2 Å²	71.2	7%	0.072	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-11.5	175.9	-58.4	168.1	0	0	0	111.2	N64 H71 I80 K84 L87	N64-I66 PolarHBondContact O-N 3.31Å; N64-I66 VanDerWaalsContact O-N 3.12Å; N64-I66 WeakPolarHBondContact OD1-CB 3.4Å; N64-I66 WeakPolarHBondContact OD1-CG1 3.37Å; N64-I66 PolarHBondContact OD1-N 3.34Å; I66-H71 PolarHBondContact O-NE2 2.85Å; I66-I80 HydrophobicContact CG2-CG2 4.02Å; I66-K84 HydrophobicContact CD1-CB 3.81Å; I66-K84 HydrophobicContact CD1-CG 3.89Å; I66-L87 HydrophobicContact CD1-CD1 4.41Å; I66-L87 HydrophobicContact CG1-CD1 3.61Å
67	C	89.2	Confident	90.4	Very high	1 Å²	1	73.4 Å²	73.4	1%	0.007	34%	0.338	C	S	.	.			trans	59.3	52.7	176.2	-65.2	0	0	0	0	113.1	M60 N64 A65 Q69 L70	M60-C67 HydrophobicContact CE-CB 4.39Å; N64-C67 WeakPolarHBondContact O-CA 3.3Å; N64-C67 PolarHBondContact O-N 2.9Å; A65-C67 PolarHBondContact O-N 3.18Å; A65-C67 PolarHBondContact O-SG 3.45Å; A65-C67 VanDerWaalsContact O-SG 3.41Å; C67-Q69 PolarHBondContact O-N 2.85Å; C67-L70 HydrophobicContact CB-CB 4.41Å; C67-L70 HydrophobicContact CB-CD1 3.84Å; C67-L70 HydrophobicContact CB-CG 4.14Å; C67-L70 WeakPolarHBondContact O-CB 3.43Å; C67-L70 PolarHBondContact O-N 3.27Å
68	R	89.2	Confident	90.4	Very high	153 Å²	153	77.1 Å²	77.1	58%	0.577	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-51.1	-28.1	179.4	-63.9	-174.6	-174.2	165.5	7.5	113.6	D39 N64 L70 H71	D39-R68 IonicContact OD1-NH2 2.62Å; N64-R68 PolarHBondContact ND2-NH2 2.92Å; R68-L70 VanDerWaalsContact C-N 3.25Å; R68-L70 PolarHBondContact O-N 3.38Å; R68-H71 WeakPolarHBondContact O-CB 3.5Å; R68-H71 PolarHBondContact O-N 3.36Å
69	Q	88.4	Confident	90.3	Very high	64 Å²	64	67.3 Å²	67.3	30%	0.299	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-65.4	-26.6	177.7	-61.9	75.6	11.9	0	0	113.2	Y55 C67 H71	Y55-Q69 HydrophobicContact CE1-CB 4.32Å; Y55-Q69 PolarHBondContact OH-O 2.86Å; C67-Q69 PolarHBondContact O-N 2.85Å; Q69-H71 VanDerWaalsContact C-N 3.34Å
70	L	91	Very high	90.2	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.01	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-89	-2.5	178.9	-59.6	179.6	0	0	0	112.2	F49 T53 Y55 C67 R68 L99 Y100	F49-L70 HydrophobicContact CZ-CD1 3.98Å; T53-L70 HydrophobicContact CG2-CD1 3.78Å; T53-L70 HydrophobicContact CG2-CD2 4.06Å; Y55-L70 HydrophobicContact CD2-CD2 3.57Å; Y55-L70 HydrophobicContact CE2-CD2 3.39Å; C67-L70 HydrophobicContact CB-CB 4.41Å; C67-L70 HydrophobicContact CB-CD1 3.84Å; C67-L70 HydrophobicContact CB-CG 4.14Å; C67-L70 WeakPolarHBondContact O-CB 3.43Å; C67-L70 PolarHBondContact O-N 3.27Å; R68-L70 VanDerWaalsContact C-N 3.25Å; R68-L70 PolarHBondContact O-N 3.38Å; L70-L99 HydrophobicContact CB-CB 4.15Å; L70-L99 HydrophobicContact CB-CD1 4.39Å; L70-L99 HydrophobicContact CB-CD2 3.98Å; L70-L99 HydrophobicContact CB-CG 4.4Å; L70-L99 HydrophobicContact CD1-CD1 4.17Å; L70-L99 CarbonylContact O-C 3.52Å; L70-L99 WeakPolarHBondContact O-CA 3.37Å; L70-Y100 WeakPolarHBondContact CD2-O 3.36Å; L70-Y100 PolarHBondContact O-N 3.25Å
71	H	91.2	Very high	90.2	Very high	49 Å²	49	70.8 Å²	70.8	23%	0.227	34%	0.338	C	S	.	.			trans	-81.9	140.6	178.5	-60.4	177.6	0	0	0	110.9	I66 R68 Q69 T75 I80	I66-H71 PolarHBondContact O-NE2 2.85Å; R68-H71 WeakPolarHBondContact O-CB 3.5Å; R68-H71 PolarHBondContact O-N 3.36Å; Q69-H71 VanDerWaalsContact C-N 3.34Å; H71-T75 HydrophobicContact CB-CG2 4.48Å; H71-I80 WeakPolarHBondContact ND1-CD1 3.25Å
72	G	88	Confident	90.3	Very high	29 Å²	29	73.7 Å²	73.7	30%	0.299	35%	0.345	S	S	.	.			trans	-145.2	-170	169.6	0	0	0	0	0	112.4	R74 T75 Y100	G72-R74 VanDerWaalsContact C-N 3.26Å; G72-R74 PolarHBondContact O-N 3.35Å; G72-T75 PolarHBondContact N-OG1 2.98Å; G72-T75 WeakPolarHBondContact O-CB 3.33Å; G72-T75 PolarHBondContact O-N 3.35Å; G72-T75 PolarHBondContact O-OG1 3.1Å; G72-Y100 VanDerWaalsContact C-CE2 3.43Å; G72-Y100 VanDerWaalsContact N-CD2 3.29Å
73	K	86.6	Confident	90.3	Very high	214 Å²	214	66.6 Å²	66.6	93%	0.93	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.8	-165.5	-65.3	-174.9	178.2	-175.8	0	115.9
74	R	86.3	Confident	90.3	Very high	191 Å²	191	68.3 Å²	68.3	72%	0.721	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	0	-179.5	-72.1	-176.6	171.2	-177.7	-2.3	114.4	G72 S76 T98 Y100 M106	G72-R74 VanDerWaalsContact C-N 3.26Å; G72-R74 PolarHBondContact O-N 3.35Å; R74-S76 PolarHBondContact O-N 3.48Å; R74-T98 PolarHBondContact O-OG1 2.91Å; R74-Y100 WeakPolarHBondContact CB-OH 3.47Å; R74-Y100 PolarHBondContact N-OH 2.93Å; R74-M106 HydrophobicContact CB-CE 3.29Å; R74-M106 HydrophobicContact CG-CE 3.89Å
75	T	88.9	Confident	90.3	Very high	15 Å²	15	71 Å²	71	9%	0.092	33%	0.333	C	S	.	.	S	Bend	trans	-66.6	123.5	178.1	-40.2	0	0	0	0	109.6	H71 G72 I77 I80 I97 T98 L99	H71-T75 HydrophobicContact CB-CG2 4.48Å; G72-T75 PolarHBondContact N-OG1 2.98Å; G72-T75 WeakPolarHBondContact O-CB 3.33Å; G72-T75 PolarHBondContact O-N 3.35Å; G72-T75 PolarHBondContact O-OG1 3.1Å; T75-I77 PolarHBondContact O-N 2.82Å; T75-I80 HydrophobicContact CG2-CD1 3.81Å; T75-I80 HydrophobicContact CG2-CG1 4.08Å; T75-I97 HydrophobicContact CG2-CD1 3.62Å; T75-I97 HydrophobicContact CG2-CG1 3.61Å; T75-T98 WeakPolarHBondContact CA-OG1 3.18Å; T75-T98 WeakPolarHBondContact CG2-O 3.1Å; T75-T98 PolarHBondContact N-OG1 2.8Å; T75-T98 PolarHBondContact OG1-O 2.86Å; T75-L99 HydrophobicContact CG2-CD2 4.49Å
76	S	89.4	Confident	90.3	Very high	49 Å²	49	71 Å²	71	34%	0.343	33%	0.333	S	S	.	.			trans	-65.8	120.6	179.2	39	0	0	0	0	111.3	R74 N78 S79 I80	R74-S76 PolarHBondContact O-N 3.48Å; S76-N78 VanDerWaalsContact C-N 3.29Å; S76-N78 PolarHBondContact O-N 3Å; S76-S79 WeakPolarHBondContact O-CB 3.5Å; S76-S79 PolarHBondContact O-N 2.66Å; S76-S79 VanDerWaalsContact O-N 3.13Å; S76-S79 WeakPolarHBondContact OG-CB 3.4Å; S76-S79 PolarHBondContact OG-OG 3.26Å; S76-I80 PolarHBondContact O-N 3.43Å
77	I	91	Very high	90.3	Very high	116 Å²	116	70.3 Å²	70.3	60%	0.595	33%	0.329	S	S	*	.	H	α-helix	trans	-58.7	-41.6	175.5	-76.8	160.5	0	0	0	111.1	T75 S79 I80 E81	T75-I77 PolarHBondContact O-N 2.82Å; I77-S79 VanDerWaalsContact C-N 3.26Å; I77-S79 PolarHBondContact O-N 3.5Å; I77-I80 WeakPolarHBondContact O-CB 3.3Å; I77-I80 PolarHBondContact O-N 2.61Å; I77-E81 PolarHBondContact O-N 3.28Å
78	N	91.6	Very high	90.4	Very high	120 Å²	120	74.9 Å²	74.9	64%	0.642	35%	0.354	S	S	*	.	H	α-helix	trans	-58.7	-36.2	176.9	-62	1.4	0	0	0	112.6	S76 R82	S76-N78 VanDerWaalsContact C-N 3.29Å; S76-N78 PolarHBondContact O-N 3Å; N78-R82 WeakPolarHBondContact O-CG 3.37Å; N78-R82 PolarHBondContact O-N 2.82Å; N78-R82 VanDerWaalsContact O-N 3.11Å
79	S	90.2	Very high	90.4	Very high	17 Å²	17	74.6 Å²	74.6	12%	0.119	36%	0.359	C	S	.	.	H	α-helix	trans	-69.3	-38.2	176.9	-65	0	0	0	0	111.5	S76 I77 L83 V95 E96	S76-S79 WeakPolarHBondContact O-CB 3.5Å; S76-S79 PolarHBondContact O-N 2.66Å; S76-S79 VanDerWaalsContact O-N 3.13Å; S76-S79 WeakPolarHBondContact OG-CB 3.4Å; S76-S79 PolarHBondContact OG-OG 3.26Å; I77-S79 VanDerWaalsContact C-N 3.26Å; I77-S79 PolarHBondContact O-N 3.5Å; S79-L83 VanDerWaalsContact O-CG 3.28Å; S79-L83 WeakPolarHBondContact O-CG 3.43Å; S79-L83 PolarHBondContact O-N 3.2Å; S79-L83 VanDerWaalsContact O-N 3.1Å; S79-V95 WeakPolarHBondContact OG-CG1 3.49Å; S79-E96 PolarHBondContact OG-O 2.92Å
80	I	91.6	Very high	90.4	Very high	39 Å²	39	72.2 Å²	72.2	20%	0.2	35%	0.351	C	S	.	.	H	α-helix	trans	-65.5	-44	176.8	-62	168.1	0	0	0	110.7	I66 H71 T75 S76 I77 L83 K84 I97	I66-I80 HydrophobicContact CG2-CG2 4.02Å; H71-I80 WeakPolarHBondContact ND1-CD1 3.25Å; T75-I80 HydrophobicContact CG2-CD1 3.81Å; T75-I80 HydrophobicContact CG2-CG1 4.08Å; S76-I80 PolarHBondContact O-N 3.43Å; I77-I80 WeakPolarHBondContact O-CB 3.3Å; I77-I80 PolarHBondContact O-N 2.61Å; I80-L83 PolarHBondContact O-N 3.43Å; I80-K84 WeakPolarHBondContact O-CB 3.29Å; I80-K84 PolarHBondContact O-N 3.48Å; I80-I97 HydrophobicContact CG1-CD1 3.94Å
81	E	92.1	Very high	90.3	Very high	111 Å²	111	76.2 Å²	76.2	52%	0.519	37%	0.367	S	S	.	.	H	α-helix	trans	-64.4	-41	178.5	-73.2	-178.4	175.6	0	0	112.2	I77 K84 N85	I77-E81 PolarHBondContact O-N 3.28Å; E81-K84 WeakPolarHBondContact O-CB 3.32Å; E81-K84 PolarHBondContact O-N 3.2Å; E81-N85 VanDerWaalsContact O-CG 3.25Å; E81-N85 PolarHBondContact O-N 3.13Å; E81-N85 PolarHBondContact O-OD1 3.35Å
82	R	92.2	Very high	90.2	Very high	126 Å²	126	77.2 Å²	77.2	48%	0.475	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-47.3	173.7	-77.7	-174.5	63	172.2	-0.9	112.8	N78 K84 N85 A86 D93 V95	N78-R82 WeakPolarHBondContact O-CG 3.37Å; N78-R82 PolarHBondContact O-N 2.82Å; N78-R82 VanDerWaalsContact O-N 3.11Å; R82-K84 VanDerWaalsContact C-N 3.26Å; R82-K84 PolarHBondContact O-N 2.83Å; R82-N85 PolarHBondContact O-N 3.02Å; R82-A86 WeakPolarHBondContact O-CB 3.37Å; R82-A86 PolarHBondContact O-N 3.41Å; R82-D93 IonicContact CZ-OD1 3.88Å; R82-D93 IonicContact CZ-OD2 3.66Å; R82-D93 IonicContact NE-OD2 3.23Å; R82-D93 PolarHBondContact NE-OD2 3.44Å; R82-D93 IonicContact NH2-OD1 3.59Å; R82-D93 PolarHBondContact NH2-OD1 3.15Å; R82-D93 IonicContact NH2-OD2 2.85Å; R82-D93 PolarHBondContact NH2-OD2 3.24Å; R82-V95 HydrophobicContact CB-CG2 3.96Å
83	L	92.1	Very high	90.2	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-61.7	-37	177	-72.5	169.5	0	0	0	112	S79 I80 L87 V95 I97 M111 V113	S79-L83 VanDerWaalsContact O-CG 3.28Å; S79-L83 WeakPolarHBondContact O-CG 3.43Å; S79-L83 PolarHBondContact O-N 3.2Å; S79-L83 VanDerWaalsContact O-N 3.1Å; I80-L83 PolarHBondContact O-N 3.43Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 2.89Å; L83-V95 HydrophobicContact CD1-CB 4.44Å; L83-V95 HydrophobicContact CD2-CB 3.96Å; L83-V95 HydrophobicContact CD2-CG2 3.85Å; L83-V95 HydrophobicContact CG-CB 4.02Å; L83-V95 HydrophobicContact CG-CG1 4.42Å; L83-V95 HydrophobicContact CG-CG2 3.98Å; L83-I97 HydrophobicContact CD1-CD1 3.98Å; L83-M111 HydrophobicContact CB-CE 4.25Å; L83-M111 HydrophobicContact CD1-CB 4.49Å; L83-M111 HydrophobicContact CD1-CE 3.64Å; L83-M111 HydrophobicContact CD1-CG 4.45Å; L83-M111 HydrophobicContact CD1-SD 3.58Å; L83-M111 VanDerWaalsContact CD1-SD 3.58Å; L83-M111 HydrophobicContact CD2-CB 4.38Å; L83-M111 HydrophobicContact CD2-CE 3.57Å; L83-M111 HydrophobicContact CD2-CG 4.14Å; L83-M111 HydrophobicContact CD2-SD 4.12Å; L83-M111 HydrophobicContact CG-CE 4Å; L83-M111 HydrophobicContact CG-SD 4.44Å; L83-V113 HydrophobicContact CD2-CG2 3.73Å
84	K	92.4	Very high	90.4	Very high	106 Å²	106	69.4 Å²	69.4	46%	0.461	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-49.5	174.1	-173	-176	174.3	-165.5	0	111.3	I66 I80 E81 R82 A86 L87 D88	I66-K84 HydrophobicContact CD1-CB 3.81Å; I66-K84 HydrophobicContact CD1-CG 3.89Å; I80-K84 WeakPolarHBondContact O-CB 3.29Å; I80-K84 PolarHBondContact O-N 3.48Å; E81-K84 WeakPolarHBondContact O-CB 3.32Å; E81-K84 PolarHBondContact O-N 3.2Å; R82-K84 VanDerWaalsContact C-N 3.26Å; R82-K84 PolarHBondContact O-N 2.83Å; K84-A86 VanDerWaalsContact C-N 3.31Å; K84-A86 PolarHBondContact O-N 3.46Å; K84-L87 PolarHBondContact O-N 3.11Å; K84-D88 WeakPolarHBondContact CE-OD2 3.39Å; K84-D88 WeakPolarHBondContact O-CB 3.5Å; K84-D88 PolarHBondContact O-N 3.45Å
85	N	91.8	Very high	90.5	Very high	75 Å²	75	60.5 Å²	60.5	40%	0.401	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-38.7	179.2	-66.6	-8.3	0	0	0	111.9	E81 R82 L87 D88 E89	E81-N85 VanDerWaalsContact O-CG 3.25Å; E81-N85 PolarHBondContact O-N 3.13Å; E81-N85 PolarHBondContact O-OD1 3.35Å; R82-N85 PolarHBondContact O-N 3.02Å; N85-L87 VanDerWaalsContact C-N 3.33Å; N85-L87 PolarHBondContact O-N 3.12Å; N85-D88 PolarHBondContact O-N 2.86Å; N85-E89 VanDerWaalsContact O-CB 3.32Å; N85-E89 WeakPolarHBondContact O-CB 3.39Å; N85-E89 PolarHBondContact O-N 3.32Å
86	A	91.8	Very high	90.6	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.5	-37.8	176.1	0	0	0	0	0	113	R82 K84 G90 Y91 D93	R82-A86 WeakPolarHBondContact O-CB 3.37Å; R82-A86 PolarHBondContact O-N 3.41Å; K84-A86 VanDerWaalsContact C-N 3.31Å; K84-A86 PolarHBondContact O-N 3.46Å; A86-G90 WeakPolarHBondContact O-CA 3.48Å; A86-G90 PolarHBondContact O-N 2.94Å; A86-Y91 HydrophobicContact CB-CD2 4.48Å; A86-Y91 HydrophobicContact CB-CE1 4.37Å; A86-Y91 HydrophobicContact CB-CE2 4.05Å; A86-Y91 PolarHBondContact O-N 2.88Å; A86-D93 HydrophobicContact CB-CB 3.62Å
87	L	92	Very high	90.6	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-74.9	-37.4	175.9	-70.9	169	0	0	0	112.6	H40 A65 I66 L83 K84 N85 V113 Y126 I128	H40-L87 PolarHBondContact NE2-O 2.78Å; A65-L87 HydrophobicContact CB-CD1 3.95Å; I66-L87 HydrophobicContact CD1-CD1 4.41Å; I66-L87 HydrophobicContact CG1-CD1 3.61Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 2.89Å; K84-L87 PolarHBondContact O-N 3.11Å; N85-L87 VanDerWaalsContact C-N 3.33Å; N85-L87 PolarHBondContact O-N 3.12Å; L87-V113 HydrophobicContact CD2-CG1 3.5Å; L87-V113 VanDerWaalsContact CD2-CG1 3.5Å; L87-V113 HydrophobicContact CG-CG1 4.04Å; L87-Y126 HydrophobicContact CD2-CD1 4.11Å; L87-Y126 HydrophobicContact CD2-CD2 3.66Å; L87-Y126 HydrophobicContact CD2-CE2 4.08Å; L87-Y126 HydrophobicContact CD2-CG 3.69Å; L87-Y126 WeakPolarHBondContact O-CE2 3.49Å; L87-Y126 PolarHBondContact O-OH 2.89Å; L87-I128 HydrophobicContact CD1-CD1 4.49Å; L87-I128 HydrophobicContact CD2-CD1 4.01Å
88	D	90.1	Very high	90.6	Very high	97 Å²	97	55.8 Å²	55.8	52%	0.519	27%	0.267	S	S	.	.	H	α-helix	trans	-74.1	-41.4	-179.3	-71	-17.9	0	0	0	111.6	H40 K84 N85	H40-D88 IonicContact NE2-OD1 2.79Å; K84-D88 WeakPolarHBondContact CE-OD2 3.39Å; K84-D88 WeakPolarHBondContact O-CB 3.5Å; K84-D88 PolarHBondContact O-N 3.45Å; N85-D88 PolarHBondContact O-N 2.86Å
89	E	88.8	Confident	90.6	Very high	146 Å²	146	50.3 Å²	50.3	68%	0.682	24%	0.238	S	C	*	.	H	α-helix	trans	-88.3	-15.7	179.8	-66.3	-179.2	-174.9	0	0	113.5	N85 Y91	N85-E89 VanDerWaalsContact O-CB 3.32Å; N85-E89 WeakPolarHBondContact O-CB 3.39Å; N85-E89 PolarHBondContact O-N 3.32Å; E89-Y91 HydrophobicContact CB-CD1 3.6Å; E89-Y91 HydrophobicContact CB-CE1 3.76Å; E89-Y91 HydrophobicContact CG-CE1 4.35Å; E89-Y91 WeakPolarHBondContact OE2-CE1 3.21Å
90	G	88.5	Confident	90.7	Very high	14 Å²	14	51.8 Å²	51.8	14%	0.144	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	35.1	174.7	0	0	0	0	0	115.1	A86 P115 Y126	A86-G90 WeakPolarHBondContact O-CA 3.48Å; A86-G90 PolarHBondContact O-N 2.94Å; G90-P115 WeakPolarHBondContact O-CG 3.29Å; G90-Y126 VanDerWaalsContact CA-OH 3.22Å; G90-Y126 WeakPolarHBondContact CA-OH 3.38Å
91	Y	89.2	Confident	90.7	Very high	86 Å²	86	51.9 Å²	51.9	34%	0.337	24%	0.24	S	C	.	.			trans	-107.3	165.3	173	67.3	-90	0	0	0	112.3	A86 E89 D93	A86-Y91 HydrophobicContact CB-CD2 4.48Å; A86-Y91 HydrophobicContact CB-CE1 4.37Å; A86-Y91 HydrophobicContact CB-CE2 4.05Å; A86-Y91 PolarHBondContact O-N 2.88Å; E89-Y91 HydrophobicContact CB-CD1 3.6Å; E89-Y91 HydrophobicContact CB-CE1 3.76Å; E89-Y91 HydrophobicContact CG-CE1 4.35Å; E89-Y91 WeakPolarHBondContact OE2-CE1 3.21Å; Y91-D93 HydrophobicContact CD2-CB 4.23Å; Y91-D93 HydrophobicContact CE2-CB 3.75Å
92	F	89.7	Confident	90.6	Very high	71 Å²	71	51 Å²	51	31%	0.311	23%	0.234	S	C	.	.			trans	-78.9	123	175.7	176.4	-87.7	0	0	0	110.5	C112 V113 A114 I181	F92-C112 WeakPolarHBondContact CE2-SG 3.4Å; F92-C112 WeakPolarHBondContact CZ-SG 3.43Å; F92-V113 WeakPolarHBondContact CA-O 3.22Å; F92-V113 WeakPolarHBondContact CD2-O 3.34Å; F92-A114 HydrophobicContact CD2-CB 3.77Å; F92-A114 HydrophobicContact CE2-CB 4.2Å; F92-I181 HydrophobicContact CE2-CB 4.13Å; F92-I181 HydrophobicContact CE2-CG2 3.71Å; F92-I181 HydrophobicContact CZ-CB 4.1Å; F92-I181 HydrophobicContact CZ-CG2 4.16Å
93	D	88.8	Confident	90.5	Very high	19 Å²	19	49.8 Å²	49.8	10%	0.102	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	154.2	173.1	-159.5	11.6	0	0	0	111.4	R82 A86 Y91 C112 V113	R82-D93 IonicContact CZ-OD1 3.88Å; R82-D93 IonicContact CZ-OD2 3.66Å; R82-D93 IonicContact NE-OD2 3.23Å; R82-D93 PolarHBondContact NE-OD2 3.44Å; R82-D93 IonicContact NH2-OD1 3.59Å; R82-D93 PolarHBondContact NH2-OD1 3.15Å; R82-D93 IonicContact NH2-OD2 2.85Å; R82-D93 PolarHBondContact NH2-OD2 3.24Å; A86-D93 HydrophobicContact CB-CB 3.62Å; Y91-D93 HydrophobicContact CD2-CB 4.23Å; Y91-D93 HydrophobicContact CE2-CB 3.75Å; D93-C112 WeakPolarHBondContact O-CA 3.42Å; D93-V113 PolarHBondContact N-O 3.03Å; D93-V113 PolarHBondContact O-N 3.46Å
94	Q	89.5	Confident	90.1	Very high	59 Å²	59	60.2 Å²	60.2	28%	0.276	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.7	176	178.3	178.9	-23.7	0	0	109.6	I110 M111	Q94-I110 HydrophobicContact CG-CG2 3.41Å; Q94-I110 VanDerWaalsContact CG-CG2 3.41Å; Q94-M111 WeakPolarHBondContact CA-O 3.38Å
95	V	89.6	Confident	89.9	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.2	-173.8	-176.4	0	0	0	0	110.2	S79 R82 L83 M111	S79-V95 WeakPolarHBondContact OG-CG1 3.49Å; R82-V95 HydrophobicContact CB-CG2 3.96Å; L83-V95 HydrophobicContact CD1-CB 4.44Å; L83-V95 HydrophobicContact CD2-CB 3.96Å; L83-V95 HydrophobicContact CD2-CG2 3.85Å; L83-V95 HydrophobicContact CG-CB 4.02Å; L83-V95 HydrophobicContact CG-CG1 4.42Å; L83-V95 HydrophobicContact CG-CG2 3.98Å; V95-M111 PolarHBondContact N-O 2.84Å; V95-M111 PolarHBondContact O-N 3.37Å
96	E	89.9	Confident	89.8	Confident	71 Å²	71	56.6 Å²	56.6	33%	0.332	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.8	166.3	-51.9	-161.4	162.4	0	0	109.2	S79 I110 R137	S79-E96 PolarHBondContact OG-O 2.92Å; E96-I110 HydrophobicContact CG-CD1 4.44Å; E96-I110 HydrophobicContact CG-CG1 4.14Å; E96-R137 IonicContact OE2-NH2 3.06Å; E96-R137 PolarHBondContact OE2-NH2 2.71Å
97	I	90.2	Very high	89.7	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	137.5	-176.8	-170.7	165.8	0	0	0	110.6	T75 I80 L83 L99 V109 M111	T75-I97 HydrophobicContact CG2-CD1 3.62Å; T75-I97 HydrophobicContact CG2-CG1 3.61Å; I80-I97 HydrophobicContact CG1-CD1 3.94Å; L83-I97 HydrophobicContact CD1-CD1 3.98Å; I97-L99 HydrophobicContact CD1-CD2 4.09Å; I97-L99 HydrophobicContact CG1-CD2 4.04Å; I97-L99 HydrophobicContact CG1-CG 4.48Å; I97-L99 HydrophobicContact CG2-CD1 4.19Å; I97-L99 HydrophobicContact CG2-CD2 4.26Å; I97-L99 HydrophobicContact CG2-CG 4.03Å; I97-V109 PolarHBondContact N-O 3.12Å; I97-V109 PolarHBondContact O-N 3.1Å; I97-V109 VanDerWaalsContact O-O 3.07Å; I97-M111 HydrophobicContact CG2-CB 4.19Å
98	T	90.4	Very high	89.5	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.043	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.8	170.9	58.8	0	0	0	0	109.7	R74 T75 M106 W108	R74-T98 PolarHBondContact O-OG1 2.91Å; T75-T98 WeakPolarHBondContact CA-OG1 3.18Å; T75-T98 WeakPolarHBondContact CG2-O 3.1Å; T75-T98 PolarHBondContact N-OG1 2.8Å; T75-T98 PolarHBondContact OG1-O 2.86Å; T98-M106 HydrophobicContact CG2-CE 4.21Å; T98-M106 HydrophobicContact CG2-SD 4.42Å; T98-W108 HydrophobicContact CG2-CD2 3.49Å; T98-W108 VanDerWaalsContact CG2-CD2 3.49Å; T98-W108 VanDerWaalsContact CG2-CE2 3.49Å; T98-W108 HydrophobicContact CG2-CE3 3.42Å; T98-W108 VanDerWaalsContact CG2-CE3 3.42Å; T98-W108 HydrophobicContact CG2-CG 4.28Å; T98-W108 HydrophobicContact CG2-CH2 3.39Å; T98-W108 HydrophobicContact CG2-CZ2 3.46Å; T98-W108 VanDerWaalsContact CG2-CZ2 3.46Å; T98-W108 HydrophobicContact CG2-CZ3 3.37Å
99	L	91.9	Very high	89.4	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	164.6	179.1	-63.4	176.5	0	0	0	110.3	L70 T75 I97 M106 I107 V109 F130	L70-L99 HydrophobicContact CB-CB 4.15Å; L70-L99 HydrophobicContact CB-CD1 4.39Å; L70-L99 HydrophobicContact CB-CD2 3.98Å; L70-L99 HydrophobicContact CB-CG 4.4Å; L70-L99 HydrophobicContact CD1-CD1 4.17Å; L70-L99 CarbonylContact O-C 3.52Å; L70-L99 WeakPolarHBondContact O-CA 3.37Å; T75-L99 HydrophobicContact CG2-CD2 4.49Å; I97-L99 HydrophobicContact CD1-CD2 4.09Å; I97-L99 HydrophobicContact CG1-CD2 4.04Å; I97-L99 HydrophobicContact CG1-CG 4.48Å; I97-L99 HydrophobicContact CG2-CD1 4.19Å; I97-L99 HydrophobicContact CG2-CD2 4.26Å; I97-L99 HydrophobicContact CG2-CG 4.03Å; L99-M106 WeakPolarHBondContact O-CA 3.44Å; L99-I107 HydrophobicContact CB-CG2 4.12Å; L99-I107 PolarHBondContact N-O 3.43Å; L99-I107 VanDerWaalsContact O-CG2 3.29Å; L99-I107 WeakPolarHBondContact O-CG2 3.22Å; L99-I107 PolarHBondContact O-N 2.97Å; L99-V109 HydrophobicContact CD1-CB 4.3Å; L99-V109 HydrophobicContact CD1-CG2 4.22Å; L99-F130 HydrophobicContact CD1-CD1 4.19Å; L99-F130 HydrophobicContact CD1-CE1 3.89Å
100	Y	92.1	Very high	89.5	Confident	48 Å²	48	49 Å²	49	19%	0.188	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.2	177.6	-72	-102	0	0	0	109.1	L70 G72 R74 S105 M106	L70-Y100 WeakPolarHBondContact CD2-O 3.36Å; L70-Y100 PolarHBondContact O-N 3.25Å; G72-Y100 VanDerWaalsContact C-CE2 3.43Å; G72-Y100 VanDerWaalsContact N-CD2 3.29Å; R74-Y100 WeakPolarHBondContact CB-OH 3.47Å; R74-Y100 PolarHBondContact N-OH 2.93Å; Y100-S105 WeakPolarHBondContact CA-O 3.22Å; Y100-M106 HydrophobicContact CE2-CE 4.2Å
101	K	91.6	Very high	89.6	Confident	41 Å²	41	48.4 Å²	48.4	18%	0.178	22%	0.217	C	C	.	.			trans	-69.8	167.6	172.9	-57.9	-169.2	-172.2	-152.4	0	110.1	M52 T53 N103 R104 S105 I107	M52-K101 WeakPolarHBondContact O-CD 3.45Å; M52-K101 WeakPolarHBondContact O-CE 3.27Å; M52-K101 PolarHBondContact O-NZ 3.07Å; T53-K101 CarbonylContact O-C 3.31Å; T53-K101 WeakPolarHBondContact O-CA 3.35Å; T53-K101 WeakPolarHBondContact O-CB 3.23Å; K101-N103 WeakPolarHBondContact CB-OD1 3.27Å; K101-N103 PolarHBondContact O-N 3.22Å; K101-N103 VanDerWaalsContact O-N 3.15Å; K101-R104 WeakPolarHBondContact O-CA 3.48Å; K101-R104 PolarHBondContact O-N 3.49Å; K101-S105 PolarHBondContact N-O 3.28Å; K101-I107 HydrophobicContact CD-CG2 4.42Å; K101-I107 HydrophobicContact CG-CB 4.27Å; K101-I107 HydrophobicContact CG-CG2 3.6Å
102	K	90.3	Very high	89.7	Confident	92 Å²	92	44.3 Å²	44.3	40%	0.4	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-34.1	177.2	-167.1	175.7	-175.8	173.7	0	113.8	T53 N54 Y55 E59 R104	T53-K102 PolarHBondContact O-N 3.4Å; N54-K102 HydrophobicContact CB-CB 3.81Å; N54-K102 WeakPolarHBondContact O-CD 3.13Å; Y55-K102 HydrophobicContact CD1-CD 4.37Å; Y55-K102 HydrophobicContact CD2-CB 3.88Å; Y55-K102 HydrophobicContact CE1-CB 4.47Å; Y55-K102 HydrophobicContact CE1-CG 4.25Å; Y55-K102 HydrophobicContact CE2-CB 3.64Å; Y55-K102 HydrophobicContact CE2-CG 4.28Å; Y55-K102 HydrophobicContact CG-CB 4.39Å; E59-K102 IonicContact OE1-NZ 2.96Å; E59-K102 PolarHBondContact OE1-NZ 3.24Å; E59-K102 IonicContact OE2-NZ 3.61Å; E59-K102 PolarHBondContact OE2-NZ 3.35Å; K102-R104 PolarHBondContact O-N 2.99Å
103	N	89.7	Confident	89.8	Confident	102 Å²	102	41 Å²	41	55%	0.545	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	10.5	175	70	-8.2	0	0	0	113.6	K101 S105	K101-N103 WeakPolarHBondContact CB-OD1 3.27Å; K101-N103 PolarHBondContact O-N 3.22Å; K101-N103 VanDerWaalsContact O-N 3.15Å; N103-S105 PolarHBondContact O-N 3.24Å; N103-S105 WeakPolarHBondContact OD1-CB 3.35Å; N103-S105 PolarHBondContact OD1-N 2.92Å; N103-S105 VanDerWaalsContact OD1-N 3.12Å; N103-S105 PolarHBondContact OD1-OG 3.44Å
104	R	84.9	Confident	90	Very high	219 Å²	219	40.2 Å²	40.2	83%	0.826	18%	0.182	S	C	*	.	S	Bend	trans	63.4	12.5	-177.5	-54.4	-176.1	176.4	-174.4	-0.9	115.6	K101 K102	K101-R104 WeakPolarHBondContact O-CA 3.48Å; K101-R104 PolarHBondContact O-N 3.49Å; K102-R104 PolarHBondContact O-N 2.99Å
105	S	88.1	Confident	90.1	Very high	47 Å²	47	38.8 Å²	38.8	33%	0.329	18%	0.178	S	C	.	.			trans	-72.5	141	168.4	63.6	0	0	0	0	110.6	Y100 K101 N103	Y100-S105 WeakPolarHBondContact CA-O 3.22Å; K101-S105 PolarHBondContact N-O 3.28Å; N103-S105 PolarHBondContact O-N 3.24Å; N103-S105 WeakPolarHBondContact OD1-CB 3.35Å; N103-S105 PolarHBondContact OD1-N 2.92Å; N103-S105 VanDerWaalsContact OD1-N 3.12Å; N103-S105 PolarHBondContact OD1-OG 3.44Å
106	M	88.7	Confident	90.1	Very high	57 Å²	57	38.5 Å²	38.5	28%	0.281	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	140.6	176.6	171.4	177.7	-89.1	0	0	110.5	R74 T98 L99 Y100	R74-M106 HydrophobicContact CB-CE 3.29Å; R74-M106 HydrophobicContact CG-CE 3.89Å; T98-M106 HydrophobicContact CG2-CE 4.21Å; T98-M106 HydrophobicContact CG2-SD 4.42Å; L99-M106 WeakPolarHBondContact O-CA 3.44Å; Y100-M106 HydrophobicContact CE2-CE 4.2Å
107	I	88.8	Confident	90.1	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.015	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	132.8	175.4	170.8	-172.4	0	0	0	108.1	M52 L99 K101 V109 D132 S134	M52-I107 HydrophobicContact CG-CD1 3.43Å; M52-I107 VanDerWaalsContact CG-CD1 3.43Å; M52-I107 HydrophobicContact SD-CD1 3.91Å; L99-I107 HydrophobicContact CB-CG2 4.12Å; L99-I107 PolarHBondContact N-O 3.43Å; L99-I107 VanDerWaalsContact O-CG2 3.29Å; L99-I107 WeakPolarHBondContact O-CG2 3.22Å; L99-I107 PolarHBondContact O-N 2.97Å; K101-I107 HydrophobicContact CD-CG2 4.42Å; K101-I107 HydrophobicContact CG-CB 4.27Å; K101-I107 HydrophobicContact CG-CG2 3.6Å; I107-V109 HydrophobicContact CB-CG2 4.43Å; I107-V109 HydrophobicContact CD1-CG2 3.33Å; I107-V109 HydrophobicContact CG1-CG2 3.44Å; I107-V109 VanDerWaalsContact CG1-CG2 3.44Å; I107-V109 HydrophobicContact CG2-CG2 4.44Å; I107-D132 HydrophobicContact CD1-CB 4.3Å; I107-S134 WeakPolarHBondContact CA-OG 3.32Å; I107-S134 WeakPolarHBondContact CG1-OG 3.42Å
108	W	88.3	Confident	89.8	Confident	78 Å²	78	39.8 Å²	39.8	30%	0.295	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	123.2	170.4	-69.4	80.9	0	0	0	108.8	T98 I133 S134 R137	T98-W108 HydrophobicContact CG2-CD2 3.49Å; T98-W108 VanDerWaalsContact CG2-CD2 3.49Å; T98-W108 VanDerWaalsContact CG2-CE2 3.49Å; T98-W108 HydrophobicContact CG2-CE3 3.42Å; T98-W108 VanDerWaalsContact CG2-CE3 3.42Å; T98-W108 HydrophobicContact CG2-CG 4.28Å; T98-W108 HydrophobicContact CG2-CH2 3.39Å; T98-W108 HydrophobicContact CG2-CZ2 3.46Å; T98-W108 VanDerWaalsContact CG2-CZ2 3.46Å; T98-W108 HydrophobicContact CG2-CZ3 3.37Å; W108-I133 HydrophobicContact CB-CD1 4.12Å; W108-I133 HydrophobicContact CB-CG1 3.67Å; W108-I133 VanDerWaalsContact O-CG1 3.27Å; W108-I133 WeakPolarHBondContact O-CG1 3.04Å; W108-I133 PolarHBondContact O-N 3.21Å; W108-S134 PolarHBondContact N-OG 3.44Å; W108-S134 PolarHBondContact O-N 3.48Å; W108-R137 HydrophobicContact CD2-CB 4.46Å; W108-R137 HydrophobicContact CD2-CG 4.19Å; W108-R137 HydrophobicContact CE3-CG 4.49Å; W108-R137 HydrophobicContact CG-CB 4.34Å; W108-R137 HydrophobicContact CG-CG 4.32Å
109	V	89.2	Confident	89.4	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	142.3	-176.8	-169.3	0	0	0	0	110.4	I97 L99 I107 F130 Y131	I97-V109 PolarHBondContact N-O 3.12Å; I97-V109 PolarHBondContact O-N 3.1Å; I97-V109 VanDerWaalsContact O-O 3.07Å; L99-V109 HydrophobicContact CD1-CB 4.3Å; L99-V109 HydrophobicContact CD1-CG2 4.22Å; I107-V109 HydrophobicContact CB-CG2 4.43Å; I107-V109 HydrophobicContact CD1-CG2 3.33Å; I107-V109 HydrophobicContact CG1-CG2 3.44Å; I107-V109 VanDerWaalsContact CG1-CG2 3.44Å; I107-V109 HydrophobicContact CG2-CG2 4.44Å; V109-F130 HydrophobicContact CG1-CB 3.73Å; V109-F130 HydrophobicContact CG1-CD1 3.78Å; V109-F130 HydrophobicContact CG1-CG 4.19Å; V109-Y131 CarbonylContact C-O 3.6Å; V109-Y131 VanDerWaalsContact CA-O 3.3Å; V109-Y131 WeakPolarHBondContact CA-O 3.38Å; V109-Y131 WeakPolarHBondContact CG1-O 3.47Å
110	I	89.8	Confident	89.1	Confident	1 Å²	1	51 Å²	51	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	116.6	162.1	-59.2	-171.2	0	0	0	107.7	Q94 E96 F130 Y131 I133 V178	Q94-I110 HydrophobicContact CG-CG2 3.41Å; Q94-I110 VanDerWaalsContact CG-CG2 3.41Å; E96-I110 HydrophobicContact CG-CD1 4.44Å; E96-I110 HydrophobicContact CG-CG1 4.14Å; I110-F130 WeakPolarHBondContact O-CA 3.4Å; I110-Y131 PolarHBondContact N-O 3.34Å; I110-Y131 PolarHBondContact O-N 2.83Å; I110-I133 HydrophobicContact CD1-CD1 4.39Å; I110-I133 HydrophobicContact CD1-CG2 3.87Å; I110-I133 HydrophobicContact CG1-CD1 3.83Å; I110-I133 HydrophobicContact CG1-CG1 4.21Å; I110-I133 HydrophobicContact CG1-CG2 3.86Å; I110-V178 HydrophobicContact CD1-CB 3.58Å; I110-V178 HydrophobicContact CD1-CG1 3.55Å; I110-V178 HydrophobicContact CD1-CG2 4.14Å
111	M	91.7	Very high	88.6	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.8	177.1	-172.7	174.5	138.7	0	0	109.1	L83 Q94 V95 I97 V113 I128 L129 F130	L83-M111 HydrophobicContact CB-CE 4.25Å; L83-M111 HydrophobicContact CD1-CB 4.49Å; L83-M111 HydrophobicContact CD1-CE 3.64Å; L83-M111 HydrophobicContact CD1-CG 4.45Å; L83-M111 HydrophobicContact CD1-SD 3.58Å; L83-M111 VanDerWaalsContact CD1-SD 3.58Å; L83-M111 HydrophobicContact CD2-CB 4.38Å; L83-M111 HydrophobicContact CD2-CE 3.57Å; L83-M111 HydrophobicContact CD2-CG 4.14Å; L83-M111 HydrophobicContact CD2-SD 4.12Å; L83-M111 HydrophobicContact CG-CE 4Å; L83-M111 HydrophobicContact CG-SD 4.44Å; Q94-M111 WeakPolarHBondContact CA-O 3.38Å; V95-M111 PolarHBondContact N-O 2.84Å; V95-M111 PolarHBondContact O-N 3.37Å; I97-M111 HydrophobicContact CG2-CB 4.19Å; M111-V113 HydrophobicContact CE-CG2 3.99Å; M111-I128 HydrophobicContact CE-CD1 4.21Å; M111-I128 HydrophobicContact CE-CG2 3.77Å; M111-I128 HydrophobicContact CG-CG2 3.57Å; M111-I128 HydrophobicContact SD-CG2 4.25Å; M111-L129 CarbonylContact C-O 3.48Å; M111-L129 WeakPolarHBondContact CA-O 3.41Å; M111-F130 HydrophobicContact CB-CE1 4.48Å; M111-F130 HydrophobicContact CE-CZ 4.46Å; M111-F130 HydrophobicContact CG-CD1 4.43Å; M111-F130 HydrophobicContact CG-CE1 3.97Å; M111-F130 HydrophobicContact CG-CE2 4.2Å; M111-F130 HydrophobicContact CG-CZ 3.83Å; M111-F130 HydrophobicContact SD-CE1 3.73Å; M111-F130 HydrophobicContact SD-CE2 4.43Å; M111-F130 HydrophobicContact SD-CZ 3.57Å; M111-F130 VanDerWaalsContact SD-CZ 3.57Å
112	C	91	Very high	88.5	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.007	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.2	179.9	170.9	0	0	0	0	109.4	F92 D93 I128 L129 I181	F92-C112 WeakPolarHBondContact CE2-SG 3.4Å; F92-C112 WeakPolarHBondContact CZ-SG 3.43Å; D93-C112 WeakPolarHBondContact O-CA 3.42Å; C112-I128 CarbonylContact O-C 3.56Å; C112-I128 WeakPolarHBondContact O-CA 3.21Å; C112-I128 WeakPolarHBondContact O-CG2 3.37Å; C112-L129 HydrophobicContact CB-CB 4.34Å; C112-L129 PolarHBondContact N-O 3.18Å; C112-L129 PolarHBondContact O-N 2.99Å; C112-I181 HydrophobicContact CB-CD1 4.21Å; C112-I181 WeakPolarHBondContact SG-CD1 3.3Å
113	V	92.1	Very high	88.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	130.8	178.5	179.5	0	0	0	0	108.9	L83 L87 F92 D93 M111 Y126 I128	L83-V113 HydrophobicContact CD2-CG2 3.73Å; L87-V113 HydrophobicContact CD2-CG1 3.5Å; L87-V113 VanDerWaalsContact CD2-CG1 3.5Å; L87-V113 HydrophobicContact CG-CG1 4.04Å; F92-V113 WeakPolarHBondContact CA-O 3.22Å; F92-V113 WeakPolarHBondContact CD2-O 3.34Å; D93-V113 PolarHBondContact N-O 3.03Å; D93-V113 PolarHBondContact O-N 3.46Å; M111-V113 HydrophobicContact CE-CG2 3.99Å; V113-Y126 HydrophobicContact CG1-CD1 4.36Å; V113-I128 HydrophobicContact CG1-CG1 4.34Å; V113-I128 HydrophobicContact CG2-CD1 4.11Å; V113-I128 HydrophobicContact CG2-CG1 4.17Å; V113-I128 HydrophobicContact CG2-CG2 4.06Å
114	A	91.2	Very high	88.5	Confident	3 Å²	3	51.1 Å²	51.1	3%	0.025	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	126.2	179.2	0	0	0	0	0	112.7	F92 L127 I186	F92-A114 HydrophobicContact CD2-CB 3.77Å; F92-A114 HydrophobicContact CE2-CB 4.2Å; A114-L127 PolarHBondContact N-O 3.17Å; A114-L127 PolarHBondContact O-N 2.83Å; A114-I186 HydrophobicContact CB-CD1 3.46Å; A114-I186 VanDerWaalsContact CB-CD1 3.46Å
115	P	92.3	Very high	89	Confident	29 Å²	29	41.3 Å²	41.3	19%	0.188	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	140.2	174.8	29.2	-35.4	0	0	0	111.9	G90 I123 Y126	G90-P115 WeakPolarHBondContact O-CG 3.29Å; P115-I123 HydrophobicContact CB-CD1 3.74Å; P115-I123 HydrophobicContact CB-CG1 4.08Å; P115-I123 HydrophobicContact CB-CG2 3.76Å; P115-Y126 HydrophobicContact CB-CD1 4.18Å; P115-Y126 HydrophobicContact CB-CE1 3.89Å
116	V	90.9	Very high	89.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.3	175.2	178.7	0	0	0	0	109.2	F15 I123 P124 L125 L127 I186	F15-V116 HydrophobicContact CD2-CG1 4.39Å; F15-V116 HydrophobicContact CE2-CG1 3.47Å; F15-V116 VanDerWaalsContact CE2-CG1 3.47Å; F15-V116 HydrophobicContact CE2-CG2 4.31Å; F15-V116 HydrophobicContact CZ-CB 4.46Å; F15-V116 HydrophobicContact CZ-CG1 3.76Å; F15-V116 HydrophobicContact CZ-CG2 4.04Å; V116-I123 WeakPolarHBondContact O-CA 3.42Å; V116-P124 WeakPolarHBondContact O-CD 2.88Å; V116-L125 HydrophobicContact CB-CB 4.14Å; V116-L125 WeakPolarHBondContact CB-O 3.12Å; V116-L125 HydrophobicContact CG2-CB 4.49Å; V116-L125 PolarHBondContact N-O 2.82Å; V116-L127 HydrophobicContact CG2-CB 3.99Å; V116-I186 HydrophobicContact CG2-CG2 3.97Å
117	E	88.1	Confident	89.4	Confident	77 Å²	77	37 Å²	37	36%	0.36	18%	0.176	S	C	.	.			trans	-85.1	152.8	178.4	-66	179.7	-170.8	0	0	113.7	H121 E122 I123 K188 Y189	E117-H121 IonicContact OE2-CE1 3.78Å; E117-H121 IonicContact OE2-CG 2.82Å; E117-H121 IonicContact OE2-ND1 3.75Å; E117-H121 PolarHBondContact OE2-ND1 2.99Å; E117-E122 CarbonylContact C-O 3.56Å; E117-E122 VanDerWaalsContact CA-O 3.3Å; E117-E122 WeakPolarHBondContact CA-O 3.41Å; E117-I123 HydrophobicContact CG-CG1 4.35Å; E117-K188 CarbonylContact O-C 3.51Å; E117-K188 VanDerWaalsContact O-CA 3.3Å; E117-K188 WeakPolarHBondContact O-CA 3.41Å; E117-K188 WeakPolarHBondContact O-CB 3.42Å; E117-K188 IonicContact OE2-NZ 2.61Å; E117-Y189 PolarHBondContact O-N 3.17Å
118	N	85.4	Confident	89.5	Confident	22 Å²	22	36.9 Å²	36.9	12%	0.118	18%	0.175	C	C	.	.			trans	-94.9	-177.9	166	70.5	10.4	0	0	0	112	K120 H121 E122 P124	N118-K120 PolarHBondContact O-N 2.85Å; N118-K120 WeakPolarHBondContact OD1-CA 3.44Å; N118-K120 WeakPolarHBondContact OD1-CB 3.27Å; N118-K120 PolarHBondContact OD1-N 2.92Å; N118-H121 PolarHBondContact O-N 2.92Å; N118-H121 VanDerWaalsContact O-N 3.09Å; N118-H121 PolarHBondContact OD1-N 2.89Å; N118-H121 VanDerWaalsContact OD1-N 3.16Å; N118-E122 PolarHBondContact N-O 2.94Å; N118-E122 PolarHBondContact ND2-OE2 3.24Å; N118-E122 PolarHBondContact OD1-N 3.38Å; N118-E122 PolarHBondContact OD1-O 3.11Å; N118-P124 HydrophobicContact CB-CG 4.18Å
119	D	81.4	Confident	89.7	Confident	86 Å²	86	33.3 Å²	33.3	46%	0.46	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.3	176.9	-74	-37.9	0	0	0	113.9	H121 R190	D119-H121 VanDerWaalsContact C-N 3.34Å; D119-R190 WeakPolarHBondContact OD1-CD 3.25Å; D119-R190 IonicContact OD1-CZ 3.81Å; D119-R190 IonicContact OD1-NE 2.76Å; D119-R190 PolarHBondContact OD1-NE 3.48Å; D119-R190 IonicContact OD1-NH1 2.77Å; D119-R190 PolarHBondContact OD1-NH1 3.04Å; D119-R190 VanDerWaalsContact OD2-CB 3.24Å; D119-R190 WeakPolarHBondContact OD2-CB 3.42Å; D119-R190 WeakPolarHBondContact OD2-CD 3.14Å
120	K	85.7	Confident	89.8	Confident	163 Å²	163	33.2 Å²	33.2	71%	0.709	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	8.9	176.4	-60.3	-176.4	178.5	-177	0	112.8	N118 E122	N118-K120 PolarHBondContact O-N 2.85Å; N118-K120 WeakPolarHBondContact OD1-CA 3.44Å; N118-K120 WeakPolarHBondContact OD1-CB 3.27Å; N118-K120 PolarHBondContact OD1-N 2.92Å; K120-E122 HydrophobicContact CB-CG 4.17Å; K120-E122 PolarHBondContact O-N 3.42Å
121	H	81.6	Confident	89.7	Confident	129 Å²	129	35.4 Å²	35.4	60%	0.597	17%	0.17	S	C	*	.	S	Bend	trans	59.6	20	-174.3	-62.7	-78.8	0	0	0	114.8	E117 N118 D119	E117-H121 IonicContact OE2-CE1 3.78Å; E117-H121 IonicContact OE2-CG 2.82Å; E117-H121 IonicContact OE2-ND1 3.75Å; E117-H121 PolarHBondContact OE2-ND1 2.99Å; N118-H121 PolarHBondContact O-N 2.92Å; N118-H121 VanDerWaalsContact O-N 3.09Å; N118-H121 PolarHBondContact OD1-N 2.89Å; N118-H121 VanDerWaalsContact OD1-N 3.16Å; D119-H121 VanDerWaalsContact C-N 3.34Å
122	E	89	Confident	89.4	Confident	89 Å²	89	37.8 Å²	37.8	42%	0.416	18%	0.183	S	C	.	.			trans	-87.3	150.8	169.7	-53.6	167.3	152.9	0	0	108.7	R36 E117 N118 K120 P124	R36-E122 IonicContact CZ-OE2 2.81Å; R36-E122 IonicContact NH2-OE2 3.81Å; R36-E122 PolarHBondContact NH2-OE2 2.87Å; E117-E122 CarbonylContact C-O 3.56Å; E117-E122 VanDerWaalsContact CA-O 3.3Å; E117-E122 WeakPolarHBondContact CA-O 3.41Å; N118-E122 PolarHBondContact N-O 2.94Å; N118-E122 PolarHBondContact ND2-OE2 3.24Å; N118-E122 PolarHBondContact OD1-N 3.38Å; N118-E122 PolarHBondContact OD1-O 3.11Å; K120-E122 HydrophobicContact CB-CG 4.17Å; K120-E122 PolarHBondContact O-N 3.42Å; E122-P124 WeakPolarHBondContact O-CD 3.15Å
123	I	90.2	Very high	89.1	Confident	51 Å²	51	38 Å²	38	26%	0.262	18%	0.184	S	C	.	.			trans	-95.3	95.3	177.6	-56.8	164.6	0	0	0	108.8	A35 P115 V116 E117 L125 Y126	A35-I123 HydrophobicContact CB-CG2 3.96Å; A35-I123 WeakPolarHBondContact CB-O 3.43Å; P115-I123 HydrophobicContact CB-CD1 3.74Å; P115-I123 HydrophobicContact CB-CG1 4.08Å; P115-I123 HydrophobicContact CB-CG2 3.76Å; V116-I123 WeakPolarHBondContact O-CA 3.42Å; E117-I123 HydrophobicContact CG-CG1 4.35Å; I123-L125 WeakPolarHBondContact CG2-O 3.3Å; I123-Y126 HydrophobicContact CG2-CE1 4.14Å
124	P	91	Very high	88.5	Confident	15 Å²	15	39.3 Å²	39.3	10%	0.097	19%	0.193	C	C	.	.			trans	-74.6	-27.5	173.4	28.2	-39.1	0	0	0	113.7	N34 A35 V116 N118 E122 Y189	N34-P124 PolarHBondContact OD1-O 3.48Å; A35-P124 PolarHBondContact N-O 2.85Å; V116-P124 WeakPolarHBondContact O-CD 2.88Å; N118-P124 HydrophobicContact CB-CG 4.18Å; E122-P124 WeakPolarHBondContact O-CD 3.15Å; P124-Y189 HydrophobicContact CG-CD1 4.16Å; P124-Y189 HydrophobicContact CG-CG 4.32Å
125	L	93.5	Very high	87.7	Confident	13 Å²	13	41.7 Å²	41.7	7%	0.068	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	152.1	-168.1	-60.5	172.9	0	0	0	111.7	F15 I32 A33 I43 V116 I123 Y189	F15-L125 HydrophobicContact CD1-CD1 4.45Å; F15-L125 HydrophobicContact CE1-CD1 3.81Å; F15-L125 HydrophobicContact CZ-CD1 4.27Å; I32-L125 HydrophobicContact CG2-CB 4.18Å; I32-L125 HydrophobicContact CG2-CD1 4.17Å; I32-L125 HydrophobicContact CG2-CD2 4.19Å; I32-L125 HydrophobicContact CG2-CG 4.42Å; A33-L125 CarbonylContact O-C 3.56Å; A33-L125 VanDerWaalsContact O-CA 3.31Å; A33-L125 WeakPolarHBondContact O-CA 3.34Å; I43-L125 HydrophobicContact CD1-CD2 3.47Å; I43-L125 VanDerWaalsContact CD1-CD2 3.47Å; V116-L125 HydrophobicContact CB-CB 4.14Å; V116-L125 WeakPolarHBondContact CB-O 3.12Å; V116-L125 HydrophobicContact CG2-CB 4.49Å; V116-L125 PolarHBondContact N-O 2.82Å; I123-L125 WeakPolarHBondContact CG2-O 3.3Å; L125-Y189 HydrophobicContact CD1-CD2 3.62Å; L125-Y189 HydrophobicContact CD1-CE2 3.91Å; L125-Y189 HydrophobicContact CD1-CG 4.14Å
126	Y	93	Very high	86.7	Confident	12 Å²	12	43.7 Å²	43.7	5%	0.047	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.3	165.2	-72	-64.7	0	0	0	110.1	I32 A33 A35 H40 L87 G90 V113 P115 I123	I32-Y126 CarbonylContact C-O 3.59Å; I32-Y126 VanDerWaalsContact CA-O 3.3Å; I32-Y126 WeakPolarHBondContact CA-O 3.39Å; A33-Y126 PolarHBondContact N-O 3.09Å; A33-Y126 PolarHBondContact O-N 2.82Å; A35-Y126 HydrophobicContact CB-CD2 3.62Å; A35-Y126 HydrophobicContact CB-CE2 3.45Å; A35-Y126 VanDerWaalsContact CB-CE2 3.45Å; A35-Y126 HydrophobicContact CB-CG 4.39Å; H40-Y126 AromaticContact CE1-CE2 3.91Å; H40-Y126 AromaticContact ND1-CE2 3.93Å; L87-Y126 HydrophobicContact CD2-CD1 4.11Å; L87-Y126 HydrophobicContact CD2-CD2 3.66Å; L87-Y126 HydrophobicContact CD2-CE2 4.08Å; L87-Y126 HydrophobicContact CD2-CG 3.69Å; L87-Y126 WeakPolarHBondContact O-CE2 3.49Å; L87-Y126 PolarHBondContact O-OH 2.89Å; G90-Y126 VanDerWaalsContact CA-OH 3.22Å; G90-Y126 WeakPolarHBondContact CA-OH 3.38Å; V113-Y126 HydrophobicContact CG1-CD1 4.36Å; P115-Y126 HydrophobicContact CB-CD1 4.18Å; P115-Y126 HydrophobicContact CB-CE1 3.89Å; I123-Y126 HydrophobicContact CG2-CE1 4.14Å
127	L	92.9	Very high	85.6	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.4	169.5	177	64.7	0	0	0	108.2	V19 F23 L30 I32 A114 V116 L129	V19-L127 HydrophobicContact CG1-CD1 3.8Å; V19-L127 HydrophobicContact CG1-CD2 4.31Å; F23-L127 HydrophobicContact CD2-CD2 4.05Å; F23-L127 HydrophobicContact CE2-CD2 4.05Å; L30-L127 HydrophobicContact CD1-CD1 3.9Å; L30-L127 HydrophobicContact CD2-CD1 3.89Å; L30-L127 HydrophobicContact CG-CD1 3.72Å; I32-L127 HydrophobicContact CG1-CD1 4.19Å; A114-L127 PolarHBondContact N-O 3.17Å; A114-L127 PolarHBondContact O-N 2.83Å; V116-L127 HydrophobicContact CG2-CB 3.99Å; L127-L129 HydrophobicContact CD1-CD2 4.4Å; L127-L129 HydrophobicContact CG-CG 4.4Å
128	I	92.1	Very high	84.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.7	177.4	-46.1	-177.5	0	0	0	109.9	L31 A65 L87 M111 C112 V113 F130	L31-I128 HydrophobicContact CD1-CB 3.55Å; L31-I128 HydrophobicContact CD1-CD1 3.73Å; L31-I128 HydrophobicContact CD1-CG1 3.66Å; L31-I128 HydrophobicContact CD2-CB 4.33Å; L31-I128 HydrophobicContact CG-CB 3.74Å; L31-I128 HydrophobicContact CG-CG1 4.4Å; L31-I128 PolarHBondContact N-O 2.81Å; L31-I128 PolarHBondContact O-N 2.8Å; A65-I128 HydrophobicContact CB-CD1 3.87Å; L87-I128 HydrophobicContact CD1-CD1 4.49Å; L87-I128 HydrophobicContact CD2-CD1 4.01Å; M111-I128 HydrophobicContact CE-CD1 4.21Å; M111-I128 HydrophobicContact CE-CG2 3.77Å; M111-I128 HydrophobicContact CG-CG2 3.57Å; M111-I128 HydrophobicContact SD-CG2 4.25Å; C112-I128 CarbonylContact O-C 3.56Å; C112-I128 WeakPolarHBondContact O-CA 3.21Å; C112-I128 WeakPolarHBondContact O-CG2 3.37Å; V113-I128 HydrophobicContact CG1-CG1 4.34Å; V113-I128 HydrophobicContact CG2-CD1 4.11Å; V113-I128 HydrophobicContact CG2-CG1 4.17Å; V113-I128 HydrophobicContact CG2-CG2 4.06Å; I128-F130 HydrophobicContact CB-CE2 4.21Å; I128-F130 HydrophobicContact CG2-CD2 4.27Å; I128-F130 HydrophobicContact CG2-CE2 3.54Å; I128-F130 HydrophobicContact CG2-CZ 4.11Å
129	L	91.8	Very high	82.3	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	141.8	-176.5	-61.8	170.9	0	0	0	110.6	F23 G29 L30 M111 C112 L127 Y131 I181	F23-L129 HydrophobicContact CB-CD1 4.38Å; F23-L129 HydrophobicContact CB-CD2 4.04Å; F23-L129 HydrophobicContact CD1-CD1 3.84Å; F23-L129 HydrophobicContact CE1-CD1 4.41Å; F23-L129 HydrophobicContact CG-CD1 4.21Å; G29-L129 CarbonylContact O-C 3.49Å; G29-L129 WeakPolarHBondContact O-CA 3.31Å; L30-L129 HydrophobicContact CB-CD2 3.83Å; L30-L129 HydrophobicContact CD1-CD2 3.63Å; L30-L129 HydrophobicContact CG-CD2 3.65Å; M111-L129 CarbonylContact C-O 3.48Å; M111-L129 WeakPolarHBondContact CA-O 3.41Å; C112-L129 HydrophobicContact CB-CB 4.34Å; C112-L129 PolarHBondContact N-O 3.18Å; C112-L129 PolarHBondContact O-N 2.99Å; L127-L129 HydrophobicContact CD1-CD2 4.4Å; L127-L129 HydrophobicContact CG-CG 4.4Å; L129-Y131 HydrophobicContact CB-CE2 4.05Å; L129-I181 HydrophobicContact CD1-CD1 3.38Å; L129-I181 HydrophobicContact CD1-CG1 4.29Å
130	F	91	Very high	80.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.1	-175.2	-70.8	-109.4	0	0	0	109.4	T28 G29 L31 F49 M52 L99 V109 I110 M111 I128	T28-F130 WeakPolarHBondContact CA-O 3.14Å; G29-F130 PolarHBondContact N-O 2.93Å; G29-F130 PolarHBondContact O-N 3.01Å; L31-F130 HydrophobicContact CD2-CD2 4.42Å; L31-F130 HydrophobicContact CD2-CE2 3.35Å; L31-F130 HydrophobicContact CD2-CZ 3.76Å; L31-F130 HydrophobicContact CG-CE2 3.94Å; F49-F130 HydrophobicContact CD2-CD1 4.5Å; F49-F130 AromaticContact CD2-CD2 3.8Å; F49-F130 HydrophobicContact CD2-CD2 3.8Å; F49-F130 HydrophobicContact CD2-CE2 4.15Å; F49-F130 HydrophobicContact CD2-CG 4.03Å; F49-F130 AromaticContact CE2-CD1 3.94Å; F49-F130 HydrophobicContact CE2-CD1 3.94Å; F49-F130 AromaticContact CE2-CD2 3.66Å; F49-F130 HydrophobicContact CE2-CD2 3.66Å; F49-F130 AromaticContact CE2-CE1 3.87Å; F49-F130 HydrophobicContact CE2-CE1 3.87Å; F49-F130 AromaticContact CE2-CE2 3.6Å; F49-F130 HydrophobicContact CE2-CE2 3.6Å; F49-F130 AromaticContact CE2-CG 3.87Å; F49-F130 HydrophobicContact CE2-CG 3.87Å; F49-F130 AromaticContact CE2-CZ 3.71Å; F49-F130 HydrophobicContact CE2-CZ 3.71Å; F49-F130 HydrophobicContact CZ-CZ 4.48Å; M52-F130 HydrophobicContact CE-CB 3.31Å; M52-F130 HydrophobicContact CE-CD1 3.98Å; M52-F130 HydrophobicContact CE-CG 3.87Å; M52-F130 HydrophobicContact SD-CB 4.18Å; L99-F130 HydrophobicContact CD1-CD1 4.19Å; L99-F130 HydrophobicContact CD1-CE1 3.89Å; V109-F130 HydrophobicContact CG1-CB 3.73Å; V109-F130 HydrophobicContact CG1-CD1 3.78Å; V109-F130 HydrophobicContact CG1-CG 4.19Å; I110-F130 WeakPolarHBondContact O-CA 3.4Å; M111-F130 HydrophobicContact CB-CE1 4.48Å; M111-F130 HydrophobicContact CE-CZ 4.46Å; M111-F130 HydrophobicContact CG-CD1 4.43Å; M111-F130 HydrophobicContact CG-CE1 3.97Å; M111-F130 HydrophobicContact CG-CE2 4.2Å; M111-F130 HydrophobicContact CG-CZ 3.83Å; M111-F130 HydrophobicContact SD-CE1 3.73Å; M111-F130 HydrophobicContact SD-CE2 4.43Å; M111-F130 HydrophobicContact SD-CZ 3.57Å; M111-F130 VanDerWaalsContact SD-CZ 3.57Å; I128-F130 HydrophobicContact CB-CE2 4.21Å; I128-F130 HydrophobicContact CG2-CD2 4.27Å; I128-F130 HydrophobicContact CG2-CE2 3.54Å; I128-F130 HydrophobicContact CG2-CZ 4.11Å
131	Y	88.3	Confident	78.1	Confident	46 Å²	46	58.4 Å²	58.4	18%	0.18	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	118.2	177.1	-60.1	-93.3	0	0	0	111	T28 V109 I110 L129 I133 I181	T28-Y131 HydrophobicContact CG2-CD1 3.62Å; T28-Y131 HydrophobicContact CG2-CE1 3.3Å; V109-Y131 CarbonylContact C-O 3.6Å; V109-Y131 VanDerWaalsContact CA-O 3.3Å; V109-Y131 WeakPolarHBondContact CA-O 3.38Å; V109-Y131 WeakPolarHBondContact CG1-O 3.47Å; I110-Y131 PolarHBondContact N-O 3.34Å; I110-Y131 PolarHBondContact O-N 2.83Å; L129-Y131 HydrophobicContact CB-CE2 4.05Å; Y131-I133 PolarHBondContact O-N 2.82Å; Y131-I181 HydrophobicContact CE2-CD1 4.36Å
132	D	85.7	Confident	76.1	Confident	52 Å²	52	59 Å²	59	28%	0.278	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	113.7	179.9	-169.3	-9.7	0	0	0	111.5	M52 I107 S134	M52-D132 HydrophobicContact SD-CB 4.22Å; I107-D132 HydrophobicContact CD1-CB 4.3Å; D132-S134 WeakPolarHBondContact OD1-CB 3.49Å; D132-S134 PolarHBondContact OD1-N 3.38Å; D132-S134 PolarHBondContact OD1-OG 2.87Å
133	I	84.6	Confident	73.8	Confident	7 Å²	7	64 Å²	64	4%	0.036	33%	0.327	C	S	.	.			trans	-107.7	7.3	177.8	55.9	161	0	0	0	112.4	W108 I110 Y131 P135 L136 V178	W108-I133 HydrophobicContact CB-CD1 4.12Å; W108-I133 HydrophobicContact CB-CG1 3.67Å; W108-I133 VanDerWaalsContact O-CG1 3.27Å; W108-I133 WeakPolarHBondContact O-CG1 3.04Å; W108-I133 PolarHBondContact O-N 3.21Å; I110-I133 HydrophobicContact CD1-CD1 4.39Å; I110-I133 HydrophobicContact CD1-CG2 3.87Å; I110-I133 HydrophobicContact CG1-CD1 3.83Å; I110-I133 HydrophobicContact CG1-CG1 4.21Å; I110-I133 HydrophobicContact CG1-CG2 3.86Å; Y131-I133 PolarHBondContact O-N 2.82Å; I133-P135 VanDerWaalsContact C-N 3.3Å; I133-L136 HydrophobicContact CB-CD1 4.26Å; I133-L136 HydrophobicContact CG2-CD1 4.24Å; I133-L136 WeakPolarHBondContact O-CB 3.3Å; I133-L136 PolarHBondContact O-N 2.67Å; I133-V178 HydrophobicContact CG2-CG1 4.21Å
134	S	79.6	Confident	71.6	Confident	27 Å²	27	67 Å²	67	19%	0.189	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-51.3	-38.8	179.2	-49.5	0	0	0	0	114.5	I107 W108 D132 L136 R137	I107-S134 WeakPolarHBondContact CA-OG 3.32Å; I107-S134 WeakPolarHBondContact CG1-OG 3.42Å; W108-S134 PolarHBondContact N-OG 3.44Å; W108-S134 PolarHBondContact O-N 3.48Å; D132-S134 WeakPolarHBondContact OD1-CB 3.49Å; D132-S134 PolarHBondContact OD1-N 3.38Å; D132-S134 PolarHBondContact OD1-OG 2.87Å; S134-L136 PolarHBondContact O-N 3.27Å; S134-R137 PolarHBondContact O-N 2.85Å
135	P	73.4	Confident	69	Low	52 Å²	52	75 Å²	75	34%	0.338	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-63.7	-20.3	177.8	-22.8	34.6	0	0	0	114.6	I133 S158	I133-P135 VanDerWaalsContact C-N 3.3Å; P135-S158 VanDerWaalsContact CB-OG 3.28Å; P135-S158 WeakPolarHBondContact CB-OG 3.35Å
136	L	71.6	Confident	66.4	Low	72 Å²	72	80.1 Å²	80.1	38%	0.377	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-86.5	-14.3	-177.4	-60.2	172.2	0	0	0	113.1	I133 S134 V159	I133-L136 HydrophobicContact CB-CD1 4.26Å; I133-L136 HydrophobicContact CG2-CD1 4.24Å; I133-L136 WeakPolarHBondContact O-CB 3.3Å; I133-L136 PolarHBondContact O-N 2.67Å; S134-L136 PolarHBondContact O-N 3.27Å; L136-V159 HydrophobicContact CD2-CB 4.39Å; L136-V159 HydrophobicContact CD2-CG2 3.58Å
137	R	67.2	Low	64.2	Low	129 Å²	129	81.8 Å²	81.8	49%	0.487	45%	0.446	S	S	.	.			trans	-111.8	1.7	-168.8	-77.5	-96.1	-170.2	171.6	2.4	115.9	E96 W108 S134 P139	E96-R137 IonicContact OE2-NH2 3.06Å; E96-R137 PolarHBondContact OE2-NH2 2.71Å; W108-R137 HydrophobicContact CD2-CB 4.46Å; W108-R137 HydrophobicContact CD2-CG 4.19Å; W108-R137 HydrophobicContact CE3-CG 4.49Å; W108-R137 HydrophobicContact CG-CB 4.34Å; W108-R137 HydrophobicContact CG-CG 4.32Å; S134-R137 PolarHBondContact O-N 2.85Å; R137-P139 WeakPolarHBondContact O-CD 3.32Å
138	Q	56.6	Low	61.9	Low	153 Å²	153	85.7 Å²	85.7	72%	0.715	47%	0.474	S	S	*	.			trans	-69.4	121.1	-179	-76.2	-175.7	-16.7	0	0	112.4
139	P	47.5	Very low	60	Low	103 Å²	103	94.9 Å²	94.9	67%	0.669	52%	0.515	S	S	*	.			trans	-80.2	152.4	176.8	31.2	-31.1	0	0	0	113	R137 D141	R137-P139 WeakPolarHBondContact O-CD 3.32Å; P139-D141 PolarHBondContact O-N 3.01Å
140	L	37.7	Very low	58.1	Low	144 Å²	144	98.2 Å²	98.2	75%	0.754	54%	0.538	S	S	*	.			trans	-85.7	80.1	176.9	-77.5	143	0	0	0	110.4	F152	L140-F152 HydrophobicContact CD1-CZ 4.16Å; L140-F152 HydrophobicContact CD2-CE2 3.98Å; L140-F152 HydrophobicContact CD2-CZ 4.31Å
141	D	41.1	Very low	56.2	Low	128 Å²	128	104.7 Å²	104.7	68%	0.684	57%	0.566	S	S	*	*			trans	-125.5	132.8	175.8	-63.5	-39.5	0	0	0	112.5	P139	P139-D141 PolarHBondContact O-N 3.01Å
142	D	40	Very low	54.6	Low	142 Å²	142	107.8 Å²	107.8	76%	0.759	58%	0.581	S	S	*	*	S	Bend	trans	78.7	107.9	158.9	-55.8	-21	0	0	0	123.9	T144	D142-T144 PolarHBondContact O-N 3.1Å; D142-T144 VanDerWaalsContact O-N 3.13Å
143	E	40.6	Very low	53.1	Low	193 Å²	193	107.5 Å²	107.5	90%	0.902	59%	0.585	S	S	*	*			trans	57	17.4	139.7	-65.2	-139.2	144.4	0	0	123.4
144	T	43.9	Very low	51.5	Low	113 Å²	113	113.9 Å²	113.9	69%	0.693	61%	0.613	S	S	*	*			trans	-102	80.3	164.2	45.4	0	0	0	0	112.4	D142 S146	D142-T144 PolarHBondContact O-N 3.1Å; D142-T144 VanDerWaalsContact O-N 3.13Å; T144-S146 VanDerWaalsContact C-N 3.31Å; T144-S146 PolarHBondContact O-N 3.02Å
145	L	37.2	Very low	50.1	Low	183 Å²	183	115.6 Å²	115.6	96%	0.958	62%	0.62	S	S	*	*			trans	-78.5	64.3	-175.4	-136.8	124	0	0	0	112.8
146	S	39	Very low	49.1	Very low	121 Å²	121	116 Å²	116	85%	0.846	63%	0.628	S	S	*	*	S	Bend	trans	-169.9	103.1	162.1	-175.4	0	0	0	0	110.4	T144	T144-S146 VanDerWaalsContact C-N 3.31Å; T144-S146 PolarHBondContact O-N 3.02Å
147	G	46.2	Very low	48.1	Very low	47 Å²	47	120.6 Å²	120.6	49%	0.485	64%	0.64	S	S	.	*			trans	138.3	11.1	172.3	0	0	0	0	0	117.8	F149 S150	G147-F149 VanDerWaalsContact C-N 3.25Å; G147-F149 PolarHBondContact O-N 2.86Å; G147-S150 PolarHBondContact O-N 2.89Å
148	S	44.7	Very low	47.3	Very low	85 Å²	85	116.2 Å²	116.2	59%	0.594	63%	0.629	S	S	*	*	H	α-helix	trans	-49.1	-31.4	-169.8	-160.3	0	0	0	0	116.1
149	F	52.7	Low	46.9	Very low	193 Å²	193	111.7 Å²	111.7	85%	0.846	61%	0.612	S	S	*	*	H	α-helix	trans	-73.8	-29.8	-177.9	-81.3	-86.4	0	0	0	115.6	G147 A153	G147-F149 VanDerWaalsContact C-N 3.25Å; G147-F149 PolarHBondContact O-N 2.86Å; F149-A153 PolarHBondContact O-N 3.02Å
150	S	52.5	Low	47	Very low	73 Å²	73	109.1 Å²	109.1	51%	0.51	60%	0.599	S	S	.	*	H	α-helix	trans	-72.5	-37.4	-175.6	162.6	0	0	0	0	112.9	G147 K154	G147-S150 PolarHBondContact O-N 2.89Å; S150-K154 PolarHBondContact O-N 3.16Å
151	K	50.7	Low	47.3	Very low	135 Å²	135	111.5 Å²	111.5	59%	0.587	60%	0.598	S	S	*	*	H	α-helix	trans	-72.7	-40.8	-178.8	-64	-179.6	-176.6	174.9	0	111.1	A153 K154 L155	K151-A153 PolarHBondContact O-N 3.04Å; K151-K154 PolarHBondContact O-N 3.26Å; K151-L155 PolarHBondContact O-N 3.2Å
152	F	54.5	Low	47.6	Very low	112 Å²	112	107.5 Å²	107.5	49%	0.491	58%	0.577	S	S	.	*	H	α-helix	trans	-61.7	-40.1	173.4	-93.6	-86.4	0	0	0	112.8	L140 K154 L155 A156	L140-F152 HydrophobicContact CD1-CZ 4.16Å; L140-F152 HydrophobicContact CD2-CE2 3.98Å; L140-F152 HydrophobicContact CD2-CZ 4.31Å; F152-K154 VanDerWaalsContact C-N 3.3Å; F152-K154 PolarHBondContact O-N 3.46Å; F152-L155 PolarHBondContact O-N 2.9Å; F152-A156 WeakPolarHBondContact O-CB 3.44Å; F152-A156 PolarHBondContact O-N 2.82Å
153	A	53.5	Low	47.5	Very low	45 Å²	45	107.2 Å²	107.2	37%	0.372	57%	0.569	S	S	.	*	H	α-helix	trans	-68.4	-24.8	176.6	0	0	0	0	0	114	F149 K151 R157	F149-A153 PolarHBondContact O-N 3.02Å; K151-A153 PolarHBondContact O-N 3.04Å; A153-R157 PolarHBondContact O-N 3.23Å; A153-R157 PolarHBondContact O-NE 2.9Å
154	K	51.9	Low	47.4	Very low	141 Å²	141	103 Å²	103	61%	0.613	56%	0.556	S	S	*	*	H	α-helix	trans	-77.4	-40.7	171.5	-81.2	-179.1	178	174.6	0	111.5	S150 K151 F152 R157 S158	S150-K154 PolarHBondContact O-N 3.16Å; K151-K154 PolarHBondContact O-N 3.26Å; F152-K154 VanDerWaalsContact C-N 3.3Å; F152-K154 PolarHBondContact O-N 3.46Å; K154-R157 PolarHBondContact O-N 3.09Å; K154-S158 WeakPolarHBondContact O-CB 3.26Å; K154-S158 PolarHBondContact O-N 2.92Å
155	L	49.3	Very low	47.4	Very low	64 Å²	64	103.2 Å²	103.2	34%	0.335	56%	0.557	S	S	.	*	H	α-helix	trans	-62.7	-47.6	174.9	-108.3	155.1	0	0	0	111.6	K151 F152 R157 S158 V159	K151-L155 PolarHBondContact O-N 3.2Å; F152-L155 PolarHBondContact O-N 2.9Å; L155-R157 VanDerWaalsContact C-N 3.3Å; L155-R157 PolarHBondContact O-N 3Å; L155-S158 WeakPolarHBondContact O-CB 3.1Å; L155-S158 PolarHBondContact O-N 2.65Å; L155-S158 VanDerWaalsContact O-N 3.13Å; L155-V159 HydrophobicContact CD2-CG2 4.5Å; L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.45Å; L155-V159 PolarHBondContact O-N 2.95Å
156	A	53.1	Low	47.3	Very low	61 Å²	61	97.7 Å²	97.7	50%	0.504	53%	0.528	S	S	.	.	H	α-helix	trans	-59.9	-38	176.6	0	0	0	0	0	112.6	F152 A160	F152-A156 WeakPolarHBondContact O-CB 3.44Å; F152-A156 PolarHBondContact O-N 2.82Å; A156-A160 WeakPolarHBondContact O-CB 3.35Å; A156-A160 PolarHBondContact O-N 3.07Å
157	R	50.3	Low	46.8	Very low	168 Å²	168	96.4 Å²	96.4	63%	0.634	52%	0.516	S	S	*	.	H	α-helix	trans	-71.7	-33.7	174.9	-84.5	-177.2	-74	173.4	-8.6	113.6	A153 K154 L155 R161	A153-R157 PolarHBondContact O-N 3.23Å; A153-R157 PolarHBondContact O-NE 2.9Å; K154-R157 PolarHBondContact O-N 3.09Å; L155-R157 VanDerWaalsContact C-N 3.3Å; L155-R157 PolarHBondContact O-N 3Å; R157-R161 WeakPolarHBondContact O-CB 3.44Å; R157-R161 PolarHBondContact O-N 3.33Å; R157-R161 VanDerWaalsContact O-N 3.07Å
158	S	49.4	Very low	45.9	Very low	36 Å²	36	103 Å²	103	25%	0.252	53%	0.534	S	S	.	.	H	α-helix	trans	-67	-47.4	174.3	178.9	0	0	0	0	111.2	P135 K154 L155 R161 N162	P135-S158 VanDerWaalsContact CB-OG 3.28Å; P135-S158 WeakPolarHBondContact CB-OG 3.35Å; K154-S158 WeakPolarHBondContact O-CB 3.26Å; K154-S158 PolarHBondContact O-N 2.92Å; L155-S158 WeakPolarHBondContact O-CB 3.1Å; L155-S158 PolarHBondContact O-N 2.65Å; L155-S158 VanDerWaalsContact O-N 3.13Å; S158-R161 PolarHBondContact O-N 3.1Å; S158-N162 PolarHBondContact O-N 3.45Å
159	V	48.6	Very low	45.4	Very low	59 Å²	59	105.4 Å²	105.4	36%	0.358	54%	0.544	S	S	.	.	H	α-helix	trans	-66.2	-43.6	177.8	176.6	0	0	0	0	110.4	L136 L155 R161 N162 K163	L136-V159 HydrophobicContact CD2-CB 4.39Å; L136-V159 HydrophobicContact CD2-CG2 3.58Å; L155-V159 HydrophobicContact CD2-CG2 4.5Å; L155-V159 VanDerWaalsContact O-CG2 3.26Å; L155-V159 WeakPolarHBondContact O-CG2 3.45Å; L155-V159 PolarHBondContact O-N 2.95Å; V159-R161 VanDerWaalsContact C-N 3.31Å; V159-R161 PolarHBondContact O-N 3.34Å; V159-N162 PolarHBondContact O-N 2.71Å; V159-K163 WeakPolarHBondContact O-CB 3.31Å; V159-K163 PolarHBondContact O-N 2.99Å
160	A	49.2	Very low	44.3	Very low	49 Å²	49	105.3 Å²	105.3	41%	0.405	55%	0.547	S	S	.	.	H	α-helix	trans	-63	-34.1	176.6	0	0	0	0	0	112.7	A156 K163 T164	A156-A160 WeakPolarHBondContact O-CB 3.35Å; A156-A160 PolarHBondContact O-N 3.07Å; A160-K163 PolarHBondContact O-N 3.44Å; A160-T164 WeakPolarHBondContact O-CG2 3.49Å; A160-T164 PolarHBondContact O-N 3.4Å; A160-T164 PolarHBondContact O-OG1 2.92Å; A160-T164 VanDerWaalsContact O-OG1 3.12Å
161	R	45.9	Very low	43.3	Very low	193 Å²	193	108.9 Å²	108.9	73%	0.728	56%	0.559	S	S	*	*	H	α-helix	trans	-69.4	-34.8	176.2	-108.6	179.7	170	172.1	-3.4	113.5	R157 S158 V159 T164	R157-R161 WeakPolarHBondContact O-CB 3.44Å; R157-R161 PolarHBondContact O-N 3.33Å; R157-R161 VanDerWaalsContact O-N 3.07Å; S158-R161 PolarHBondContact O-N 3.1Å; V159-R161 VanDerWaalsContact C-N 3.31Å; V159-R161 PolarHBondContact O-N 3.34Å; R161-T164 WeakPolarHBondContact CA-OG1 3.23Å; R161-T164 PolarHBondContact O-OG1 2.92Å
162	N	45.5	Very low	42.3	Very low	45 Å²	45	109.1 Å²	109.1	24%	0.241	57%	0.567	C	S	.	*	H	α-helix	trans	-73.9	-35.8	170.7	-80	1.7	0	0	0	111.4	S158 V159 T164 V165	S158-N162 PolarHBondContact O-N 3.45Å; V159-N162 PolarHBondContact O-N 2.71Å; N162-T164 VanDerWaalsContact C-N 3.34Å; N162-T164 PolarHBondContact O-N 3.44Å; N162-V165 PolarHBondContact O-N 3.19Å
163	K	38.4	Very low	41.2	Very low	136 Å²	136	111.1 Å²	111.1	59%	0.591	58%	0.583	S	S	*	*	H	α-helix	trans	-66.8	-30.7	174.8	-123	-177.9	177.3	-179.2	0	112.9	V159 A160 V165 L166 T167	V159-K163 WeakPolarHBondContact O-CB 3.31Å; V159-K163 PolarHBondContact O-N 2.99Å; A160-K163 PolarHBondContact O-N 3.44Å; K163-V165 PolarHBondContact O-N 3.43Å; K163-V165 VanDerWaalsContact O-N 3.11Å; K163-L166 CarbonylContact O-C 3.52Å; K163-L166 PolarHBondContact O-N 3.42Å; K163-T167 HydrophobicContact CB-CG2 4.44Å; K163-T167 HydrophobicContact CD-CG2 4.33Å; K163-T167 HydrophobicContact CG-CG2 4.01Å; K163-T167 PolarHBondContact O-N 3.03Å; K163-T167 VanDerWaalsContact O-N 3.12Å; K163-T167 PolarHBondContact O-OG1 3.21Å
164	T	39.7	Very low	40	Very low	103 Å²	103	114.5 Å²	114.5	63%	0.632	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-7.9	178.7	41.5	0	0	0	0	114.8	A160 R161 N162	A160-T164 WeakPolarHBondContact O-CG2 3.49Å; A160-T164 PolarHBondContact O-N 3.4Å; A160-T164 PolarHBondContact O-OG1 2.92Å; A160-T164 VanDerWaalsContact O-OG1 3.12Å; R161-T164 WeakPolarHBondContact CA-OG1 3.23Å; R161-T164 PolarHBondContact O-OG1 2.92Å; N162-T164 VanDerWaalsContact C-N 3.34Å; N162-T164 PolarHBondContact O-N 3.44Å
165	V	42.2	Very low	39.1	Very low	119 Å²	119	114.8 Å²	114.8	72%	0.721	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-6.3	169.7	-179.1	0	0	0	0	111.7	N162 K163	N162-V165 PolarHBondContact O-N 3.19Å; K163-V165 PolarHBondContact O-N 3.43Å; K163-V165 VanDerWaalsContact O-N 3.11Å
166	L	35.7	Very low	38.4	Very low	66 Å²	66	118 Å²	118	35%	0.346	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-133.3	8.6	-164.9	-95.7	140.4	0	0	0	115.9	K163 Q168 A177	K163-L166 CarbonylContact O-C 3.52Å; K163-L166 PolarHBondContact O-N 3.42Å; L166-Q168 PolarHBondContact O-N 3.27Å; L166-A177 WeakPolarHBondContact CD1-O 3.42Å
167	T	28	Very low	37.3	Very low	95 Å²	95	118.7 Å²	118.7	58%	0.583	64%	0.639	S	S	*	*			trans	-91.6	87.1	176.6	43.9	0	0	0	0	113	K163	K163-T167 HydrophobicContact CB-CG2 4.44Å; K163-T167 HydrophobicContact CD-CG2 4.33Å; K163-T167 HydrophobicContact CG-CG2 4.01Å; K163-T167 PolarHBondContact O-N 3.03Å; K163-T167 VanDerWaalsContact O-N 3.12Å; K163-T167 PolarHBondContact O-OG1 3.21Å
168	Q	28.9	Very low	37	Very low	186 Å²	186	112.7 Å²	112.7	87%	0.869	62%	0.621	S	S	*	*	S	Bend	trans	-150.5	135.8	136.7	-74.8	-164.8	-32.2	0	0	106.9	L166	L166-Q168 PolarHBondContact O-N 3.27Å
169	V	33.7	Very low	36.9	Very low	134 Å²	134	113.5 Å²	113.5	81%	0.812	63%	0.63	S	S	*	*			trans	96.5	98.5	180	-166.5	0	0	0	0	115	L171	V169-L171 HydrophobicContact CG1-CD1 4.35Å
170	E	28.9	Very low	37	Very low	191 Å²	191	114.5 Å²	114.5	89%	0.893	64%	0.637	S	S	*	*			trans	-66.7	123.2	156.3	-69.4	168.9	141.3	0	0	108.7
171	L	31.8	Very low	37.4	Very low	148 Å²	148	113.2 Å²	113.2	78%	0.775	62%	0.624	S	S	*	*			trans	-174.6	122.4	154.5	-99.2	139.3	0	0	0	110.2	V169	V169-L171 HydrophobicContact CG1-CD1 4.35Å
172	D	30.8	Very low	37.9	Very low	141 Å²	141	111.5 Å²	111.5	75%	0.754	62%	0.624	S	S	*	*			trans	47.9	112.5	162.3	-68.6	-11.1	0	0	0	122.2
173	D	29.7	Very low	38.3	Very low	154 Å²	154	113.3 Å²	113.3	82%	0.824	64%	0.64	S	S	*	*	S	Bend	trans	0.6	114.3	156.4	-73.2	-29.2	0	0	0	119.9
174	S	29.5	Very low	39.1	Very low	116 Å²	116	114.2 Å²	114.2	81%	0.811	65%	0.651	S	S	*	*	S	Bend	trans	103	-12.9	136.1	74.4	0	0	0	0	122.4
175	L	32.1	Very low	40.3	Very low	147 Å²	147	111.2 Å²	111.2	77%	0.77	63%	0.634	S	S	*	*	S	Bend	trans	-141.7	-2.5	-177.4	-81.9	161.7	0	0	0	118.5
176	V	35.4	Very low	41.8	Very low	130 Å²	130	107 Å²	107	79%	0.788	61%	0.607	S	S	*	*			trans	-106.3	-1.3	-160.3	178.4	0	0	0	0	116.1	V178	V176-V178 PolarHBondContact O-N 3.35Å
177	A	30.4	Very low	43.9	Very low	77 Å²	77	104.7 Å²	104.7	64%	0.636	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	23.9	-162.6	0	0	0	0	0	118.8	L166	L166-A177 WeakPolarHBondContact CD1-O 3.42Å
178	V	43.4	Very low	46.4	Very low	41 Å²	41	104.2 Å²	104.2	25%	0.248	59%	0.586	C	S	.	*	T	Hydrogen-bonded Turn	trans	-137.2	25.1	-173.2	-156.1	0	0	0	0	116.8	I110 I133 V176	I110-V178 HydrophobicContact CD1-CB 3.58Å; I110-V178 HydrophobicContact CD1-CG1 3.55Å; I110-V178 HydrophobicContact CD1-CG2 4.14Å; I133-V178 HydrophobicContact CG2-CG1 4.21Å; V176-V178 PolarHBondContact O-N 3.35Å
179	A	47.2	Very low	48.9	Very low	53 Å²	53	100.1 Å²	100.1	44%	0.438	56%	0.564	S	S	.	*			trans	-132.5	113.9	-177.6	0	0	0	0	0	114.7
180	P	50.5	Low	51	Low	80 Å²	80	97.6 Å²	97.6	52%	0.519	54%	0.54	S	S	.	.			trans	-109.3	20.6	173.8	38.4	-29.8	0	0	0	115.2
181	I	58.4	Low	53.1	Low	23 Å²	23	95.6 Å²	95.6	12%	0.118	53%	0.53	C	S	.	.			trans	-101	100.7	179.8	-57.5	153.7	0	0	0	110.4	F23 F92 C112 L129 Y131	F23-I181 HydrophobicContact CE1-CG1 4.38Å; F92-I181 HydrophobicContact CE2-CB 4.13Å; F92-I181 HydrophobicContact CE2-CG2 3.71Å; F92-I181 HydrophobicContact CZ-CB 4.1Å; F92-I181 HydrophobicContact CZ-CG2 4.16Å; C112-I181 HydrophobicContact CB-CD1 4.21Å; C112-I181 WeakPolarHBondContact SG-CD1 3.3Å; L129-I181 HydrophobicContact CD1-CD1 3.38Å; L129-I181 HydrophobicContact CD1-CG1 4.29Å; Y131-I181 HydrophobicContact CE2-CD1 4.36Å
182	Q	55.2	Low	54.7	Low	157 Å²	157	91 Å²	91	73%	0.734	51%	0.505	S	S	*	.			trans	-80.8	130.5	159.6	-68.7	-179.5	-6	0	0	108.7	N184 S185	Q182-N184 PolarHBondContact O-N 3.42Å; Q182-S185 WeakPolarHBondContact O-CB 3.44Å; Q182-S185 PolarHBondContact O-N 3.47Å; Q182-S185 PolarHBondContact O-OG 3.22Å
183	S	55.7	Low	56.4	Low	82 Å²	82	88.3 Å²	88.3	57%	0.573	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-48.8	-32.2	-177	54.3	0	0	0	0	114.7	S185	S183-S185 PolarHBondContact O-N 2.94Å; S183-S185 VanDerWaalsContact O-N 3.1Å
184	N	55.1	Low	58.1	Low	155 Å²	155	84 Å²	84	83%	0.829	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-66.4	-9	179.1	-72.8	-13.9	0	0	0	115.1	Q182	Q182-N184 PolarHBondContact O-N 3.42Å
185	S	64.7	Low	59.8	Low	40 Å²	40	84.9 Å²	84.9	28%	0.28	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-88.3	-9	-176.2	65	0	0	0	0	114.5	R22 Q182 S183	R22-S185 PolarHBondContact NH1-O 2.91Å; Q182-S185 WeakPolarHBondContact O-CB 3.44Å; Q182-S185 PolarHBondContact O-N 3.47Å; Q182-S185 PolarHBondContact O-OG 3.22Å; S183-S185 PolarHBondContact O-N 2.94Å; S183-S185 VanDerWaalsContact O-N 3.1Å
186	I	73.4	Confident	61.9	Low	30 Å²	30	79.9 Å²	79.9	15%	0.154	44%	0.442	C	S	.	.	S	Bend	trans	-81.8	123.3	-172.8	-57.4	165.8	0	0	0	110.1	A114 V116	A114-I186 HydrophobicContact CB-CD1 3.46Å; A114-I186 VanDerWaalsContact CB-CD1 3.46Å; V116-I186 HydrophobicContact CG2-CG2 3.97Å
187	P	78.5	Confident	64.1	Low	18 Å²	18	75.8 Å²	75.8	12%	0.117	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-68.7	142.3	178.4	29.1	-34	0	0	0	111.2	F15 T18 V19	F15-P187 HydrophobicContact CD2-CB 4.37Å; F15-P187 HydrophobicContact CD2-CG 4.14Å; F15-P187 HydrophobicContact CE2-CG 4.06Å; F15-P187 VanDerWaalsContact CE2-O 3.32Å; F15-P187 WeakPolarHBondContact CE2-O 3.48Å; T18-P187 HydrophobicContact CG2-CB 3.88Å; T18-P187 HydrophobicContact CG2-CG 4.06Å; V19-P187 HydrophobicContact CG2-CG 3.44Å; V19-P187 VanDerWaalsContact CG2-CG 3.44Å
188	K	80.3	Confident	66.5	Low	85 Å²	85	77.2 Å²	77.2	37%	0.37	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-76.3	149.9	175.7	-64	-167.3	177.5	-157	0	111.8	E117 R190	E117-K188 CarbonylContact O-C 3.51Å; E117-K188 VanDerWaalsContact O-CA 3.3Å; E117-K188 WeakPolarHBondContact O-CA 3.41Å; E117-K188 WeakPolarHBondContact O-CB 3.42Å; E117-K188 IonicContact OE2-NZ 2.61Å; K188-R190 PolarHBondContact O-N 3.06Å
189	Y	82.2	Confident	68.6	Low	100 Å²	100	82.9 Å²	82.9	39%	0.392	44%	0.444	S	S	.	.			trans	-84.3	94.7	175	-172.7	-98.6	0	0	0	110.6	N13 F15 E117 P124 L125	N13-Y189 VanDerWaalsContact ND2-CE2 3.26Å; N13-Y189 WeakPolarHBondContact ND2-CE2 2.86Å; N13-Y189 VanDerWaalsContact ND2-CZ 3.27Å; F15-Y189 HydrophobicContact CB-CD2 4.03Å; F15-Y189 AromaticContact CD1-CD2 3.63Å; F15-Y189 HydrophobicContact CD1-CD2 3.63Å; F15-Y189 HydrophobicContact CD1-CE2 4.14Å; F15-Y189 HydrophobicContact CD2-CD2 4.37Å; F15-Y189 HydrophobicContact CE1-CD2 4.16Å; F15-Y189 AromaticContact CG-CD2 3.74Å; F15-Y189 HydrophobicContact CG-CD2 3.74Å; E117-Y189 PolarHBondContact O-N 3.17Å; P124-Y189 HydrophobicContact CG-CD1 4.16Å; P124-Y189 HydrophobicContact CG-CG 4.32Å; L125-Y189 HydrophobicContact CD1-CD2 3.62Å; L125-Y189 HydrophobicContact CD1-CE2 3.91Å; L125-Y189 HydrophobicContact CD1-CG 4.14Å
190	R	78.1	Confident	70.6	Confident	82 Å²	82	81 Å²	81	31%	0.309	43%	0.427	S	S	.	.			trans	-149.5	156.8	177.6	54.5	155.4	134.9	167.8	92.6	114.2	N13 D119 K188 E192 K195	N13-R190 PolarHBondContact OD1-O 2.86Å; D119-R190 WeakPolarHBondContact OD1-CD 3.25Å; D119-R190 IonicContact OD1-CZ 3.81Å; D119-R190 IonicContact OD1-NE 2.76Å; D119-R190 PolarHBondContact OD1-NE 3.48Å; D119-R190 IonicContact OD1-NH1 2.77Å; D119-R190 PolarHBondContact OD1-NH1 3.04Å; D119-R190 VanDerWaalsContact OD2-CB 3.24Å; D119-R190 WeakPolarHBondContact OD2-CB 3.42Å; D119-R190 WeakPolarHBondContact OD2-CD 3.14Å; K188-R190 PolarHBondContact O-N 3.06Å; R190-E192 VanDerWaalsContact CD-CG 3.42Å; R190-E192 WeakPolarHBondContact CD-OE1 3.19Å; R190-E192 HydrophobicContact CG-CG 3.81Å; R190-E192 IonicContact CZ-OE1 3.66Å; R190-E192 IonicContact NE-OE1 3.8Å; R190-E192 PolarHBondContact NE-OE1 2.65Å; R190-E192 VanDerWaalsContact NH2-CD 3.3Å; R190-E192 IonicContact NH2-OE1 2.66Å; R190-E192 PolarHBondContact NH2-OE1 3.12Å; R190-E192 IonicContact NH2-OE2 3.76Å; R190-K195 VanDerWaalsContact NH2-NZ 3.17Å
191	Q	72.2	Confident	72.5	Confident	149 Å²	149	78.8 Å²	78.8	70%	0.696	41%	0.412	S	S	*	.			trans	-81.1	112	167.6	-70.8	178	1.2	0	0	108.7	N13	N13-Q191 HydrophobicContact CB-CG 4.13Å
192	E	65.4	Low	74	Confident	52 Å²	52	79.3 Å²	79.3	24%	0.243	42%	0.415	C	S	.	.	B	Isolated β-bridge	trans	-105.1	142.3	178	-72.2	-173	-172.1	0	0	110.3	Q12 R190 K195	Q12-E192 PolarHBondContact N-O 2.95Å; Q12-E192 VanDerWaalsContact N-O 3.07Å; Q12-E192 PolarHBondContact O-N 2.99Å; R190-E192 VanDerWaalsContact CD-CG 3.42Å; R190-E192 WeakPolarHBondContact CD-OE1 3.19Å; R190-E192 HydrophobicContact CG-CG 3.81Å; R190-E192 IonicContact CZ-OE1 3.66Å; R190-E192 IonicContact NE-OE1 3.8Å; R190-E192 PolarHBondContact NE-OE1 2.65Å; R190-E192 VanDerWaalsContact NH2-CD 3.3Å; R190-E192 IonicContact NH2-OE1 2.66Å; R190-E192 PolarHBondContact NH2-OE1 3.12Å; R190-E192 IonicContact NH2-OE2 3.76Å; E192-K195 VanDerWaalsContact CD-NZ 3.29Å; E192-K195 IonicContact OE1-NZ 2.62Å; E192-K195 PolarHBondContact OE1-NZ 3.28Å; E192-K195 VanDerWaalsContact OE1-NZ 3.12Å; E192-K195 WeakPolarHBondContact OE2-CD 3.42Å; E192-K195 WeakPolarHBondContact OE2-CE 3.24Å; E192-K195 IonicContact OE2-NZ 2.67Å; E192-K195 PolarHBondContact OE2-NZ 3.34Å
193	S	66.4	Low	75.4	Confident	84 Å²	84	73.9 Å²	73.9	59%	0.587	39%	0.39	S	S	*	.			trans	-61.8	139.7	153.8	47.8	0	0	0	0	107.6	K195	S193-K195 PolarHBondContact O-N 3.18Å
194	P	65.3	Low	76.8	Confident	62 Å²	62	74 Å²	74	40%	0.403	38%	0.378	S	S	.	.			trans	-55.8	110.9	178.6	20.7	-30.7	0	0	0	109	V9 T196	V9-P194 HydrophobicContact CG1-CG 3.87Å; P194-T196 PolarHBondContact O-N 3.21Å
195	K	66.9	Low	78.3	Confident	135 Å²	135	70.2 Å²	70.2	59%	0.587	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-66.2	122.6	177.6	-72.7	173.6	176.4	149.6	0	108.2	R190 E192 S193	R190-K195 VanDerWaalsContact NH2-NZ 3.17Å; E192-K195 VanDerWaalsContact CD-NZ 3.29Å; E192-K195 IonicContact OE1-NZ 2.62Å; E192-K195 PolarHBondContact OE1-NZ 3.28Å; E192-K195 VanDerWaalsContact OE1-NZ 3.12Å; E192-K195 WeakPolarHBondContact OE2-CD 3.42Å; E192-K195 WeakPolarHBondContact OE2-CE 3.24Å; E192-K195 IonicContact OE2-NZ 2.67Å; E192-K195 PolarHBondContact OE2-NZ 3.34Å; S193-K195 PolarHBondContact O-N 3.18Å
196	T	75.8	Confident	79.4	Confident	43 Å²	43	73.9 Å²	73.9	26%	0.264	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-77.9	145	165.1	49.8	0	0	0	0	109	P194 L202 T265	P194-T196 PolarHBondContact O-N 3.21Å; T196-L202 HydrophobicContact CG2-CD1 3.74Å; T196-L202 HydrophobicContact CG2-CD2 4.22Å; T196-L202 HydrophobicContact CG2-CG 3.86Å; T196-T265 HydrophobicContact CG2-CG2 4.23Å
197	P	81.4	Confident	80.3	Confident	43 Å²	43	77.5 Å²	77.5	28%	0.279	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-58.1	153.8	171.6	23.8	-30.5	0	0	0	110.2	V200 S275	P197-V200 HydrophobicContact CG-CB 4.16Å; P197-V200 HydrophobicContact CG-CG2 3.76Å; P197-V200 PolarHBondContact O-N 2.93Å; P197-S275 WeakPolarHBondContact CD-O 3.41Å; P197-S275 WeakPolarHBondContact CG-O 3.41Å
198	P	81.3	Confident	80.8	Confident	107 Å²	107	77.4 Å²	77.4	70%	0.695	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	147.2	175.1	25.6	-34	0	0	0	110	V200	P198-V200 VanDerWaalsContact C-N 3.28Å; P198-V200 PolarHBondContact O-N 2.96Å
199	H	85.8	Confident	81.1	Confident	160 Å²	160	75.5 Å²	75.5	74%	0.741	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	7	-175.3	-44.9	-73.6	0	0	0	116.7	H263	H199-H263 WeakPolarHBondContact O-CB 3.16Å; H199-H263 PolarHBondContact O-CD2 3.26Å
200	V	90.9	Very high	81.5	Confident	14 Å²	14	73.2 Å²	73.2	9%	0.085	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-103.3	121.9	170.2	175	0	0	0	0	110.7	P197 P198 H263 T265 P277 I280	P197-V200 HydrophobicContact CG-CB 4.16Å; P197-V200 HydrophobicContact CG-CG2 3.76Å; P197-V200 PolarHBondContact O-N 2.93Å; P198-V200 VanDerWaalsContact C-N 3.28Å; P198-V200 PolarHBondContact O-N 2.96Å; V200-H263 CarbonylContact C-O 3.58Å; V200-H263 VanDerWaalsContact CA-O 3.28Å; V200-H263 WeakPolarHBondContact CA-O 3.35Å; V200-T265 HydrophobicContact CG1-CG2 3.53Å; V200-P277 HydrophobicContact CG2-CB 4.31Å; V200-I280 HydrophobicContact CG1-CD1 3.83Å; V200-I280 HydrophobicContact CG2-CD1 4.48Å
201	V	90.4	Very high	82.1	Confident	34 Å²	34	71.2 Å²	71.2	21%	0.206	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-93.5	133.1	-179	-177.5	0	0	0	0	110.2	L205 K208 H263 T264 T265	V201-L205 HydrophobicContact CG1-CD2 4.28Å; V201-K208 HydrophobicContact CG1-CB 4.42Å; V201-H263 PolarHBondContact N-O 3Å; V201-T264 HydrophobicContact CB-CG2 4.17Å; V201-T264 CarbonylContact O-C 3.53Å; V201-T264 VanDerWaalsContact O-CA 3.27Å; V201-T264 WeakPolarHBondContact O-CA 3.39Å; V201-T265 PolarHBondContact O-N 3.1Å
202	L	88.8	Confident	82.9	Confident	33 Å²	33	64.6 Å²	64.6	17%	0.173	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-75.1	136.3	177.3	-67.4	89.7	0	0	0	111.1	T196 Y204 L205	T196-L202 HydrophobicContact CG2-CD1 3.74Å; T196-L202 HydrophobicContact CG2-CD2 4.22Å; T196-L202 HydrophobicContact CG2-CG 3.86Å; L202-Y204 VanDerWaalsContact C-N 3.27Å; L202-Y204 HydrophobicContact CB-CD1 4.41Å; L202-Y204 HydrophobicContact CB-CE1 4.14Å; L202-Y204 HydrophobicContact CD2-CE1 3.56Å; L202-Y204 HydrophobicContact CD2-CE2 4.24Å; L202-Y204 WeakPolarHBondContact CD2-OH 3.44Å; L202-Y204 HydrophobicContact CG-CE1 4.44Å; L202-Y204 PolarHBondContact O-N 3.31Å; L202-L205 HydrophobicContact CB-CB 4.49Å; L202-L205 VanDerWaalsContact O-CB 3.29Å; L202-L205 WeakPolarHBondContact O-CB 3.45Å; L202-L205 PolarHBondContact O-N 2.78Å; L202-L205 VanDerWaalsContact O-N 3.16Å
203	H	85.7	Confident	84	Confident	44 Å²	44	67.9 Å²	67.9	20%	0.204	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-30.2	-176.6	62.5	-82.2	0	0	0	113.7	R5 T265 V267	R5-H203 PolarHBondContact O-NE2 3.25Å; R5-H203 VanDerWaalsContact O-NE2 3.17Å; H203-T265 WeakPolarHBondContact CB-O 3.42Å; H203-T265 PolarHBondContact N-OG1 2.7Å; H203-T265 PolarHBondContact ND1-OG1 3.19Å; H203-V267 VanDerWaalsContact CE1-CG2 3.5Å; H203-V267 WeakPolarHBondContact CE1-CG2 3.33Å; H203-V267 WeakPolarHBondContact NE2-CG2 3.29Å
204	Y	83.8	Confident	85.2	Confident	84 Å²	84	67.8 Å²	67.8	33%	0.329	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	3	-180	64.2	-99.1	0	0	0	113.5	V9 L202	V9-Y204 HydrophobicContact CG2-CE1 4.12Å; L202-Y204 VanDerWaalsContact C-N 3.27Å; L202-Y204 HydrophobicContact CB-CD1 4.41Å; L202-Y204 HydrophobicContact CB-CE1 4.14Å; L202-Y204 HydrophobicContact CD2-CE1 3.56Å; L202-Y204 HydrophobicContact CD2-CE2 4.24Å; L202-Y204 WeakPolarHBondContact CD2-OH 3.44Å; L202-Y204 HydrophobicContact CG-CE1 4.44Å; L202-Y204 PolarHBondContact O-N 3.31Å
205	L	86.6	Confident	86.4	Confident	75 Å²	75	65.2 Å²	65.2	39%	0.393	34%	0.335	S	S	.	.			trans	-63.5	144.4	178	-167.5	64.9	0	0	0	110.1	V201 L202 F207 K208 T209	V201-L205 HydrophobicContact CG1-CD2 4.28Å; L202-L205 HydrophobicContact CB-CB 4.49Å; L202-L205 VanDerWaalsContact O-CB 3.29Å; L202-L205 WeakPolarHBondContact O-CB 3.45Å; L202-L205 PolarHBondContact O-N 2.78Å; L202-L205 VanDerWaalsContact O-N 3.16Å; L205-F207 VanDerWaalsContact C-N 3.29Å; L205-F207 HydrophobicContact CD2-CB 4.15Å; L205-F207 HydrophobicContact CG-CB 4.33Å; L205-F207 PolarHBondContact O-N 3.42Å; L205-K208 HydrophobicContact CB-CB 4.44Å; L205-K208 PolarHBondContact O-N 3.48Å; L205-K208 VanDerWaalsContact O-N 3.14Å; L205-T209 PolarHBondContact O-N 3.5Å; L205-T209 PolarHBondContact O-OG1 3.14Å; L205-T209 VanDerWaalsContact O-OG1 3.08Å
206	T	88.1	Confident	87.4	Confident	118 Å²	118	61 Å²	61	72%	0.724	32%	0.317	S	S	*	.	H	α-helix	trans	-58	-41.9	178.8	49.5	0	0	0	0	111.8	K208 T209 A210	T206-K208 PolarHBondContact O-N 2.9Å; T206-T209 PolarHBondContact O-N 2.81Å; T206-A210 PolarHBondContact O-N 2.93Å
207	F	91.5	Very high	88	Confident	106 Å²	106	64.6 Å²	64.6	47%	0.465	33%	0.334	S	S	.	.	H	α-helix	trans	-55.5	-50.5	173.7	170.1	-103.4	0	0	0	112	L205 T209 A210 W211	L205-F207 VanDerWaalsContact C-N 3.29Å; L205-F207 HydrophobicContact CD2-CB 4.15Å; L205-F207 HydrophobicContact CG-CB 4.33Å; L205-F207 PolarHBondContact O-N 3.42Å; F207-T209 VanDerWaalsContact C-N 3.31Å; F207-T209 PolarHBondContact O-N 2.92Å; F207-A210 PolarHBondContact O-N 3.42Å; F207-W211 WeakPolarHBondContact O-CB 3.1Å; F207-W211 PolarHBondContact O-N 3.34Å
208	K	89.6	Confident	88.5	Confident	15 Å²	15	64.1 Å²	64.1	7%	0.065	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-40.9	179.3	-177.4	56.1	169.1	75.2	0	111.4	V201 L205 T206 W211 D212 T264	V201-K208 HydrophobicContact CG1-CB 4.42Å; L205-K208 HydrophobicContact CB-CB 4.44Å; L205-K208 PolarHBondContact O-N 3.48Å; L205-K208 VanDerWaalsContact O-N 3.14Å; T206-K208 PolarHBondContact O-N 2.9Å; K208-W211 WeakPolarHBondContact O-CB 3.35Å; K208-W211 PolarHBondContact O-N 3.48Å; K208-D212 IonicContact NZ-OD1 3.41Å; K208-D212 PolarHBondContact NZ-OD1 3.04Å; K208-D212 IonicContact NZ-OD2 3.81Å; K208-D212 PolarHBondContact NZ-OD2 2.98Å; K208-D212 WeakPolarHBondContact O-CB 3.43Å; K208-D212 PolarHBondContact O-N 3.33Å; K208-T264 HydrophobicContact CD-CG2 3.92Å
209	T	86.7	Confident	89	Confident	45 Å²	45	59 Å²	59	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-43	176.8	-55.1	0	0	0	0	111.9	L205 T206 F207 D212 W213	L205-T209 PolarHBondContact O-N 3.5Å; L205-T209 PolarHBondContact O-OG1 3.14Å; L205-T209 VanDerWaalsContact O-OG1 3.08Å; T206-T209 PolarHBondContact O-N 2.81Å; F207-T209 VanDerWaalsContact C-N 3.31Å; F207-T209 PolarHBondContact O-N 2.92Å; T209-D212 PolarHBondContact O-N 3.08Å; T209-W213 VanDerWaalsContact O-CD1 3.24Å; T209-W213 PolarHBondContact O-N 3.18Å
210	A	90.3	Very high	89.2	Confident	52 Å²	52	52 Å²	52	43%	0.43	27%	0.267	S	S	.	.	H	α-helix	trans	-66.2	-43.3	176.8	0	0	0	0	0	111.8	T206 F207 D212 W213 I214	T206-A210 PolarHBondContact O-N 2.93Å; F207-A210 PolarHBondContact O-N 3.42Å; A210-D212 VanDerWaalsContact C-N 3.28Å; A210-D212 PolarHBondContact O-N 3.4Å; A210-W213 WeakPolarHBondContact O-CB 3.46Å; A210-W213 PolarHBondContact O-N 3.31Å; A210-W213 VanDerWaalsContact O-N 3.16Å; A210-I214 WeakPolarHBondContact O-CG1 3.46Å; A210-I214 PolarHBondContact O-N 3.38Å; A210-I214 VanDerWaalsContact O-N 3.1Å
211	W	92.3	Very high	89.2	Confident	40 Å²	40	55 Å²	55	15%	0.152	28%	0.277	C	S	.	.	H	α-helix	trans	-56.2	-44.3	173.9	-176	-95.3	0	0	0	111.8	F207 K208 W213 I214 I215 I253 I256 D257 L260	F207-W211 WeakPolarHBondContact O-CB 3.1Å; F207-W211 PolarHBondContact O-N 3.34Å; K208-W211 WeakPolarHBondContact O-CB 3.35Å; K208-W211 PolarHBondContact O-N 3.48Å; W211-W213 VanDerWaalsContact C-N 3.29Å; W211-W213 PolarHBondContact O-N 3.48Å; W211-I214 WeakPolarHBondContact O-CB 3.35Å; W211-I214 PolarHBondContact O-N 2.88Å; W211-I215 HydrophobicContact CZ2-CD1 4.28Å; W211-I215 WeakPolarHBondContact O-CG1 3.34Å; W211-I215 PolarHBondContact O-N 2.91Å; W211-I253 HydrophobicContact CH2-CG2 4.08Å; W211-I253 HydrophobicContact CZ2-CG2 4.08Å; W211-I256 HydrophobicContact CH2-CB 4.47Å; W211-I256 HydrophobicContact CH2-CG2 3.89Å; W211-I256 HydrophobicContact CZ2-CB 4.33Å; W211-I256 HydrophobicContact CZ2-CG2 3.85Å; W211-D257 PolarHBondContact NE1-OD1 3.28Å; W211-L260 HydrophobicContact CD2-CD1 3.9Å; W211-L260 VanDerWaalsContact CE2-CD1 3.47Å; W211-L260 HydrophobicContact CG-CD1 4.26Å; W211-L260 HydrophobicContact CH2-CD1 4.42Å; W211-L260 HydrophobicContact CZ2-CD1 3.77Å
212	D	88.3	Confident	89.1	Confident	11 Å²	11	53.6 Å²	53.6	6%	0.059	27%	0.269	C	S	.	.	H	α-helix	trans	-64.2	-31.8	179.1	-71.3	-41.4	0	0	0	113.7	K208 T209 A210 F216 K332	K208-D212 IonicContact NZ-OD1 3.41Å; K208-D212 PolarHBondContact NZ-OD1 3.04Å; K208-D212 IonicContact NZ-OD2 3.81Å; K208-D212 PolarHBondContact NZ-OD2 2.98Å; K208-D212 WeakPolarHBondContact O-CB 3.43Å; K208-D212 PolarHBondContact O-N 3.33Å; T209-D212 PolarHBondContact O-N 3.08Å; A210-D212 VanDerWaalsContact C-N 3.28Å; A210-D212 PolarHBondContact O-N 3.4Å; D212-F216 WeakPolarHBondContact O-CB 3.37Å; D212-F216 PolarHBondContact O-N 2.73Å; D212-K332 HydrophobicContact CB-CD 4.13Å; D212-K332 VanDerWaalsContact CB-CE 3.42Å; D212-K332 VanDerWaalsContact OD1-CE 3.25Å; D212-K332 WeakPolarHBondContact OD1-CE 3.4Å; D212-K332 IonicContact OD1-NZ 2.72Å; D212-K332 WeakPolarHBondContact OD2-CE 3.44Å; D212-K332 IonicContact OD2-NZ 3.56Å; D212-K332 PolarHBondContact OD2-NZ 3.33Å
213	W	87.9	Confident	89.3	Confident	121 Å²	121	52 Å²	52	46%	0.458	26%	0.261	S	S	.	.	H	α-helix	trans	-69.1	-38.5	170.8	-82.4	110.5	0	0	0	112.3	T209 A210 W211 F216 L217 Y336	T209-W213 VanDerWaalsContact O-CD1 3.24Å; T209-W213 PolarHBondContact O-N 3.18Å; A210-W213 WeakPolarHBondContact O-CB 3.46Å; A210-W213 PolarHBondContact O-N 3.31Å; A210-W213 VanDerWaalsContact O-N 3.16Å; W211-W213 VanDerWaalsContact C-N 3.29Å; W211-W213 PolarHBondContact O-N 3.48Å; W213-F216 AromaticContact CE3-CD1 3.94Å; W213-F216 HydrophobicContact CE3-CD1 3.94Å; W213-F216 AromaticContact CZ3-CD1 3.96Å; W213-F216 HydrophobicContact CZ3-CD1 3.96Å; W213-F216 HydrophobicContact CZ3-CE1 4.16Å; W213-F216 WeakPolarHBondContact O-CB 3.14Å; W213-F216 PolarHBondContact O-N 3.46Å; W213-L217 WeakPolarHBondContact O-CG 3.39Å; W213-L217 PolarHBondContact O-N 2.75Å; W213-Y336 HydrophobicContact CD2-CE1 4.42Å; W213-Y336 HydrophobicContact CE3-CE1 4.3Å; W213-Y336 AromaticContact CH2-CD1 3.84Å; W213-Y336 HydrophobicContact CH2-CD1 3.84Å; W213-Y336 AromaticContact CH2-CE1 3.5Å; W213-Y336 HydrophobicContact CH2-CE1 3.5Å; W213-Y336 HydrophobicContact CZ2-CD1 4.13Å; W213-Y336 AromaticContact CZ2-CE1 3.63Å; W213-Y336 HydrophobicContact CZ2-CE1 3.63Å; W213-Y336 HydrophobicContact CZ3-CD1 4.44Å; W213-Y336 AromaticContact CZ3-CE1 3.85Å; W213-Y336 HydrophobicContact CZ3-CE1 3.85Å
214	I	91.5	Very high	89.5	Confident	81 Å²	81	53.1 Å²	53.1	42%	0.415	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-47.8	174.5	-64.9	167.7	0	0	0	109.8	A210 W211 F216 L217 L218	A210-I214 WeakPolarHBondContact O-CG1 3.46Å; A210-I214 PolarHBondContact O-N 3.38Å; A210-I214 VanDerWaalsContact O-N 3.1Å; W211-I214 WeakPolarHBondContact O-CB 3.35Å; W211-I214 PolarHBondContact O-N 2.88Å; I214-F216 VanDerWaalsContact C-N 3.28Å; I214-F216 PolarHBondContact O-N 3.41Å; I214-L217 PolarHBondContact O-N 2.96Å; I214-L218 HydrophobicContact CG2-CD1 3.9Å; I214-L218 HydrophobicContact CG2-CG 4.33Å; I214-L218 WeakPolarHBondContact O-CB 3.33Å; I214-L218 WeakPolarHBondContact O-CG 3.48Å; I214-L218 PolarHBondContact O-N 2.79Å
215	I	90.6	Very high	89.8	Confident	8 Å²	8	51.2 Å²	51.2	4%	0.041	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-38.8	176.5	-63.9	-60.4	0	0	0	111.5	W211 T219 I253 F254 D257	W211-I215 HydrophobicContact CZ2-CD1 4.28Å; W211-I215 WeakPolarHBondContact O-CG1 3.34Å; W211-I215 PolarHBondContact O-N 2.91Å; I215-T219 WeakPolarHBondContact O-CB 3.02Å; I215-T219 PolarHBondContact O-N 3.38Å; I215-T219 PolarHBondContact O-OG1 3.31Å; I215-I253 HydrophobicContact CD1-CG2 3.88Å; I215-F254 HydrophobicContact CD1-CD1 4.49Å; I215-F254 HydrophobicContact CG2-CE1 3.95Å; I215-D257 HydrophobicContact CD1-CB 3.84Å; I215-D257 HydrophobicContact CG1-CB 4.38Å
216	F	87.6	Confident	89.8	Confident	46 Å²	46	48 Å²	48	20%	0.202	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-49	175.2	174.2	-102.6	0	0	0	112.2	D212 W213 I214 T219 G220 V329 Y336	D212-F216 WeakPolarHBondContact O-CB 3.37Å; D212-F216 PolarHBondContact O-N 2.73Å; W213-F216 AromaticContact CE3-CD1 3.94Å; W213-F216 HydrophobicContact CE3-CD1 3.94Å; W213-F216 AromaticContact CZ3-CD1 3.96Å; W213-F216 HydrophobicContact CZ3-CD1 3.96Å; W213-F216 HydrophobicContact CZ3-CE1 4.16Å; W213-F216 WeakPolarHBondContact O-CB 3.14Å; W213-F216 PolarHBondContact O-N 3.46Å; I214-F216 VanDerWaalsContact C-N 3.28Å; I214-F216 PolarHBondContact O-N 3.41Å; F216-T219 PolarHBondContact O-N 3.07Å; F216-G220 PolarHBondContact O-N 3.28Å; F216-V329 HydrophobicContact CD2-CG1 3.98Å; F216-V329 HydrophobicContact CD2-CG2 4Å; F216-V329 HydrophobicContact CE2-CG1 3.81Å; F216-V329 HydrophobicContact CE2-CG2 4.38Å; F216-Y336 HydrophobicContact CD2-CE2 4.15Å; F216-Y336 HydrophobicContact CE2-CE2 4.49Å
217	L	89.3	Confident	89.9	Confident	120 Å²	120	43.1 Å²	43.1	63%	0.628	22%	0.215	S	C	*	.	H	α-helix	trans	-63.7	-43.2	178.3	-68.7	173.9	0	0	0	112.1	W213 I214 T219 G220 Y221	W213-L217 WeakPolarHBondContact O-CG 3.39Å; W213-L217 PolarHBondContact O-N 2.75Å; I214-L217 PolarHBondContact O-N 2.96Å; L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 3.04Å; L217-G220 PolarHBondContact O-N 3.41Å; L217-Y221 PolarHBondContact O-N 3.35Å
218	L	91.6	Very high	89.9	Confident	32 Å²	32	41.8 Å²	41.8	17%	0.168	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-37.3	175.8	-71	177.1	0	0	0	112	I214 Y221 T222 V250 I253 F254	I214-L218 HydrophobicContact CG2-CD1 3.9Å; I214-L218 HydrophobicContact CG2-CG 4.33Å; I214-L218 WeakPolarHBondContact O-CB 3.33Å; I214-L218 WeakPolarHBondContact O-CG 3.48Å; I214-L218 PolarHBondContact O-N 2.79Å; L218-Y221 WeakPolarHBondContact O-CB 3.2Å; L218-Y221 PolarHBondContact O-N 3.25Å; L218-T222 WeakPolarHBondContact O-CG2 3.5Å; L218-T222 PolarHBondContact O-N 3.07Å; L218-T222 PolarHBondContact O-OG1 3.17Å; L218-V250 HydrophobicContact CD2-CG2 4.11Å; L218-I253 HydrophobicContact CD1-CB 4.17Å; L218-I253 HydrophobicContact CD1-CD1 3.92Å; L218-I253 HydrophobicContact CD1-CG2 3.57Å; L218-F254 HydrophobicContact CB-CE2 4.18Å; L218-F254 HydrophobicContact CB-CZ 4.04Å
219	T	90.8	Very high	89.6	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-45.6	174.5	-55.9	0	0	0	0	110.4	I215 F216 L217 Y221 T222 C223 R325 V329	I215-T219 WeakPolarHBondContact O-CB 3.02Å; I215-T219 PolarHBondContact O-N 3.38Å; I215-T219 PolarHBondContact O-OG1 3.31Å; F216-T219 PolarHBondContact O-N 3.07Å; L217-T219 VanDerWaalsContact C-N 3.31Å; L217-T219 PolarHBondContact O-N 3.04Å; T219-Y221 VanDerWaalsContact C-N 3.33Å; T219-Y221 PolarHBondContact O-N 2.72Å; T219-T222 WeakPolarHBondContact CA-OG1 3.35Å; T219-T222 PolarHBondContact O-N 2.82Å; T219-T222 PolarHBondContact O-OG1 3.47Å; T219-C223 PolarHBondContact O-N 3.49Å; T219-C223 PolarHBondContact O-SG 3.15Å; T219-R325 HydrophobicContact CG2-CB 4Å; T219-V329 HydrophobicContact CG2-CG2 3.9Å
220	G	89.9	Confident	89.6	Confident	12 Å²	12	42 Å²	42	12%	0.124	21%	0.212	C	C	.	.	H	α-helix	trans	-56.6	-44.4	174	0	0	0	0	0	113	F216 L217 C223 I224	F216-G220 PolarHBondContact O-N 3.28Å; L217-G220 PolarHBondContact O-N 3.41Å; G220-C223 PolarHBondContact O-N 2.77Å; G220-I224 PolarHBondContact O-N 2.67Å
221	Y	90.9	Very high	89.5	Confident	76 Å²	76	39.9 Å²	39.9	30%	0.298	19%	0.194	S	C	.	.	H	α-helix	trans	-58.2	-48.5	173.9	168.6	-98.8	0	0	0	112.1	L217 L218 T219 C223 I224 I225 V246 V250	L217-Y221 PolarHBondContact O-N 3.35Å; L218-Y221 WeakPolarHBondContact O-CB 3.2Å; L218-Y221 PolarHBondContact O-N 3.25Å; T219-Y221 VanDerWaalsContact C-N 3.33Å; T219-Y221 PolarHBondContact O-N 2.72Å; Y221-C223 VanDerWaalsContact C-N 3.31Å; Y221-C223 PolarHBondContact O-N 2.98Å; Y221-I224 PolarHBondContact O-N 3.37Å; Y221-I224 VanDerWaalsContact O-N 3.16Å; Y221-I225 HydrophobicContact CD2-CG1 3.92Å; Y221-I225 HydrophobicContact CE1-CG1 4.3Å; Y221-I225 HydrophobicContact CE2-CD1 4.24Å; Y221-I225 HydrophobicContact CE2-CG1 3.46Å; Y221-I225 VanDerWaalsContact CE2-CG1 3.46Å; Y221-I225 PolarHBondContact O-N 3.33Å; Y221-V246 HydrophobicContact CE1-CG1 4.26Å; Y221-V246 WeakPolarHBondContact OH-CG1 3.4Å; Y221-V250 HydrophobicContact CD1-CG2 4.37Å; Y221-V250 HydrophobicContact CE1-CG2 4.15Å
222	T	90.1	Very high	89.1	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-35.6	179.9	58.3	0	0	0	0	112.8	L218 T219 I224 I226 V250 F254	L218-T222 WeakPolarHBondContact O-CG2 3.5Å; L218-T222 PolarHBondContact O-N 3.07Å; L218-T222 PolarHBondContact O-OG1 3.17Å; T219-T222 WeakPolarHBondContact CA-OG1 3.35Å; T219-T222 PolarHBondContact O-N 2.82Å; T219-T222 PolarHBondContact O-OG1 3.47Å; T222-I224 PolarHBondContact O-N 3.36Å; T222-I226 HydrophobicContact CG2-CD1 4.46Å; T222-I226 VanDerWaalsContact O-CB 3.3Å; T222-I226 WeakPolarHBondContact O-CB 3.2Å; T222-I226 WeakPolarHBondContact O-CD1 3.41Å; T222-I226 WeakPolarHBondContact O-CG1 3.42Å; T222-I226 PolarHBondContact O-N 3.26Å; T222-I226 VanDerWaalsContact O-N 3.11Å; T222-V250 HydrophobicContact CG2-CG1 3.8Å; T222-F254 HydrophobicContact CG2-CE2 4.08Å
223	C	91.4	Very high	88.3	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-67.1	-22.4	178.7	-68.1	0	0	0	0	113.2	T219 G220 Y221 P227 L353 W357	T219-C223 PolarHBondContact O-N 3.49Å; T219-C223 PolarHBondContact O-SG 3.15Å; G220-C223 PolarHBondContact O-N 2.77Å; Y221-C223 VanDerWaalsContact C-N 3.31Å; Y221-C223 PolarHBondContact O-N 2.98Å; C223-P227 VanDerWaalsContact O-CD 3.27Å; C223-P227 WeakPolarHBondContact O-CD 3.49Å; C223-P227 WeakPolarHBondContact O-CG 3.23Å; C223-L353 HydrophobicContact CB-CD1 3.76Å; C223-L353 HydrophobicContact CB-CD2 3.81Å; C223-L353 HydrophobicContact CB-CG 4.39Å; C223-L353 WeakPolarHBondContact O-CD1 3.46Å; C223-W357 HydrophobicContact CB-CZ2 4.25Å; C223-W357 PolarHBondContact O-NE1 2.91Å
224	I	91.4	Very high	86.9	Confident	66 Å²	66	38.9 Å²	38.9	34%	0.338	20%	0.198	S	C	.	.	H	α-helix	trans	-90	-50.5	176.4	-62	168.2	0	0	0	110.2	G220 Y221 T222 I226 Y228 F349 L353 H356	G220-I224 PolarHBondContact O-N 2.67Å; Y221-I224 PolarHBondContact O-N 3.37Å; Y221-I224 VanDerWaalsContact O-N 3.16Å; T222-I224 PolarHBondContact O-N 3.36Å; I224-I226 PolarHBondContact O-N 3.49Å; I224-Y228 WeakPolarHBondContact O-CB 3.45Å; I224-F349 HydrophobicContact CD1-CE2 4.4Å; I224-F349 HydrophobicContact CD1-CZ 4.46Å; I224-L353 HydrophobicContact CG1-CD1 3.93Å; I224-H356 PolarHBondContact O-NE2 3.32Å
225	I	88.7	Confident	85	Confident	45 Å²	45	41.2 Å²	41.2	23%	0.231	21%	0.212	C	C	.	.	H	α-helix	trans	-71.6	-34.5	-172	-65.2	-57.7	0	0	0	112.9	Y221 Y228 S229	Y221-I225 HydrophobicContact CD2-CG1 3.92Å; Y221-I225 HydrophobicContact CE1-CG1 4.3Å; Y221-I225 HydrophobicContact CE2-CD1 4.24Å; Y221-I225 HydrophobicContact CE2-CG1 3.46Å; Y221-I225 VanDerWaalsContact CE2-CG1 3.46Å; Y221-I225 PolarHBondContact O-N 3.33Å; I225-Y228 PolarHBondContact O-N 3.34Å; I225-S229 WeakPolarHBondContact O-CB 3.24Å; I225-S229 PolarHBondContact O-N 2.87Å
226	I	87.8	Confident	83.1	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-68.9	-51	-172.5	-63.9	175	0	0	0	112.3	T222 I224 Y228 S229 V230 K319 R322	T222-I226 HydrophobicContact CG2-CD1 4.46Å; T222-I226 VanDerWaalsContact O-CB 3.3Å; T222-I226 WeakPolarHBondContact O-CB 3.2Å; T222-I226 WeakPolarHBondContact O-CD1 3.41Å; T222-I226 WeakPolarHBondContact O-CG1 3.42Å; T222-I226 PolarHBondContact O-N 3.26Å; T222-I226 VanDerWaalsContact O-N 3.11Å; I224-I226 PolarHBondContact O-N 3.49Å; I226-Y228 VanDerWaalsContact C-N 3.27Å; I226-Y228 PolarHBondContact O-N 2.99Å; I226-S229 PolarHBondContact O-N 3.45Å; I226-V230 VanDerWaalsContact O-CG2 3.31Å; I226-V230 WeakPolarHBondContact O-CG2 3.49Å; I226-V230 PolarHBondContact O-N 3.48Å; I226-K319 HydrophobicContact CG2-CB 4.41Å; I226-R322 HydrophobicContact CD1-CB 3.42Å; I226-R322 VanDerWaalsContact CD1-CB 3.42Å; I226-R322 HydrophobicContact CD1-CG 4.21Å
227	P	90.5	Very high	81.3	Confident	14 Å²	14	48.4 Å²	48.4	9%	0.091	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-38.5	174.8	-23.6	35.8	0	0	0	112.3	C223 V230 A231 L323 W357 C360	C223-P227 VanDerWaalsContact O-CD 3.27Å; C223-P227 WeakPolarHBondContact O-CD 3.49Å; C223-P227 WeakPolarHBondContact O-CG 3.23Å; P227-V230 PolarHBondContact O-N 3.17Å; P227-A231 VanDerWaalsContact O-CB 3.27Å; P227-A231 WeakPolarHBondContact O-CB 3.45Å; P227-A231 PolarHBondContact O-N 3.21Å; P227-L323 HydrophobicContact CG-CD1 4.47Å; P227-L323 HydrophobicContact CG-CD2 4.29Å; P227-W357 HydrophobicContact CG-CG 4.48Å; P227-C360 HydrophobicContact CB-CB 4.19Å
228	Y	89.7	Confident	79.6	Confident	78 Å²	78	46.3 Å²	46.3	31%	0.306	25%	0.25	S	C	.	.	H	α-helix	trans	-60.5	-48.4	174.8	179.2	-98.5	0	0	0	112.1	I224 I225 I226 V230 A231 F232 Y408	I224-Y228 WeakPolarHBondContact O-CB 3.45Å; I225-Y228 PolarHBondContact O-N 3.34Å; I226-Y228 VanDerWaalsContact C-N 3.27Å; I226-Y228 PolarHBondContact O-N 2.99Å; Y228-V230 VanDerWaalsContact C-N 3.35Å; Y228-V230 PolarHBondContact O-N 3.36Å; Y228-A231 PolarHBondContact O-N 3.32Å; Y228-F232 HydrophobicContact CD2-CB 4.4Å; Y228-F232 AromaticContact CD2-CD2 3.53Å; Y228-F232 HydrophobicContact CD2-CD2 3.53Å; Y228-F232 HydrophobicContact CD2-CE2 4.11Å; Y228-F232 HydrophobicContact CD2-CG 4.14Å; Y228-F232 HydrophobicContact CE2-CB 4.05Å; Y228-F232 AromaticContact CE2-CD2 3.71Å; Y228-F232 HydrophobicContact CE2-CD2 3.71Å; Y228-F232 HydrophobicContact CE2-CE2 4.35Å; Y228-F232 AromaticContact CE2-CG 3.86Å; Y228-F232 HydrophobicContact CE2-CG 3.86Å; Y228-F232 HydrophobicContact CG-CD2 4.31Å; Y228-F232 WeakPolarHBondContact O-CB 3.32Å; Y228-F232 PolarHBondContact O-N 3.39Å; Y228-Y408 HydrophobicContact CD2-CD2 4.11Å; Y228-Y408 HydrophobicContact CD2-CE2 4.32Å; Y228-Y408 HydrophobicContact CE2-CD2 4.19Å; Y228-Y408 HydrophobicContact CE2-CG 4.39Å
229	S	85.1	Confident	77.9	Confident	29 Å²	29	52 Å²	52	20%	0.203	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-39.8	178.4	177.5	0	0	0	0	112	I225 I226 G233	I225-S229 WeakPolarHBondContact O-CB 3.24Å; I225-S229 PolarHBondContact O-N 2.87Å; I226-S229 PolarHBondContact O-N 3.45Å; S229-G233 WeakPolarHBondContact O-CA 3.33Å; S229-G233 PolarHBondContact O-N 2.96Å
230	V	85.4	Confident	76.2	Confident	36 Å²	36	61.2 Å²	61.2	22%	0.218	32%	0.318	C	S	.	.	H	α-helix	trans	-71.2	-35.9	179.2	175.6	0	0	0	0	111.8	I226 P227 Y228 K319 L320	I226-V230 VanDerWaalsContact O-CG2 3.31Å; I226-V230 WeakPolarHBondContact O-CG2 3.49Å; I226-V230 PolarHBondContact O-N 3.48Å; P227-V230 PolarHBondContact O-N 3.17Å; Y228-V230 VanDerWaalsContact C-N 3.35Å; Y228-V230 PolarHBondContact O-N 3.36Å; V230-K319 HydrophobicContact CG2-CB 4.32Å; V230-L320 HydrophobicContact CB-CD1 4.12Å; V230-L320 HydrophobicContact CG1-CD1 3.78Å; V230-L320 HydrophobicContact CG2-CD1 3.68Å
231	A	87.8	Confident	75	Confident	8 Å²	8	62.1 Å²	62.1	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-78.7	-53.6	179.3	0	0	0	0	0	112.2	P227 Y228 C360 Y363 L364	P227-A231 VanDerWaalsContact O-CB 3.27Å; P227-A231 WeakPolarHBondContact O-CB 3.45Å; P227-A231 PolarHBondContact O-N 3.21Å; Y228-A231 PolarHBondContact O-N 3.32Å; A231-C360 HydrophobicContact CB-CB 3.82Å; A231-Y363 HydrophobicContact CB-CD1 4.08Å; A231-Y363 WeakPolarHBondContact O-CE1 3.22Å; A231-L364 HydrophobicContact CB-CD1 4.43Å; A231-L364 HydrophobicContact CB-CD2 4.4Å; A231-L364 HydrophobicContact CB-CG 4.1Å
232	F	85.5	Confident	74.4	Confident	4 Å²	4	65 Å²	65	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-101.2	-11.5	-169.6	-64.1	-91.2	0	0	0	114.4	Y228 H234 Y363 L407 Y408	Y228-F232 HydrophobicContact CD2-CB 4.4Å; Y228-F232 AromaticContact CD2-CD2 3.53Å; Y228-F232 HydrophobicContact CD2-CD2 3.53Å; Y228-F232 HydrophobicContact CD2-CE2 4.11Å; Y228-F232 HydrophobicContact CD2-CG 4.14Å; Y228-F232 HydrophobicContact CE2-CB 4.05Å; Y228-F232 AromaticContact CE2-CD2 3.71Å; Y228-F232 HydrophobicContact CE2-CD2 3.71Å; Y228-F232 HydrophobicContact CE2-CE2 4.35Å; Y228-F232 AromaticContact CE2-CG 3.86Å; Y228-F232 HydrophobicContact CE2-CG 3.86Å; Y228-F232 HydrophobicContact CG-CD2 4.31Å; Y228-F232 WeakPolarHBondContact O-CB 3.32Å; Y228-F232 PolarHBondContact O-N 3.39Å; F232-H234 PolarHBondContact O-N 3.28Å; F232-Y363 HydrophobicContact CD1-CD1 4.05Å; F232-Y363 HydrophobicContact CD1-CD2 4.21Å; F232-Y363 AromaticContact CD1-CE1 3.88Å; F232-Y363 HydrophobicContact CD1-CE1 3.88Å; F232-Y363 HydrophobicContact CD1-CE2 4.06Å; F232-Y363 HydrophobicContact CD1-CG 4.18Å; F232-Y363 AromaticContact CD1-CZ 3.87Å; F232-Y363 HydrophobicContact CD2-CD1 4.42Å; F232-Y363 AromaticContact CE1-CD1 3.85Å; F232-Y363 HydrophobicContact CE1-CD1 3.85Å; F232-Y363 AromaticContact CE1-CD2 3.46Å; F232-Y363 HydrophobicContact CE1-CD2 3.46Å; F232-Y363 VanDerWaalsContact CE1-CD2 3.46Å; F232-Y363 HydrophobicContact CE1-CE1 4.06Å; F232-Y363 AromaticContact CE1-CE2 3.71Å; F232-Y363 HydrophobicContact CE1-CE2 3.71Å; F232-Y363 AromaticContact CE1-CG 3.52Å; F232-Y363 HydrophobicContact CE1-CG 3.52Å; F232-Y363 AromaticContact CE1-CZ 3.98Å; F232-Y363 HydrophobicContact CE2-CD1 4.22Å; F232-Y363 HydrophobicContact CE2-CG 4.17Å; F232-Y363 HydrophobicContact CG-CD1 4.32Å; F232-Y363 HydrophobicContact CG-CE1 4.26Å; F232-Y363 AromaticContact CZ-CD1 3.92Å; F232-Y363 HydrophobicContact CZ-CD1 3.92Å; F232-Y363 AromaticContact CZ-CD2 3.85Å; F232-Y363 HydrophobicContact CZ-CD2 3.85Å; F232-Y363 AromaticContact CZ-CG 3.5Å; F232-Y363 HydrophobicContact CZ-CG 3.5Å; F232-Y363 VanDerWaalsContact CZ-CG 3.5Å; F232-L407 HydrophobicContact CE1-CB 4.28Å; F232-Y408 AromaticContact CE2-CD2 3.78Å; F232-Y408 HydrophobicContact CE2-CD2 3.78Å; F232-Y408 AromaticContact CZ-CD2 3.85Å; F232-Y408 HydrophobicContact CZ-CD2 3.85Å; F232-Y408 HydrophobicContact CZ-CG 4.37Å
233	G	70.1	Confident	73.7	Confident	10 Å²	10	72.5 Å²	72.5	10%	0.103	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	22.4	-166.5	0	0	0	0	0	116.8	S229 D235	S229-G233 WeakPolarHBondContact O-CA 3.33Å; S229-G233 PolarHBondContact O-N 2.96Å; G233-D235 PolarHBondContact O-N 3.27Å
234	H	58.8	Low	73	Confident	136 Å²	136	77.1 Å²	77.1	63%	0.63	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.3	177.7	-88.6	-6.5	0	0	0	113.9	F232	F232-H234 PolarHBondContact O-N 3.28Å
235	D	52.4	Low	72.5	Confident	130 Å²	130	76.4 Å²	76.4	70%	0.695	40%	0.395	S	S	*	.	S	Bend	trans	-116.4	-2.2	-175.1	-56.1	-38.8	0	0	0	115.1	G233 Q404	G233-D235 PolarHBondContact O-N 3.27Å; D235-Q404 PolarHBondContact OD2-NE2 3.37Å
236	T	50.9	Low	72.3	Confident	72 Å²	72	76.8 Å²	76.8	44%	0.442	40%	0.399	S	S	.	.			trans	-100.2	5.8	-172.9	53.1	0	0	0	0	114.8	S238	T236-S238 PolarHBondContact O-N 3.21Å
237	L	50	Low	72	Confident	134 Å²	134	78 Å²	78	70%	0.702	41%	0.405	S	S	*	.			trans	-77.6	45.4	179.5	-71.4	163.3	0	0	0	113.3	E239	L237-E239 PolarHBondContact O-N 3.3Å
238	S	52.1	Low	71.6	Confident	75 Å²	75	80 Å²	80	52%	0.524	41%	0.413	S	S	.	.			trans	-76.3	117.6	155.2	50.8	0	0	0	0	107.2	T236 E240 S241	T236-S238 PolarHBondContact O-N 3.21Å; S238-E240 PolarHBondContact O-N 2.75Å; S238-S241 WeakPolarHBondContact O-CB 3.18Å; S238-S241 PolarHBondContact O-N 3.46Å
239	E	55.9	Low	71.6	Confident	153 Å²	153	80.9 Å²	80.9	72%	0.715	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-17	-179.4	-65.6	-159.6	151.2	0	0	113.1	L237 S241	L237-E239 PolarHBondContact O-N 3.3Å; E239-S241 VanDerWaalsContact C-N 3.29Å; E239-S241 PolarHBondContact O-N 3.18Å
240	E	55.4	Low	71.8	Confident	193 Å²	193	79.9 Å²	79.9	90%	0.902	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	6.2	178.8	-58	-137.3	155.5	0	0	114.6	S238	S238-E240 PolarHBondContact O-N 2.75Å
241	S	65.9	Low	71.9	Confident	31 Å²	31	78.8 Å²	78.8	22%	0.217	41%	0.407	C	S	.	.			trans	-77.9	133.5	-175	-157.1	0	0	0	0	113.1	S238 E239 Y243 F244	S238-S241 WeakPolarHBondContact O-CB 3.18Å; S238-S241 PolarHBondContact O-N 3.46Å; E239-S241 VanDerWaalsContact C-N 3.29Å; E239-S241 PolarHBondContact O-N 3.18Å; S241-Y243 PolarHBondContact O-N 2.91Å; S241-Y243 VanDerWaalsContact OG-CD2 3.23Å; S241-Y243 WeakPolarHBondContact OG-CD2 3.46Å; S241-F244 WeakPolarHBondContact O-CB 3.49Å; S241-F244 PolarHBondContact O-N 3.16Å
242	I	77.2	Confident	72.1	Confident	137 Å²	137	83.3 Å²	83.3	70%	0.703	43%	0.429	S	S	*	.	H	α-helix	trans	-48.6	-31.8	171.6	-64.6	169.5	0	0	0	111.4	F244 A245 V246	I242-F244 PolarHBondContact O-N 3.25Å; I242-A245 PolarHBondContact O-N 2.73Å; I242-V246 HydrophobicContact CG2-CG2 4.24Å; I242-V246 WeakPolarHBondContact O-CG2 3.46Å; I242-V246 PolarHBondContact O-N 3.33Å
243	Y	76.6	Confident	72.4	Confident	162 Å²	162	85 Å²	85	64%	0.635	44%	0.439	S	S	*	.	H	α-helix	trans	-59.7	-41.5	177.2	-63.9	-67.8	0	0	0	113.3	S241 V246 E247	S241-Y243 PolarHBondContact O-N 2.91Å; S241-Y243 VanDerWaalsContact OG-CD2 3.23Å; S241-Y243 WeakPolarHBondContact OG-CD2 3.46Å; Y243-V246 PolarHBondContact O-N 3.26Å; Y243-E247 PolarHBondContact O-N 3.23Å
244	F	75.1	Confident	73.5	Confident	98 Å²	98	84.6 Å²	84.6	43%	0.43	43%	0.434	S	S	.	.	H	α-helix	trans	-64.9	-42.9	179.3	-175.9	-103.4	0	0	0	111.3	S241 I242 V246 E247 H248	S241-F244 WeakPolarHBondContact O-CB 3.49Å; S241-F244 PolarHBondContact O-N 3.16Å; I242-F244 PolarHBondContact O-N 3.25Å; F244-V246 PolarHBondContact O-N 2.91Å; F244-E247 PolarHBondContact O-N 3.28Å; F244-H248 AromaticContact CD1-CD2 3.63Å; F244-H248 AromaticContact CD1-NE2 3.86Å; F244-H248 AromaticContact CD2-NE2 3.96Å; F244-H248 AromaticContact CE1-CD2 3.38Å; F244-H248 WeakPolarHBondContact CE1-CD2 3.33Å; F244-H248 AromaticContact CE1-NE2 3.2Å; F244-H248 WeakPolarHBondContact CE1-NE2 3.23Å; F244-H248 AromaticContact CE2-NE2 3.32Å; F244-H248 VanDerWaalsContact CE2-NE2 3.32Å; F244-H248 WeakPolarHBondContact CE2-NE2 3.46Å; F244-H248 AromaticContact CZ-CD2 3.61Å; F244-H248 AromaticContact CZ-NE2 2.91Å; F244-H248 WeakPolarHBondContact CZ-NE2 3.39Å; F244-H248 PolarHBondContact O-CD2 2.79Å; F244-H248 VanDerWaalsContact O-CD2 3.22Å; F244-H248 PolarHBondContact O-N 3.48Å; F244-H248 VanDerWaalsContact O-N 3.16Å
245	A	81.8	Confident	75	Confident	52 Å²	52	83.9 Å²	83.9	43%	0.43	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-43.5	174.9	0	0	0	0	0	111.9	I242 H248 I249	I242-A245 PolarHBondContact O-N 2.73Å; A245-H248 PolarHBondContact O-N 2.9Å; A245-I249 VanDerWaalsContact O-CG1 3.29Å; A245-I249 WeakPolarHBondContact O-CG1 3.47Å; A245-I249 PolarHBondContact O-N 3.4Å
246	V	84.5	Confident	77	Confident	52 Å²	52	81.2 Å²	81.2	32%	0.315	41%	0.414	S	S	.	.	H	α-helix	trans	-63.1	-42.8	177.3	173.3	0	0	0	0	111.3	Y221 I242 Y243 F244 H248 I249 V250	Y221-V246 HydrophobicContact CE1-CG1 4.26Å; Y221-V246 WeakPolarHBondContact OH-CG1 3.4Å; I242-V246 HydrophobicContact CG2-CG2 4.24Å; I242-V246 WeakPolarHBondContact O-CG2 3.46Å; I242-V246 PolarHBondContact O-N 3.33Å; Y243-V246 PolarHBondContact O-N 3.26Å; F244-V246 PolarHBondContact O-N 2.91Å; V246-H248 VanDerWaalsContact C-N 3.33Å; V246-H248 PolarHBondContact O-N 3.14Å; V246-I249 PolarHBondContact O-N 3.32Å; V246-V250 HydrophobicContact CG1-CG2 4.33Å; V246-V250 VanDerWaalsContact O-CG2 3.27Å; V246-V250 WeakPolarHBondContact O-CG2 3.49Å; V246-V250 PolarHBondContact O-N 3.38Å
247	E	81	Confident	79	Confident	34 Å²	34	77.9 Å²	77.9	16%	0.159	39%	0.393	C	S	.	.	H	α-helix	trans	-57.7	-44.6	176.2	-76.7	-163.1	-168.4	0	0	112.3	Y243 F244 V250 D251 R322	Y243-E247 PolarHBondContact O-N 3.23Å; F244-E247 PolarHBondContact O-N 3.28Å; E247-V250 PolarHBondContact O-N 2.87Å; E247-D251 PolarHBondContact O-N 2.87Å; E247-R322 IonicContact OE2-CZ 3.25Å; E247-R322 IonicContact OE2-NH1 2.81Å; E247-R322 PolarHBondContact OE2-NH1 2.82Å
248	H	82.5	Confident	81.1	Confident	56 Å²	56	71.9 Å²	71.9	26%	0.259	36%	0.362	S	S	.	.	H	α-helix	trans	-66.5	-40.5	178.5	-77.9	-58.1	0	0	0	113.2	F244 A245 V246 V250 D251 I252	F244-H248 AromaticContact CD1-CD2 3.63Å; F244-H248 AromaticContact CD1-NE2 3.86Å; F244-H248 AromaticContact CD2-NE2 3.96Å; F244-H248 AromaticContact CE1-CD2 3.38Å; F244-H248 WeakPolarHBondContact CE1-CD2 3.33Å; F244-H248 AromaticContact CE1-NE2 3.2Å; F244-H248 WeakPolarHBondContact CE1-NE2 3.23Å; F244-H248 AromaticContact CE2-NE2 3.32Å; F244-H248 VanDerWaalsContact CE2-NE2 3.32Å; F244-H248 WeakPolarHBondContact CE2-NE2 3.46Å; F244-H248 AromaticContact CZ-CD2 3.61Å; F244-H248 AromaticContact CZ-NE2 2.91Å; F244-H248 WeakPolarHBondContact CZ-NE2 3.39Å; F244-H248 PolarHBondContact O-CD2 2.79Å; F244-H248 VanDerWaalsContact O-CD2 3.22Å; F244-H248 PolarHBondContact O-N 3.48Å; F244-H248 VanDerWaalsContact O-N 3.16Å; A245-H248 PolarHBondContact O-N 2.9Å; V246-H248 VanDerWaalsContact C-N 3.33Å; V246-H248 PolarHBondContact O-N 3.14Å; H248-V250 VanDerWaalsContact C-N 3.3Å; H248-V250 PolarHBondContact O-N 3.32Å; H248-D251 PolarHBondContact O-N 3.31Å; H248-I252 WeakPolarHBondContact O-CG1 3.36Å; H248-I252 PolarHBondContact O-N 3.08Å
249	I	89.5	Confident	83.1	Confident	96 Å²	96	71.5 Å²	71.5	49%	0.492	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-44	175	-69.1	165.3	0	0	0	110.3	A245 V246 D251 I252 I253	A245-I249 VanDerWaalsContact O-CG1 3.29Å; A245-I249 WeakPolarHBondContact O-CG1 3.47Å; A245-I249 PolarHBondContact O-N 3.4Å; V246-I249 PolarHBondContact O-N 3.32Å; I249-D251 PolarHBondContact O-N 3.16Å; I249-I252 PolarHBondContact O-N 2.92Å; I249-I253 HydrophobicContact CG2-CD1 4.09Å; I249-I253 WeakPolarHBondContact O-CG1 3.44Å; I249-I253 PolarHBondContact O-N 3.24Å
250	V	89.5	Confident	84.8	Confident	9 Å²	9	65.9 Å²	65.9	6%	0.055	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-43.7	178.4	172.6	0	0	0	0	110.8	L218 Y221 T222 V246 E247 H248 I252 I253 F254	L218-V250 HydrophobicContact CD2-CG2 4.11Å; Y221-V250 HydrophobicContact CD1-CG2 4.37Å; Y221-V250 HydrophobicContact CE1-CG2 4.15Å; T222-V250 HydrophobicContact CG2-CG1 3.8Å; V246-V250 HydrophobicContact CG1-CG2 4.33Å; V246-V250 VanDerWaalsContact O-CG2 3.27Å; V246-V250 WeakPolarHBondContact O-CG2 3.49Å; V246-V250 PolarHBondContact O-N 3.38Å; E247-V250 PolarHBondContact O-N 2.87Å; H248-V250 VanDerWaalsContact C-N 3.3Å; H248-V250 PolarHBondContact O-N 3.32Å; V250-I252 VanDerWaalsContact C-N 3.35Å; V250-I252 PolarHBondContact O-N 3.39Å; V250-I253 PolarHBondContact O-N 3.02Å; V250-F254 HydrophobicContact CG1-CD2 3.75Å; V250-F254 HydrophobicContact CG1-CE2 3.5Å; V250-F254 VanDerWaalsContact CG1-CE2 3.5Å; V250-F254 WeakPolarHBondContact O-CD2 3.43Å; V250-F254 PolarHBondContact O-N 3.5Å; V250-F254 VanDerWaalsContact O-N 3.09Å
251	D	88.1	Confident	86.6	Confident	12 Å²	12	57.4 Å²	57.4	6%	0.064	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-40.3	176.8	-74.1	-7.3	0	0	0	112.3	E247 H248 I249 I253 F254 F255 R322 R325	E247-D251 PolarHBondContact O-N 2.87Å; H248-D251 PolarHBondContact O-N 3.31Å; I249-D251 PolarHBondContact O-N 3.16Å; D251-I253 PolarHBondContact O-N 3.28Å; D251-F254 PolarHBondContact O-N 3.28Å; D251-F255 PolarHBondContact O-N 3.12Å; D251-R322 IonicContact OD1-CZ 2.95Å; D251-R322 IonicContact OD1-NE 3.1Å; D251-R322 IonicContact OD2-CZ 3.23Å; D251-R322 IonicContact OD2-NE 3.34Å; D251-R322 IonicContact OD2-NH2 3.38Å; D251-R322 PolarHBondContact OD2-NH2 2.87Å; D251-R325 IonicContact OD1-CZ 2.91Å; D251-R325 IonicContact OD1-NH1 3.79Å; D251-R325 PolarHBondContact OD1-NH1 3.42Å; D251-R325 VanDerWaalsContact OD1-NH1 3.1Å; D251-R325 IonicContact OD1-NH2 3.96Å; D251-R325 PolarHBondContact OD1-NH2 3.35Å
252	I	90.8	Very high	87.9	Confident	103 Å²	103	57.8 Å²	57.8	53%	0.528	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-43.5	174.8	-67.8	165	0	0	0	111.1	H248 I249 V250 F254 F255 I256	H248-I252 WeakPolarHBondContact O-CG1 3.36Å; H248-I252 PolarHBondContact O-N 3.08Å; I249-I252 PolarHBondContact O-N 2.92Å; V250-I252 VanDerWaalsContact C-N 3.35Å; V250-I252 PolarHBondContact O-N 3.39Å; I252-F254 VanDerWaalsContact C-N 3.33Å; I252-F254 PolarHBondContact O-N 3.4Å; I252-F255 WeakPolarHBondContact O-CB 3.07Å; I252-F255 PolarHBondContact O-N 3.27Å; I252-F255 VanDerWaalsContact O-N 3.16Å; I252-I256 HydrophobicContact CG2-CD1 4.06Å; I252-I256 WeakPolarHBondContact O-CG1 3.45Å; I252-I256 PolarHBondContact O-N 3.22Å
253	I	93	Very high	88.7	Confident	41 Å²	41	53.8 Å²	53.8	21%	0.21	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-41.9	178.3	-66.4	167.4	0	0	0	110.9	W211 I215 L218 I249 V250 D251 F255 I256 D257	W211-I253 HydrophobicContact CH2-CG2 4.08Å; W211-I253 HydrophobicContact CZ2-CG2 4.08Å; I215-I253 HydrophobicContact CD1-CG2 3.88Å; L218-I253 HydrophobicContact CD1-CB 4.17Å; L218-I253 HydrophobicContact CD1-CD1 3.92Å; L218-I253 HydrophobicContact CD1-CG2 3.57Å; I249-I253 HydrophobicContact CG2-CD1 4.09Å; I249-I253 WeakPolarHBondContact O-CG1 3.44Å; I249-I253 PolarHBondContact O-N 3.24Å; V250-I253 PolarHBondContact O-N 3.02Å; D251-I253 PolarHBondContact O-N 3.28Å; I253-F255 VanDerWaalsContact C-N 3.31Å; I253-F255 PolarHBondContact O-N 3.17Å; I253-I256 PolarHBondContact O-N 2.85Å; I253-D257 PolarHBondContact O-N 3.21Å
254	F	92	Very high	89.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-32.8	175.7	-80.3	-69.9	0	0	0	112.9	I215 L218 T222 V250 D251 I252 D257 I258 R325	I215-F254 HydrophobicContact CD1-CD1 4.49Å; I215-F254 HydrophobicContact CG2-CE1 3.95Å; L218-F254 HydrophobicContact CB-CE2 4.18Å; L218-F254 HydrophobicContact CB-CZ 4.04Å; T222-F254 HydrophobicContact CG2-CE2 4.08Å; V250-F254 HydrophobicContact CG1-CD2 3.75Å; V250-F254 HydrophobicContact CG1-CE2 3.5Å; V250-F254 VanDerWaalsContact CG1-CE2 3.5Å; V250-F254 WeakPolarHBondContact O-CD2 3.43Å; V250-F254 PolarHBondContact O-N 3.5Å; V250-F254 VanDerWaalsContact O-N 3.09Å; D251-F254 PolarHBondContact O-N 3.28Å; I252-F254 VanDerWaalsContact C-N 3.33Å; I252-F254 PolarHBondContact O-N 3.4Å; F254-D257 WeakPolarHBondContact O-CB 3.49Å; F254-D257 PolarHBondContact O-N 3.15Å; F254-I258 WeakPolarHBondContact O-CG1 3.2Å; F254-I258 PolarHBondContact O-N 2.92Å; F254-R325 HydrophobicContact CD1-CG 4.43Å; F254-R325 VanDerWaalsContact CD2-NH1 3.34Å; F254-R325 HydrophobicContact CE1-CB 4.45Å; F254-R325 HydrophobicContact CE1-CG 4.19Å; F254-R325 HydrophobicContact CZ-CG 4.32Å
255	F	91.6	Very high	90.2	Very high	121 Å²	121	42.4 Å²	42.4	53%	0.531	22%	0.224	S	C	.	.	H	α-helix	trans	-66.8	-42.9	172.9	-170.6	-97.3	0	0	0	111.7	D251 I252 I253 D257 I258 V259	D251-F255 PolarHBondContact O-N 3.12Å; I252-F255 WeakPolarHBondContact O-CB 3.07Å; I252-F255 PolarHBondContact O-N 3.27Å; I252-F255 VanDerWaalsContact O-N 3.16Å; I253-F255 VanDerWaalsContact C-N 3.31Å; I253-F255 PolarHBondContact O-N 3.17Å; F255-D257 VanDerWaalsContact C-N 3.26Å; F255-D257 PolarHBondContact O-N 3.5Å; F255-I258 WeakPolarHBondContact O-CB 3.43Å; F255-I258 PolarHBondContact O-N 3.36Å; F255-I258 VanDerWaalsContact O-N 3.13Å; F255-V259 HydrophobicContact CE1-CG2 4.32Å; F255-V259 PolarHBondContact O-N 3.5Å
256	I	93.6	Very high	90.5	Very high	74 Å²	74	42.2 Å²	42.2	38%	0.379	21%	0.213	S	C	.	.	H	α-helix	trans	-59.4	-38.9	172.8	-65.8	168.1	0	0	0	110.7	W211 I252 I253 I258 V259 L260	W211-I256 HydrophobicContact CH2-CB 4.47Å; W211-I256 HydrophobicContact CH2-CG2 3.89Å; W211-I256 HydrophobicContact CZ2-CB 4.33Å; W211-I256 HydrophobicContact CZ2-CG2 3.85Å; I252-I256 HydrophobicContact CG2-CD1 4.06Å; I252-I256 WeakPolarHBondContact O-CG1 3.45Å; I252-I256 PolarHBondContact O-N 3.22Å; I253-I256 PolarHBondContact O-N 2.85Å; I256-I258 VanDerWaalsContact C-N 3.31Å; I256-I258 PolarHBondContact O-N 3.06Å; I256-V259 PolarHBondContact O-N 3.25Å; I256-V259 VanDerWaalsContact O-N 3.17Å; I256-L260 HydrophobicContact CG2-CD1 4.03Å; I256-L260 HydrophobicContact CG2-CG 4.31Å; I256-L260 WeakPolarHBondContact O-CG 3.38Å; I256-L260 PolarHBondContact O-N 3.37Å
257	D	93.6	Very high	90.6	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.011	21%	0.213	C	C	.	.	H	α-helix	trans	-60.8	-38.1	176.1	-170.1	56.5	0	0	0	112.6	W211 I215 I253 F254 F255 L260 N261 R328	W211-D257 PolarHBondContact NE1-OD1 3.28Å; I215-D257 HydrophobicContact CD1-CB 3.84Å; I215-D257 HydrophobicContact CG1-CB 4.38Å; I253-D257 PolarHBondContact O-N 3.21Å; F254-D257 WeakPolarHBondContact O-CB 3.49Å; F254-D257 PolarHBondContact O-N 3.15Å; F255-D257 VanDerWaalsContact C-N 3.26Å; F255-D257 PolarHBondContact O-N 3.5Å; D257-L260 PolarHBondContact O-N 3.34Å; D257-N261 WeakPolarHBondContact O-CB 3.31Å; D257-N261 PolarHBondContact O-N 3.13Å; D257-N261 PolarHBondContact O-ND2 3.29Å; D257-N261 PolarHBondContact OD2-ND2 2.88Å; D257-N261 VanDerWaalsContact OD2-ND2 3.14Å; D257-R328 IonicContact OD2-CZ 3.16Å; D257-R328 IonicContact OD2-NH1 3.91Å; D257-R328 PolarHBondContact OD2-NH1 3.23Å
258	I	93.1	Very high	90.6	Very high	8 Å²	8	41.3 Å²	41.3	4%	0.041	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-47.5	174.2	-65.8	172.1	0	0	0	110.2	F254 F255 I256 L260 N261 F262 Y284 F289 D292 S296	F254-I258 WeakPolarHBondContact O-CG1 3.2Å; F254-I258 PolarHBondContact O-N 2.92Å; F255-I258 WeakPolarHBondContact O-CB 3.43Å; F255-I258 PolarHBondContact O-N 3.36Å; F255-I258 VanDerWaalsContact O-N 3.13Å; I256-I258 VanDerWaalsContact C-N 3.31Å; I256-I258 PolarHBondContact O-N 3.06Å; I258-L260 VanDerWaalsContact C-N 3.32Å; I258-L260 PolarHBondContact O-N 2.8Å; I258-N261 PolarHBondContact O-N 2.95Å; I258-F262 HydrophobicContact CG2-CD2 4.07Å; I258-F262 HydrophobicContact CG2-CE2 3.8Å; I258-F262 VanDerWaalsContact O-CD2 3.24Å; I258-F262 WeakPolarHBondContact O-CD2 3.38Å; I258-F262 PolarHBondContact O-N 3.46Å; I258-Y284 HydrophobicContact CG2-CE1 4.35Å; I258-F289 HydrophobicContact CG2-CD2 4.25Å; I258-F289 HydrophobicContact CG2-CE2 4.1Å; I258-D292 HydrophobicContact CD1-CB 4.34Å; I258-D292 HydrophobicContact CG1-CB 4.13Å; I258-S296 WeakPolarHBondContact CD1-OG 3.35Å
259	V	94	Very high	90.6	Very high	68 Å²	68	45.3 Å²	45.3	41%	0.412	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-41.4	178.4	179.6	0	0	0	0	111.1	F255 I256 F262 H263	F255-V259 HydrophobicContact CE1-CG2 4.32Å; F255-V259 PolarHBondContact O-N 3.5Å; I256-V259 PolarHBondContact O-N 3.25Å; I256-V259 VanDerWaalsContact O-N 3.17Å; V259-F262 PolarHBondContact O-N 2.88Å; V259-H263 PolarHBondContact O-ND1 2.99Å
260	L	92.8	Very high	90	Very high	34 Å²	34	45 Å²	45	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-42.5	176.2	-74.3	172.9	0	0	0	111.8	W211 I256 D257 I258 F262 H263 T264	W211-L260 HydrophobicContact CD2-CD1 3.9Å; W211-L260 VanDerWaalsContact CE2-CD1 3.47Å; W211-L260 HydrophobicContact CG-CD1 4.26Å; W211-L260 HydrophobicContact CH2-CD1 4.42Å; W211-L260 HydrophobicContact CZ2-CD1 3.77Å; I256-L260 HydrophobicContact CG2-CD1 4.03Å; I256-L260 HydrophobicContact CG2-CG 4.31Å; I256-L260 WeakPolarHBondContact O-CG 3.38Å; I256-L260 PolarHBondContact O-N 3.37Å; D257-L260 PolarHBondContact O-N 3.34Å; I258-L260 VanDerWaalsContact C-N 3.32Å; I258-L260 PolarHBondContact O-N 2.8Å; L260-F262 VanDerWaalsContact C-N 3.27Å; L260-F262 PolarHBondContact O-N 3.4Å; L260-H263 CarbonylContact O-C 3.49Å; L260-H263 WeakPolarHBondContact O-CA 3.17Å; L260-H263 PolarHBondContact O-N 2.97Å; L260-T264 WeakPolarHBondContact O-CG2 3.28Å; L260-T264 PolarHBondContact O-N 3.04Å
261	N	91.8	Very high	89.3	Confident	15 Å²	15	45.5 Å²	45.5	8%	0.08	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-33.6	179.2	-72.4	-36.5	0	0	0	112.5	D257 I258 H263 T264 Y284	D257-N261 WeakPolarHBondContact O-CB 3.31Å; D257-N261 PolarHBondContact O-N 3.13Å; D257-N261 PolarHBondContact O-ND2 3.29Å; D257-N261 PolarHBondContact OD2-ND2 2.88Å; D257-N261 VanDerWaalsContact OD2-ND2 3.14Å; I258-N261 PolarHBondContact O-N 2.95Å; N261-H263 PolarHBondContact O-N 3.22Å; N261-T264 WeakPolarHBondContact CA-OG1 3.36Å; N261-T264 PolarHBondContact O-N 2.94Å; N261-T264 PolarHBondContact O-OG1 3.29Å; N261-T264 VanDerWaalsContact O-OG1 3.09Å; N261-Y284 HydrophobicContact CB-CD1 4.48Å; N261-Y284 HydrophobicContact CB-CD2 4.38Å; N261-Y284 HydrophobicContact CB-CE1 3.95Å; N261-Y284 HydrophobicContact CB-CE2 3.86Å
262	F	94	Very high	88.8	Confident	40 Å²	40	46.9 Å²	46.9	18%	0.175	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.9	171.4	-84	-67.7	0	0	0	114.5	I258 V259 L260 I280 R281 Y284 L285 F289	I258-F262 HydrophobicContact CG2-CD2 4.07Å; I258-F262 HydrophobicContact CG2-CE2 3.8Å; I258-F262 VanDerWaalsContact O-CD2 3.24Å; I258-F262 WeakPolarHBondContact O-CD2 3.38Å; I258-F262 PolarHBondContact O-N 3.46Å; V259-F262 PolarHBondContact O-N 2.88Å; L260-F262 VanDerWaalsContact C-N 3.27Å; L260-F262 PolarHBondContact O-N 3.4Å; F262-I280 WeakPolarHBondContact O-CG2 3.23Å; F262-R281 HydrophobicContact CD1-CB 4.18Å; F262-R281 HydrophobicContact CD1-CG 3.88Å; F262-Y284 AromaticContact CD1-CD1 3.73Å; F262-Y284 HydrophobicContact CD1-CD1 3.73Å; F262-Y284 HydrophobicContact CD1-CE1 4.44Å; F262-Y284 HydrophobicContact CD2-CD1 4.04Å; F262-Y284 AromaticContact CD2-CE1 3.93Å; F262-Y284 HydrophobicContact CD2-CE1 3.93Å; F262-Y284 AromaticContact CE1-CD1 3.68Å; F262-Y284 HydrophobicContact CE1-CD1 3.68Å; F262-Y284 HydrophobicContact CE1-CE1 4.37Å; F262-Y284 AromaticContact CE2-CD1 3.95Å; F262-Y284 HydrophobicContact CE2-CD1 3.95Å; F262-Y284 AromaticContact CE2-CE1 3.8Å; F262-Y284 HydrophobicContact CE2-CE1 3.8Å; F262-Y284 AromaticContact CG-CD1 3.93Å; F262-Y284 HydrophobicContact CG-CD1 3.93Å; F262-Y284 HydrophobicContact CG-CE1 4.26Å; F262-Y284 AromaticContact CZ-CD1 3.79Å; F262-Y284 HydrophobicContact CZ-CD1 3.79Å; F262-Y284 HydrophobicContact CZ-CE1 4.04Å; F262-L285 HydrophobicContact CE1-CD2 3.91Å; F262-L285 HydrophobicContact CE1-CG 3.92Å; F262-L285 HydrophobicContact CZ-CD2 3.84Å; F262-L285 HydrophobicContact CZ-CG 4.36Å; F262-F289 AromaticContact CE2-CD2 3.62Å; F262-F289 HydrophobicContact CE2-CD2 3.62Å; F262-F289 AromaticContact CE2-CE2 3.58Å; F262-F289 HydrophobicContact CE2-CE2 3.58Å; F262-F289 AromaticContact CZ-CD2 3.45Å; F262-F289 HydrophobicContact CZ-CD2 3.45Å; F262-F289 VanDerWaalsContact CZ-CD2 3.45Å; F262-F289 AromaticContact CZ-CE2 3.57Å; F262-F289 HydrophobicContact CZ-CE2 3.57Å; F262-F289 HydrophobicContact CZ-CG 4.09Å; F262-F289 HydrophobicContact CZ-CZ 4.29Å
263	H	93.8	Very high	88.5	Confident	52 Å²	52	43.7 Å²	43.7	24%	0.241	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	0.9	-178.1	-68.3	92	0	0	0	112.6	H199 V200 V201 V259 L260 N261	H199-H263 WeakPolarHBondContact O-CB 3.16Å; H199-H263 PolarHBondContact O-CD2 3.26Å; V200-H263 CarbonylContact C-O 3.58Å; V200-H263 VanDerWaalsContact CA-O 3.28Å; V200-H263 WeakPolarHBondContact CA-O 3.35Å; V201-H263 PolarHBondContact N-O 3Å; V259-H263 PolarHBondContact O-ND1 2.99Å; L260-H263 CarbonylContact O-C 3.49Å; L260-H263 WeakPolarHBondContact O-CA 3.17Å; L260-H263 PolarHBondContact O-N 2.97Å; N261-H263 PolarHBondContact O-N 3.22Å
264	T	92.2	Very high	88.1	Confident	17 Å²	17	43.5 Å²	43.5	10%	0.104	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-95.3	133.1	-178.7	56.1	0	0	0	0	112.5	V201 K208 L260 N261 I280	V201-T264 HydrophobicContact CB-CG2 4.17Å; V201-T264 CarbonylContact O-C 3.53Å; V201-T264 VanDerWaalsContact O-CA 3.27Å; V201-T264 WeakPolarHBondContact O-CA 3.39Å; K208-T264 HydrophobicContact CD-CG2 3.92Å; L260-T264 WeakPolarHBondContact O-CG2 3.28Å; L260-T264 PolarHBondContact O-N 3.04Å; N261-T264 WeakPolarHBondContact CA-OG1 3.36Å; N261-T264 PolarHBondContact O-N 2.94Å; N261-T264 PolarHBondContact O-OG1 3.29Å; N261-T264 VanDerWaalsContact O-OG1 3.09Å; T264-I280 WeakPolarHBondContact O-CG2 3.47Å
265	T	91.4	Very high	87.8	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.031	27%	0.272	C	S	.	.			trans	-58.5	155.5	173.7	61.4	0	0	0	0	111.5	T196 V200 V201 H203 V273 I274	T196-T265 HydrophobicContact CG2-CG2 4.23Å; V200-T265 HydrophobicContact CG1-CG2 3.53Å; V201-T265 PolarHBondContact O-N 3.1Å; H203-T265 WeakPolarHBondContact CB-O 3.42Å; H203-T265 PolarHBondContact N-OG1 2.7Å; H203-T265 PolarHBondContact ND1-OG1 3.19Å; T265-V273 HydrophobicContact CG2-CG1 4.23Å; T265-I274 WeakPolarHBondContact CB-O 3.04Å
266	F	88.3	Confident	87.6	Confident	47 Å²	47	43.6 Å²	43.6	21%	0.206	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	162.4	168.8	72.8	-81.8	0	0	0	111.1	I274 L279 I280 N283	F266-I274 HydrophobicContact CD1-CB 4.26Å; F266-I274 HydrophobicContact CD1-CG2 4.38Å; F266-I274 HydrophobicContact CD2-CD1 4.29Å; F266-I274 HydrophobicContact CE1-CB 3.88Å; F266-I274 HydrophobicContact CE1-CD1 4.1Å; F266-I274 HydrophobicContact CE1-CG2 3.67Å; F266-I274 HydrophobicContact CE2-CD1 3.46Å; F266-I274 VanDerWaalsContact CE2-CD1 3.46Å; F266-I274 HydrophobicContact CZ-CB 4.04Å; F266-I274 HydrophobicContact CZ-CD1 3.34Å; F266-I274 HydrophobicContact CZ-CG1 4.27Å; F266-I274 HydrophobicContact CZ-CG2 4Å; F266-I274 PolarHBondContact O-N 2.92Å; F266-L279 HydrophobicContact CE1-CG 4.47Å; F266-L279 HydrophobicContact CZ-CG 4.34Å; F266-I280 HydrophobicContact CD1-CG1 4.03Å; F266-I280 HydrophobicContact CE1-CG1 4.19Å; F266-N283 HydrophobicContact CD1-CB 4.48Å; F266-N283 HydrophobicContact CE1-CB 3.86Å; F266-N283 HydrophobicContact CE2-CB 4.48Å; F266-N283 HydrophobicContact CZ-CB 3.85Å
267	V	86.4	Confident	87.5	Confident	53 Å²	53	42 Å²	42	32%	0.321	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	120.7	177.2	-176.1	0	0	0	0	108.3	H203	H203-V267 VanDerWaalsContact CE1-CG2 3.5Å; H203-V267 WeakPolarHBondContact CE1-CG2 3.33Å; H203-V267 WeakPolarHBondContact NE2-CG2 3.29Å
268	G	81.4	Confident	87.5	Confident	15 Å²	15	46 Å²	46	16%	0.155	29%	0.286	C	S	.	.			trans	-71.8	171.2	176.7	0	0	0	0	0	112.4	S270 G271 A272	G268-S270 PolarHBondContact O-N 3.02Å; G268-G271 PolarHBondContact O-N 3.14Å; G268-A272 PolarHBondContact N-O 3.38Å
269	S	81.6	Confident	87.4	Confident	140 Å²	140	49.3 Å²	49.3	98%	0.979	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-26.1	175.4	50.5	0	0	0	0	113.5	G271	S269-G271 PolarHBondContact O-N 3.1Å
270	S	77.2	Confident	87.3	Confident	89 Å²	89	46.2 Å²	46.2	62%	0.622	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-4.7	173.6	59.1	0	0	0	0	114.1	G268 A272	G268-S270 PolarHBondContact O-N 3.02Å; S270-A272 PolarHBondContact O-N 3.5Å; S270-A272 PolarHBondContact OG-N 3.11Å
271	G	73.7	Confident	87.4	Confident	20 Å²	20	49.7 Å²	49.7	21%	0.206	30%	0.295	C	S	.	.	S	Bend	trans	77.4	-2.9	-172.3	0	0	0	0	0	114.1	G7 L8 G268 S269	G7-G271 CarbonylContact C-O 3.55Å; G7-G271 WeakPolarHBondContact CA-O 3.5Å; L8-G271 PolarHBondContact N-O 3.19Å; G268-G271 PolarHBondContact O-N 3.14Å; S269-G271 PolarHBondContact O-N 3.1Å
272	A	78.6	Confident	87.5	Confident	41 Å²	41	54 Å²	54	34%	0.339	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-71.8	142.6	174	0	0	0	0	0	111	G268 S270	G268-A272 PolarHBondContact N-O 3.38Å; S270-A272 PolarHBondContact O-N 3.5Å; S270-A272 PolarHBondContact OG-N 3.11Å
273	V	84.4	Confident	87.4	Confident	35 Å²	35	55.8 Å²	55.8	21%	0.212	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	119	173.9	180	0	0	0	0	108.9	R6 V9 T265	R6-V273 WeakPolarHBondContact O-CG2 3.35Å; V9-V273 HydrophobicContact CG2-CB 4.14Å; V9-V273 HydrophobicContact CG2-CG2 3.27Å; T265-V273 HydrophobicContact CG2-CG1 4.23Å
274	I	85.6	Confident	87.4	Confident	38 Å²	38	54.2 Å²	54.2	20%	0.195	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	117.5	179.2	-66.1	165.7	0	0	0	108.2	T265 F266 L279	T265-I274 WeakPolarHBondContact CB-O 3.04Å; F266-I274 HydrophobicContact CD1-CB 4.26Å; F266-I274 HydrophobicContact CD1-CG2 4.38Å; F266-I274 HydrophobicContact CD2-CD1 4.29Å; F266-I274 HydrophobicContact CE1-CB 3.88Å; F266-I274 HydrophobicContact CE1-CD1 4.1Å; F266-I274 HydrophobicContact CE1-CG2 3.67Å; F266-I274 HydrophobicContact CE2-CD1 3.46Å; F266-I274 VanDerWaalsContact CE2-CD1 3.46Å; F266-I274 HydrophobicContact CZ-CB 4.04Å; F266-I274 HydrophobicContact CZ-CD1 3.34Å; F266-I274 HydrophobicContact CZ-CG1 4.27Å; F266-I274 HydrophobicContact CZ-CG2 4Å; F266-I274 PolarHBondContact O-N 2.92Å; I274-L279 HydrophobicContact CD1-CD2 4.18Å; I274-L279 HydrophobicContact CG2-CB 4.09Å; I274-L279 HydrophobicContact CG2-CD2 3.56Å; I274-L279 HydrophobicContact CG2-CG 3.88Å
275	S	85.4	Confident	87.5	Confident	42 Å²	42	57 Å²	57	29%	0.294	34%	0.335	S	S	.	.			trans	-108.9	-7.1	-178.1	57.5	0	0	0	0	114.2	P197 P277	P197-S275 WeakPolarHBondContact CD-O 3.41Å; P197-S275 WeakPolarHBondContact CG-O 3.41Å; S275-P277 WeakPolarHBondContact O-CD 3.42Å
276	D	87.8	Confident	87.5	Confident	81 Å²	81	65.8 Å²	65.8	43%	0.433	37%	0.373	S	S	.	.			trans	-68.1	118.2	178.5	-179.5	-5.4	0	0	0	110.8	V278 L279 I280	D276-V278 VanDerWaalsContact C-N 3.27Å; D276-V278 PolarHBondContact O-N 3.1Å; D276-V278 PolarHBondContact OD1-N 2.8Å; D276-L279 HydrophobicContact CB-CB 4.12Å; D276-L279 PolarHBondContact O-N 3.44Å; D276-I280 VanDerWaalsContact O-CG1 3.26Å; D276-I280 WeakPolarHBondContact O-CG1 3.2Å; D276-I280 PolarHBondContact O-N 2.96Å
277	P	91.3	Very high	87.4	Confident	39 Å²	39	65.5 Å²	65.5	25%	0.253	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-32.4	-177.4	25.1	-35.4	0	0	0	113.1	V200 S275 R281	V200-P277 HydrophobicContact CG2-CB 4.31Å; S275-P277 WeakPolarHBondContact O-CD 3.42Å; P277-R281 WeakPolarHBondContact O-CB 3.36Å; P277-R281 VanDerWaalsContact O-CD 3.27Å; P277-R281 WeakPolarHBondContact O-CD 2.99Å; P277-R281 WeakPolarHBondContact O-CG 3.45Å; P277-R281 PolarHBondContact O-N 3.32Å
278	V	92.1	Very high	87.5	Confident	87 Å²	87	68.1 Å²	68.1	53%	0.527	39%	0.387	S	S	.	.	H	α-helix	trans	-67.2	-46.1	179.6	179.8	0	0	0	0	109.7	D276 R281 L282	D276-V278 VanDerWaalsContact C-N 3.27Å; D276-V278 PolarHBondContact O-N 3.1Å; D276-V278 PolarHBondContact OD1-N 2.8Å; V278-R281 PolarHBondContact O-N 3.24Å; V278-L282 HydrophobicContact CG1-CD1 3.99Å; V278-L282 HydrophobicContact CG1-CG 4.49Å; V278-L282 WeakPolarHBondContact O-CG 3.33Å; V278-L282 PolarHBondContact O-N 2.93Å
279	L	91.8	Very high	88	Confident	77 Å²	77	69.4 Å²	69.4	40%	0.403	39%	0.388	S	S	.	.	H	α-helix	trans	-68.1	-38	-179.8	-171.3	54.7	0	0	0	112.1	F266 I274 D276 N283	F266-L279 HydrophobicContact CE1-CG 4.47Å; F266-L279 HydrophobicContact CZ-CG 4.34Å; I274-L279 HydrophobicContact CD1-CD2 4.18Å; I274-L279 HydrophobicContact CG2-CB 4.09Å; I274-L279 HydrophobicContact CG2-CD2 3.56Å; I274-L279 HydrophobicContact CG2-CG 3.88Å; D276-L279 HydrophobicContact CB-CB 4.12Å; D276-L279 PolarHBondContact O-N 3.44Å; L279-N283 VanDerWaalsContact O-CB 3.25Å; L279-N283 WeakPolarHBondContact O-CB 3.42Å; L279-N283 PolarHBondContact O-N 3Å
280	I	92.4	Very high	88.5	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.015	37%	0.367	C	S	.	.	H	α-helix	trans	-57.7	-51	172.9	-69.1	164.5	0	0	0	110.5	V200 F262 T264 F266 D276 N283 Y284	V200-I280 HydrophobicContact CG1-CD1 3.83Å; V200-I280 HydrophobicContact CG2-CD1 4.48Å; F262-I280 WeakPolarHBondContact O-CG2 3.23Å; T264-I280 WeakPolarHBondContact O-CG2 3.47Å; F266-I280 HydrophobicContact CD1-CG1 4.03Å; F266-I280 HydrophobicContact CE1-CG1 4.19Å; D276-I280 VanDerWaalsContact O-CG1 3.26Å; D276-I280 WeakPolarHBondContact O-CG1 3.2Å; D276-I280 PolarHBondContact O-N 2.96Å; I280-N283 PolarHBondContact O-N 3.15Å; I280-Y284 PolarHBondContact O-N 2.91Å
281	R	94.5	Very high	89.1	Confident	107 Å²	107	65.3 Å²	65.3	40%	0.404	35%	0.349	S	S	.	.	H	α-helix	trans	-64	-46.1	-177.7	-68.2	164.5	-177.6	-177.6	-0.5	111.7	F262 P277 V278 N283 Y284 L285	F262-R281 HydrophobicContact CD1-CB 4.18Å; F262-R281 HydrophobicContact CD1-CG 3.88Å; P277-R281 WeakPolarHBondContact O-CB 3.36Å; P277-R281 VanDerWaalsContact O-CD 3.27Å; P277-R281 WeakPolarHBondContact O-CD 2.99Å; P277-R281 WeakPolarHBondContact O-CG 3.45Å; P277-R281 PolarHBondContact O-N 3.32Å; V278-R281 PolarHBondContact O-N 3.24Å; R281-N283 VanDerWaalsContact C-N 3.33Å; R281-N283 PolarHBondContact O-N 2.96Å; R281-Y284 PolarHBondContact O-N 3.13Å; R281-L285 WeakPolarHBondContact O-CB 3.33Å; R281-L285 VanDerWaalsContact O-CG 3.27Å; R281-L285 WeakPolarHBondContact O-CG 3.11Å; R281-L285 PolarHBondContact O-N 2.89Å
282	L	93.8	Very high	89.9	Confident	105 Å²	105	64.3 Å²	64.3	55%	0.55	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-40.8	177.4	-72	173.8	0	0	0	112.1	V278 K286	V278-L282 HydrophobicContact CG1-CD1 3.99Å; V278-L282 HydrophobicContact CG1-CG 4.49Å; V278-L282 WeakPolarHBondContact O-CG 3.33Å; V278-L282 PolarHBondContact O-N 2.93Å; L282-K286 VanDerWaalsContact O-CB 3.31Å; L282-K286 WeakPolarHBondContact O-CB 3.3Å; L282-K286 PolarHBondContact O-N 3.05Å
283	N	91.8	Very high	90.4	Very high	78 Å²	78	65.5 Å²	65.5	42%	0.417	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-42.8	177.1	-175.6	63	0	0	0	111.8	F266 L279 I280 R281 G287	F266-N283 HydrophobicContact CD1-CB 4.48Å; F266-N283 HydrophobicContact CE1-CB 3.86Å; F266-N283 HydrophobicContact CE2-CB 4.48Å; F266-N283 HydrophobicContact CZ-CB 3.85Å; L279-N283 VanDerWaalsContact O-CB 3.25Å; L279-N283 WeakPolarHBondContact O-CB 3.42Å; L279-N283 PolarHBondContact O-N 3Å; I280-N283 PolarHBondContact O-N 3.15Å; R281-N283 VanDerWaalsContact C-N 3.33Å; R281-N283 PolarHBondContact O-N 2.96Å; N283-G287 PolarHBondContact O-N 2.84Å
284	Y	93.3	Very high	90.6	Very high	19 Å²	19	67 Å²	67	8%	0.075	35%	0.345	C	S	.	.	H	α-helix	trans	-68.5	-42	177.9	-174.3	-124.3	0	0	0	112.5	I258 N261 F262 I280 R281 K286 G287 W288 F289 D292	I258-Y284 HydrophobicContact CG2-CE1 4.35Å; N261-Y284 HydrophobicContact CB-CD1 4.48Å; N261-Y284 HydrophobicContact CB-CD2 4.38Å; N261-Y284 HydrophobicContact CB-CE1 3.95Å; N261-Y284 HydrophobicContact CB-CE2 3.86Å; F262-Y284 AromaticContact CD1-CD1 3.73Å; F262-Y284 HydrophobicContact CD1-CD1 3.73Å; F262-Y284 HydrophobicContact CD1-CE1 4.44Å; F262-Y284 HydrophobicContact CD2-CD1 4.04Å; F262-Y284 AromaticContact CD2-CE1 3.93Å; F262-Y284 HydrophobicContact CD2-CE1 3.93Å; F262-Y284 AromaticContact CE1-CD1 3.68Å; F262-Y284 HydrophobicContact CE1-CD1 3.68Å; F262-Y284 HydrophobicContact CE1-CE1 4.37Å; F262-Y284 AromaticContact CE2-CD1 3.95Å; F262-Y284 HydrophobicContact CE2-CD1 3.95Å; F262-Y284 AromaticContact CE2-CE1 3.8Å; F262-Y284 HydrophobicContact CE2-CE1 3.8Å; F262-Y284 AromaticContact CG-CD1 3.93Å; F262-Y284 HydrophobicContact CG-CD1 3.93Å; F262-Y284 HydrophobicContact CG-CE1 4.26Å; F262-Y284 AromaticContact CZ-CD1 3.79Å; F262-Y284 HydrophobicContact CZ-CD1 3.79Å; F262-Y284 HydrophobicContact CZ-CE1 4.04Å; I280-Y284 PolarHBondContact O-N 2.91Å; R281-Y284 PolarHBondContact O-N 3.13Å; Y284-K286 PolarHBondContact O-N 2.98Å; Y284-G287 CarbonylContact O-C 3.6Å; Y284-G287 PolarHBondContact O-N 3.42Å; Y284-W288 HydrophobicContact CD2-CB 4.37Å; Y284-W288 HydrophobicContact CE2-CB 4.05Å; Y284-W288 PolarHBondContact O-N 2.98Å; Y284-F289 HydrophobicContact CD1-CB 4.03Å; Y284-F289 HydrophobicContact CD1-CD2 4.32Å; Y284-F289 HydrophobicContact CE1-CB 4.01Å; Y284-F289 AromaticContact CE1-CD2 3.84Å; Y284-F289 HydrophobicContact CE1-CD2 3.84Å; Y284-F289 HydrophobicContact CE1-CG 4.4Å; Y284-F289 HydrophobicContact CG-CB 4.4Å; Y284-F289 VanDerWaalsContact O-CB 3.26Å; Y284-F289 WeakPolarHBondContact O-CB 3.44Å; Y284-F289 PolarHBondContact O-N 2.96Å; Y284-F289 VanDerWaalsContact O-N 3.09Å; Y284-D292 WeakPolarHBondContact OH-CB 3.4Å; Y284-D292 PolarHBondContact OH-OD2 3.11Å
285	L	94.1	Very high	90.8	Very high	75 Å²	75	65.2 Å²	65.2	39%	0.393	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-40.8	175.8	-74.8	171.9	0	0	0	112.7	F262 R281 G287 F289	F262-L285 HydrophobicContact CE1-CD2 3.91Å; F262-L285 HydrophobicContact CE1-CG 3.92Å; F262-L285 HydrophobicContact CZ-CD2 3.84Å; F262-L285 HydrophobicContact CZ-CG 4.36Å; R281-L285 WeakPolarHBondContact O-CB 3.33Å; R281-L285 VanDerWaalsContact O-CG 3.27Å; R281-L285 WeakPolarHBondContact O-CG 3.11Å; R281-L285 PolarHBondContact O-N 2.89Å; L285-G287 VanDerWaalsContact C-N 3.27Å; L285-G287 PolarHBondContact O-N 3.36Å; L285-F289 HydrophobicContact CD2-CB 4.32Å; L285-F289 HydrophobicContact CD2-CD1 3.44Å; L285-F289 VanDerWaalsContact CD2-CD1 3.44Å; L285-F289 HydrophobicContact CD2-CD2 4.43Å; L285-F289 HydrophobicContact CD2-CE1 3.77Å; L285-F289 HydrophobicContact CD2-CG 3.8Å; L285-F289 HydrophobicContact CD2-CZ 4.39Å
286	K	91.8	Very high	90.8	Very high	191 Å²	191	63.7 Å²	63.7	83%	0.83	33%	0.326	S	S	*	.	H	α-helix	trans	-69.4	-25.2	179.5	-174.6	174.7	179.6	179.2	0	113	L282 Y284	L282-K286 VanDerWaalsContact O-CB 3.31Å; L282-K286 WeakPolarHBondContact O-CB 3.3Å; L282-K286 PolarHBondContact O-N 3.05Å; Y284-K286 PolarHBondContact O-N 2.98Å
287	G	86.7	Confident	90.6	Very high	40 Å²	40	63.4 Å²	63.4	41%	0.412	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-101.7	-175.3	0	0	0	0	0	113	N283 Y284 L285	N283-G287 PolarHBondContact O-N 2.84Å; Y284-G287 CarbonylContact O-C 3.6Å; Y284-G287 PolarHBondContact O-N 3.42Å; L285-G287 VanDerWaalsContact C-N 3.27Å; L285-G287 PolarHBondContact O-N 3.36Å
288	W	88.4	Confident	90	Very high	108 Å²	108	64 Å²	64	41%	0.409	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.9	-162.5	-65.7	100.9	0	0	0	115.4	Y284 I290 V291 D292 C327 R331	Y284-W288 HydrophobicContact CD2-CB 4.37Å; Y284-W288 HydrophobicContact CE2-CB 4.05Å; Y284-W288 PolarHBondContact O-N 2.98Å; W288-I290 VanDerWaalsContact C-N 3.31Å; W288-I290 PolarHBondContact O-N 3.36Å; W288-V291 PolarHBondContact O-N 3.05Å; W288-D292 WeakPolarHBondContact O-CB 3.48Å; W288-D292 PolarHBondContact O-N 3.17Å; W288-C327 HydrophobicContact CZ3-CB 3.92Å; W288-R331 HydrophobicContact CD2-CG 3.89Å; W288-R331 HydrophobicContact CE3-CG 4.29Å; W288-R331 HydrophobicContact CG-CG 4.38Å; W288-R331 HydrophobicContact CH2-CG 4.21Å; W288-R331 HydrophobicContact CZ2-CG 3.79Å; W288-R331 HydrophobicContact CZ3-CG 4.45Å
289	F	92.4	Very high	89.1	Confident	43 Å²	43	61.1 Å²	61.1	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-55.5	-43.7	-176.2	170.8	-109.3	0	0	0	113.1	I258 F262 Y284 L285 V291 D292 L293	I258-F289 HydrophobicContact CG2-CD2 4.25Å; I258-F289 HydrophobicContact CG2-CE2 4.1Å; F262-F289 AromaticContact CE2-CD2 3.62Å; F262-F289 HydrophobicContact CE2-CD2 3.62Å; F262-F289 AromaticContact CE2-CE2 3.58Å; F262-F289 HydrophobicContact CE2-CE2 3.58Å; F262-F289 AromaticContact CZ-CD2 3.45Å; F262-F289 HydrophobicContact CZ-CD2 3.45Å; F262-F289 VanDerWaalsContact CZ-CD2 3.45Å; F262-F289 AromaticContact CZ-CE2 3.57Å; F262-F289 HydrophobicContact CZ-CE2 3.57Å; F262-F289 HydrophobicContact CZ-CG 4.09Å; F262-F289 HydrophobicContact CZ-CZ 4.29Å; Y284-F289 HydrophobicContact CD1-CB 4.03Å; Y284-F289 HydrophobicContact CD1-CD2 4.32Å; Y284-F289 HydrophobicContact CE1-CB 4.01Å; Y284-F289 AromaticContact CE1-CD2 3.84Å; Y284-F289 HydrophobicContact CE1-CD2 3.84Å; Y284-F289 HydrophobicContact CE1-CG 4.4Å; Y284-F289 HydrophobicContact CG-CB 4.4Å; Y284-F289 VanDerWaalsContact O-CB 3.26Å; Y284-F289 WeakPolarHBondContact O-CB 3.44Å; Y284-F289 PolarHBondContact O-N 2.96Å; Y284-F289 VanDerWaalsContact O-N 3.09Å; L285-F289 HydrophobicContact CD2-CB 4.32Å; L285-F289 HydrophobicContact CD2-CD1 3.44Å; L285-F289 VanDerWaalsContact CD2-CD1 3.44Å; L285-F289 HydrophobicContact CD2-CD2 4.43Å; L285-F289 HydrophobicContact CD2-CE1 3.77Å; L285-F289 HydrophobicContact CD2-CG 3.8Å; L285-F289 HydrophobicContact CD2-CZ 4.39Å; F289-V291 VanDerWaalsContact C-N 3.35Å; F289-V291 PolarHBondContact O-N 2.97Å; F289-D292 PolarHBondContact O-N 2.87Å; F289-L293 HydrophobicContact CE1-CD2 4.07Å; F289-L293 HydrophobicContact CE2-CB 4.41Å; F289-L293 HydrophobicContact CZ-CB 4.36Å; F289-L293 HydrophobicContact CZ-CD1 4.47Å; F289-L293 HydrophobicContact CZ-CD2 3.93Å; F289-L293 HydrophobicContact CZ-CG 4.49Å; F289-L293 VanDerWaalsContact O-CB 3.31Å; F289-L293 WeakPolarHBondContact O-CB 3.12Å; F289-L293 PolarHBondContact O-N 2.64Å
290	I	90.7	Very high	87.9	Confident	102 Å²	102	58.4 Å²	58.4	52%	0.523	30%	0.298	S	S	.	.	H	α-helix	trans	-62.6	-43.9	-176.9	-61.4	173.1	0	0	0	110.8	W288 L293 I294	W288-I290 VanDerWaalsContact C-N 3.31Å; W288-I290 PolarHBondContact O-N 3.36Å; I290-L293 PolarHBondContact O-N 3.23Å; I290-I294 HydrophobicContact CG2-CD1 3.93Å; I290-I294 WeakPolarHBondContact O-CG1 3.36Å; I290-I294 PolarHBondContact O-N 2.92Å; I290-I294 VanDerWaalsContact O-N 3.09Å
291	V	89.7	Confident	86.9	Confident	40 Å²	40	61.5 Å²	61.5	24%	0.242	31%	0.314	C	S	.	.	H	α-helix	trans	-64.1	-45.9	177.5	-178.7	0	0	0	0	110.3	W288 F289 L293 S295 L324 C327	W288-V291 PolarHBondContact O-N 3.05Å; F289-V291 VanDerWaalsContact C-N 3.35Å; F289-V291 PolarHBondContact O-N 2.97Å; V291-L293 VanDerWaalsContact C-N 3.34Å; V291-L293 PolarHBondContact O-N 2.95Å; V291-S295 VanDerWaalsContact O-CB 3.28Å; V291-S295 WeakPolarHBondContact O-CB 3.42Å; V291-S295 PolarHBondContact O-N 3.39Å; V291-S295 PolarHBondContact O-OG 3.34Å; V291-L324 HydrophobicContact CG1-CB 4.22Å; V291-C327 HydrophobicContact CG1-CB 3.87Å
292	D	90.6	Very high	85.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-41.3	179.9	-78.3	-8.8	0	0	0	111.4	I258 Y284 W288 F289 S295 S296 R328 R331	I258-D292 HydrophobicContact CD1-CB 4.34Å; I258-D292 HydrophobicContact CG1-CB 4.13Å; Y284-D292 WeakPolarHBondContact OH-CB 3.4Å; Y284-D292 PolarHBondContact OH-OD2 3.11Å; W288-D292 WeakPolarHBondContact O-CB 3.48Å; W288-D292 PolarHBondContact O-N 3.17Å; F289-D292 PolarHBondContact O-N 2.87Å; D292-S295 PolarHBondContact O-N 2.84Å; D292-S295 PolarHBondContact O-OG 2.87Å; D292-S296 PolarHBondContact O-N 2.91Å; D292-S296 PolarHBondContact O-OG 3.44Å; D292-R328 PolarHBondContact O-NH2 2.07Å; D292-R328 WeakPolarHBondContact OD1-CG 3.27Å; D292-R328 IonicContact OD1-CZ 3.85Å; D292-R328 IonicContact OD1-NE 3.36Å; D292-R328 PolarHBondContact OD1-NE 2.75Å; D292-R328 VanDerWaalsContact OD1-NE 3.16Å; D292-R328 IonicContact OD1-NH1 3.73Å; D292-R328 IonicContact OD1-NH2 3.97Å; D292-R328 PolarHBondContact OD1-NH2 2.88Å; D292-R328 IonicContact OD2-CZ 3.86Å; D292-R328 IonicContact OD2-NH1 3.48Å; D292-R331 IonicContact OD1-NH1 3.97Å; D292-R331 IonicContact OD1-NH2 3.96Å; D292-R331 IonicContact OD2-CZ 3.76Å; D292-R331 IonicContact OD2-NH1 2.68Å; D292-R331 PolarHBondContact OD2-NH1 3.5Å; D292-R331 IonicContact OD2-NH2 3.69Å; D292-R331 PolarHBondContact OD2-NH2 3.43Å
293	L	90.7	Very high	84.3	Confident	66 Å²	66	57.4 Å²	57.4	35%	0.346	30%	0.304	S	S	.	.	H	α-helix	trans	-62.6	-55.1	177.9	-178.6	64.6	0	0	0	111.4	F289 I290 V291 S295 S296 L297	F289-L293 HydrophobicContact CE1-CD2 4.07Å; F289-L293 HydrophobicContact CE2-CB 4.41Å; F289-L293 HydrophobicContact CZ-CB 4.36Å; F289-L293 HydrophobicContact CZ-CD1 4.47Å; F289-L293 HydrophobicContact CZ-CD2 3.93Å; F289-L293 HydrophobicContact CZ-CG 4.49Å; F289-L293 VanDerWaalsContact O-CB 3.31Å; F289-L293 WeakPolarHBondContact O-CB 3.12Å; F289-L293 PolarHBondContact O-N 2.64Å; I290-L293 PolarHBondContact O-N 3.23Å; V291-L293 VanDerWaalsContact C-N 3.34Å; V291-L293 PolarHBondContact O-N 2.95Å; L293-S295 PolarHBondContact O-N 3.05Å; L293-S296 PolarHBondContact O-N 3.45Å; L293-S296 PolarHBondContact O-OG 3.27Å; L293-L297 PolarHBondContact O-N 2.98Å
294	I	88.5	Confident	83.3	Confident	66 Å²	66	58 Å²	58	34%	0.338	31%	0.311	S	S	.	.	H	α-helix	trans	-57.3	-40.2	179.9	-65.8	168.1	0	0	0	110.6	I290 S296 L297 A321 L324	I290-I294 HydrophobicContact CG2-CD1 3.93Å; I290-I294 WeakPolarHBondContact O-CG1 3.36Å; I290-I294 PolarHBondContact O-N 2.92Å; I290-I294 VanDerWaalsContact O-N 3.09Å; I294-S296 PolarHBondContact O-N 3.13Å; I294-L297 PolarHBondContact O-N 3.35Å; I294-A321 HydrophobicContact CG2-CB 4.31Å; I294-L324 HydrophobicContact CB-CD1 4.46Å; I294-L324 HydrophobicContact CG2-CD1 3.85Å
295	S	88.2	Confident	82.3	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-68.2	-17	179.9	80.6	0	0	0	0	114.6	V291 D292 L293 R325 R328	V291-S295 VanDerWaalsContact O-CB 3.28Å; V291-S295 WeakPolarHBondContact O-CB 3.42Å; V291-S295 PolarHBondContact O-N 3.39Å; V291-S295 PolarHBondContact O-OG 3.34Å; D292-S295 PolarHBondContact O-N 2.84Å; D292-S295 PolarHBondContact O-OG 2.87Å; L293-S295 PolarHBondContact O-N 3.05Å; S295-R325 PolarHBondContact O-NE 3.19Å; S295-R325 PolarHBondContact O-NH2 3.17Å; S295-R328 PolarHBondContact OG-NH2 2.79Å
296	S	85.9	Confident	81	Confident	11 Å²	11	62.5 Å²	62.5	8%	0.077	33%	0.33	C	S	.	.	H	α-helix	trans	-102.5	-6.5	-175.7	68	0	0	0	0	114.2	I258 D292 L293 I294	I258-S296 WeakPolarHBondContact CD1-OG 3.35Å; D292-S296 PolarHBondContact O-N 2.91Å; D292-S296 PolarHBondContact O-OG 3.44Å; L293-S296 PolarHBondContact O-N 3.45Å; L293-S296 PolarHBondContact O-OG 3.27Å; I294-S296 PolarHBondContact O-N 3.13Å
297	L	83	Confident	79.9	Confident	74 Å²	74	61.2 Å²	61.2	39%	0.387	33%	0.332	S	S	.	.			trans	-69.4	130.8	-177.7	-69.9	174.1	0	0	0	111.5	L293 I294 F299	L293-L297 PolarHBondContact O-N 2.98Å; I294-L297 PolarHBondContact O-N 3.35Å; L297-F299 VanDerWaalsContact C-N 3.28Å; L297-F299 HydrophobicContact CB-CD2 4.28Å; L297-F299 HydrophobicContact CB-CE1 4.04Å; L297-F299 HydrophobicContact CB-CE2 3.77Å; L297-F299 HydrophobicContact CB-CZ 3.64Å; L297-F299 HydrophobicContact CD1-CE1 4.1Å; L297-F299 HydrophobicContact CD1-CZ 3.85Å; L297-F299 HydrophobicContact CG-CZ 4.37Å; L297-F299 VanDerWaalsContact O-CD2 3.29Å; L297-F299 WeakPolarHBondContact O-CD2 3.26Å; L297-F299 PolarHBondContact O-N 2.85Å
298	P	79.2	Confident	79.3	Confident	52 Å²	52	65.3 Å²	65.3	34%	0.338	34%	0.341	S	S	.	.			trans	-81.7	71.5	179.5	34	-36.1	0	0	0	110.8	G300 I301	P298-G300 PolarHBondContact O-N 3.03Å; P298-I301 HydrophobicContact CB-CD1 3.73Å; P298-I301 HydrophobicContact CB-CG1 4.12Å; P298-I301 HydrophobicContact CG-CD1 3.71Å; P298-I301 HydrophobicContact CG-CG1 4.46Å; P298-I301 PolarHBondContact O-N 2.77Å; P298-I301 VanDerWaalsContact O-N 3.08Å
299	F	73.8	Confident	78.5	Confident	26 Å²	26	65.3 Å²	65.3	11%	0.114	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.2	-178.5	-61.9	-73	0	0	0	113.9	L297 I301 L302 L318 A321	L297-F299 VanDerWaalsContact C-N 3.28Å; L297-F299 HydrophobicContact CB-CD2 4.28Å; L297-F299 HydrophobicContact CB-CE1 4.04Å; L297-F299 HydrophobicContact CB-CE2 3.77Å; L297-F299 HydrophobicContact CB-CZ 3.64Å; L297-F299 HydrophobicContact CD1-CE1 4.1Å; L297-F299 HydrophobicContact CD1-CZ 3.85Å; L297-F299 HydrophobicContact CG-CZ 4.37Å; L297-F299 VanDerWaalsContact O-CD2 3.29Å; L297-F299 WeakPolarHBondContact O-CD2 3.26Å; L297-F299 PolarHBondContact O-N 2.85Å; F299-I301 PolarHBondContact O-N 2.99Å; F299-L302 HydrophobicContact CD1-CD1 4.14Å; F299-L302 WeakPolarHBondContact O-CB 3.15Å; F299-L302 PolarHBondContact O-N 3.41Å; F299-L302 VanDerWaalsContact O-N 3.15Å; F299-L318 HydrophobicContact CB-CB 4.02Å; F299-L318 HydrophobicContact CD1-CB 4.07Å; F299-L318 HydrophobicContact CD1-CD1 4.28Å; F299-L318 HydrophobicContact CD2-CB 4.38Å; F299-L318 WeakPolarHBondContact CD2-O 3.17Å; F299-L318 HydrophobicContact CG-CB 3.91Å; F299-A321 HydrophobicContact CD2-CB 4.47Å; F299-A321 HydrophobicContact CE2-CB 3.71Å; F299-A321 HydrophobicContact CZ-CB 4.25Å
300	G	67.1	Low	77.6	Confident	20 Å²	20	68 Å²	68	21%	0.206	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.6	176.6	0	0	0	0	0	114	P298 L302 A303	P298-G300 PolarHBondContact O-N 3.03Å; G300-L302 PolarHBondContact O-N 3.49Å; G300-A303 VanDerWaalsContact O-CB 3.27Å; G300-A303 WeakPolarHBondContact O-CB 3.27Å; G300-A303 PolarHBondContact O-N 2.8Å; G300-A303 VanDerWaalsContact O-N 3.15Å
301	I	70.1	Confident	76.8	Confident	68 Å²	68	67.1 Å²	67.1	35%	0.349	37%	0.368	S	S	.	.	H	α-helix	trans	-66.8	-30	177.6	-63.1	176.7	0	0	0	110.9	P298 F299 A303 V304 F305	P298-I301 HydrophobicContact CB-CD1 3.73Å; P298-I301 HydrophobicContact CB-CG1 4.12Å; P298-I301 HydrophobicContact CG-CD1 3.71Å; P298-I301 HydrophobicContact CG-CG1 4.46Å; P298-I301 PolarHBondContact O-N 2.77Å; P298-I301 VanDerWaalsContact O-N 3.08Å; F299-I301 PolarHBondContact O-N 2.99Å; I301-A303 PolarHBondContact O-N 3.25Å; I301-V304 PolarHBondContact O-N 2.93Å; I301-F305 HydrophobicContact CG2-CD2 3.69Å; I301-F305 HydrophobicContact CG2-CE2 3.33Å; I301-F305 HydrophobicContact CG2-CZ 4.49Å; I301-F305 VanDerWaalsContact O-CD2 3.25Å; I301-F305 WeakPolarHBondContact O-CD2 3.25Å; I301-F305 PolarHBondContact O-N 3.39Å
302	L	69.4	Low	75.9	Confident	99 Å²	99	67.7 Å²	67.7	52%	0.518	37%	0.372	S	S	.	.	H	α-helix	trans	-64.3	-26.4	176.5	-61.5	171.2	0	0	0	112.3	F299 G300 S306	F299-L302 HydrophobicContact CD1-CD1 4.14Å; F299-L302 WeakPolarHBondContact O-CB 3.15Å; F299-L302 PolarHBondContact O-N 3.41Å; F299-L302 VanDerWaalsContact O-N 3.15Å; G300-L302 PolarHBondContact O-N 3.49Å; L302-S306 WeakPolarHBondContact O-CB 3.36Å
303	A	65.4	Low	74.9	Confident	27 Å²	27	72.3 Å²	72.3	22%	0.223	40%	0.397	C	S	.	.	H	α-helix	trans	-68.9	-39.3	175.8	0	0	0	0	0	111.7	G300 I301 F305 S306 S315	G300-A303 VanDerWaalsContact O-CB 3.27Å; G300-A303 WeakPolarHBondContact O-CB 3.27Å; G300-A303 PolarHBondContact O-N 2.8Å; G300-A303 VanDerWaalsContact O-N 3.15Å; I301-A303 PolarHBondContact O-N 3.25Å; A303-F305 VanDerWaalsContact C-N 3.29Å; A303-F305 PolarHBondContact O-N 2.97Å; A303-S306 PolarHBondContact O-N 3.23Å; A303-S315 VanDerWaalsContact CB-OG 3.27Å; A303-S315 WeakPolarHBondContact CB-OG 3.3Å
304	V	69.6	Low	74.3	Confident	91 Å²	91	73.2 Å²	73.2	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-67.6	-32.4	-177.6	-178.5	0	0	0	0	111.4	I301	I301-V304 PolarHBondContact O-N 2.93Å
305	F	71.9	Confident	73.6	Confident	169 Å²	169	70.2 Å²	70.2	74%	0.741	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.9	-178.5	-69.3	-62.5	0	0	0	114.7	I301 A303	I301-F305 HydrophobicContact CG2-CD2 3.69Å; I301-F305 HydrophobicContact CG2-CE2 3.33Å; I301-F305 HydrophobicContact CG2-CZ 4.49Å; I301-F305 VanDerWaalsContact O-CD2 3.25Å; I301-F305 WeakPolarHBondContact O-CD2 3.25Å; I301-F305 PolarHBondContact O-N 3.39Å; A303-F305 VanDerWaalsContact C-N 3.29Å; A303-F305 PolarHBondContact O-N 2.97Å
306	S	68.5	Low	72.8	Confident	20 Å²	20	72.2 Å²	72.2	14%	0.14	40%	0.4	C	S	.	.			trans	-121.7	112.9	-172.1	173.2	0	0	0	0	112.2	L302 A303 H308 L311 V312	L302-S306 WeakPolarHBondContact O-CB 3.36Å; A303-S306 PolarHBondContact O-N 3.23Å; S306-H308 PolarHBondContact O-N 3.45Å; S306-H308 PolarHBondContact OG-N 3.4Å; S306-L311 VanDerWaalsContact OG-CB 3.23Å; S306-L311 WeakPolarHBondContact OG-CB 3.49Å; S306-L311 VanDerWaalsContact OG-CD1 3.29Å; S306-L311 WeakPolarHBondContact OG-CD1 3.25Å; S306-V312 WeakPolarHBondContact O-CG2 3.41Å
307	D	67.8	Low	72.5	Confident	163 Å²	163	76.6 Å²	76.6	87%	0.872	42%	0.422	S	S	*	.			trans	-68.5	-17.1	172.2	-64.5	-21.6	0	0	0	113.1	T309	D307-T309 PolarHBondContact O-N 2.92Å
308	H	74.1	Confident	72.5	Confident	127 Å²	127	76.2 Å²	76.2	59%	0.588	42%	0.42	S	S	*	.			trans	-73.5	112.6	-179.9	-64.9	-54.8	0	0	0	111.5	S306 T310 L311 V312	S306-H308 PolarHBondContact O-N 3.45Å; S306-H308 PolarHBondContact OG-N 3.4Å; H308-T310 PolarHBondContact O-N 3.16Å; H308-T310 VanDerWaalsContact O-N 3.11Å; H308-L311 HydrophobicContact CB-CB 4.24Å; H308-L311 HydrophobicContact CB-CD1 4.12Å; H308-L311 HydrophobicContact CB-CG 4.14Å; H308-L311 WeakPolarHBondContact O-CB 3.47Å; H308-L311 PolarHBondContact O-N 3.27Å; H308-V312 PolarHBondContact O-N 2.75Å
309	T	71.5	Confident	72.6	Confident	107 Å²	107	75.3 Å²	75.3	66%	0.656	41%	0.41	S	S	*	.	H	α-helix	trans	-52.5	-33.1	177.2	56.2	0	0	0	0	113.5	D307 V312 N313	D307-T309 PolarHBondContact O-N 2.92Å; T309-V312 PolarHBondContact O-N 2.79Å; T309-N313 PolarHBondContact O-N 3.29Å
310	T	74.4	Confident	73.1	Confident	100 Å²	100	77.7 Å²	77.7	61%	0.613	42%	0.424	S	S	*	.	H	α-helix	trans	-65.3	-42.7	175.5	51.3	0	0	0	0	112.3	H308 N313 L314	H308-T310 PolarHBondContact O-N 3.16Å; H308-T310 VanDerWaalsContact O-N 3.11Å; T310-N313 PolarHBondContact O-N 2.81Å; T310-L314 WeakPolarHBondContact O-CB 3.45Å; T310-L314 PolarHBondContact O-N 2.82Å
311	L	73.6	Confident	74	Confident	83 Å²	83	77.9 Å²	77.9	44%	0.435	42%	0.424	S	S	.	.	H	α-helix	trans	-70.9	-34.4	176.6	-70	179.6	0	0	0	111.4	S306 H308 L314 S315	S306-L311 VanDerWaalsContact OG-CB 3.23Å; S306-L311 WeakPolarHBondContact OG-CB 3.49Å; S306-L311 VanDerWaalsContact OG-CD1 3.29Å; S306-L311 WeakPolarHBondContact OG-CD1 3.25Å; H308-L311 HydrophobicContact CB-CB 4.24Å; H308-L311 HydrophobicContact CB-CD1 4.12Å; H308-L311 HydrophobicContact CB-CG 4.14Å; H308-L311 WeakPolarHBondContact O-CB 3.47Å; H308-L311 PolarHBondContact O-N 3.27Å; L311-L314 PolarHBondContact O-N 3.11Å; L311-S315 VanDerWaalsContact O-CB 3.27Å; L311-S315 WeakPolarHBondContact O-CB 3.25Å; L311-S315 PolarHBondContact O-N 3.04Å
312	V	70.1	Confident	74.8	Confident	53 Å²	53	75 Å²	75	32%	0.321	41%	0.408	S	S	.	.	H	α-helix	trans	-62.2	-46.5	172.6	177.2	0	0	0	0	110.9	S306 H308 T309 S315 S316	S306-V312 WeakPolarHBondContact O-CG2 3.41Å; H308-V312 PolarHBondContact O-N 2.75Å; T309-V312 PolarHBondContact O-N 2.79Å; V312-S315 PolarHBondContact O-N 3.29Å; V312-S315 PolarHBondContact O-OG 2.98Å; V312-S316 PolarHBondContact O-N 3.46Å; V312-S316 PolarHBondContact O-OG 3.16Å
313	N	70.5	Confident	75.7	Confident	96 Å²	96	71.8 Å²	71.8	51%	0.513	39%	0.392	S	S	.	.	H	α-helix	trans	-64.6	-41.8	175.8	-73.6	-16.1	0	0	0	112.2	T309 T310 S315 S316 I317	T309-N313 PolarHBondContact O-N 3.29Å; T310-N313 PolarHBondContact O-N 2.81Å; N313-S315 VanDerWaalsContact C-N 3.34Å; N313-S315 PolarHBondContact O-N 2.86Å; N313-S316 WeakPolarHBondContact O-CB 3.27Å; N313-S316 PolarHBondContact O-N 2.78Å; N313-I317 PolarHBondContact O-N 2.82Å
314	L	77.2	Confident	76.8	Confident	86 Å²	86	73.9 Å²	73.9	45%	0.45	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-39.7	176.6	-171.7	64.9	0	0	0	111.6	T310 L311 S316 I317 L318	T310-L314 WeakPolarHBondContact O-CB 3.45Å; T310-L314 PolarHBondContact O-N 2.82Å; L311-L314 PolarHBondContact O-N 3.11Å; L314-S316 PolarHBondContact O-N 2.8Å; L314-I317 PolarHBondContact O-N 3.41Å; L314-I317 VanDerWaalsContact O-N 3.14Å; L314-L318 HydrophobicContact CG-CD1 4.17Å; L314-L318 HydrophobicContact CG-CG 4.36Å; L314-L318 WeakPolarHBondContact O-CB 3.31Å; L314-L318 VanDerWaalsContact O-CG 3.29Å; L314-L318 WeakPolarHBondContact O-CG 3.25Å; L314-L318 PolarHBondContact O-N 2.82Å
315	S	73.4	Confident	77.7	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-60.8	-35.8	177.5	77.7	0	0	0	0	112	A303 L311 V312 N313 L318 K319	A303-S315 VanDerWaalsContact CB-OG 3.27Å; A303-S315 WeakPolarHBondContact CB-OG 3.3Å; L311-S315 VanDerWaalsContact O-CB 3.27Å; L311-S315 WeakPolarHBondContact O-CB 3.25Å; L311-S315 PolarHBondContact O-N 3.04Å; V312-S315 PolarHBondContact O-N 3.29Å; V312-S315 PolarHBondContact O-OG 2.98Å; N313-S315 VanDerWaalsContact C-N 3.34Å; N313-S315 PolarHBondContact O-N 2.86Å; S315-L318 PolarHBondContact O-N 3.33Å; S315-K319 PolarHBondContact O-N 3.43Å
316	S	72.9	Confident	78.4	Confident	41 Å²	41	64.6 Å²	64.6	29%	0.287	35%	0.353	S	S	.	.	H	α-helix	trans	-67	-41.7	175.6	-63.1	0	0	0	0	111.4	V312 N313 L314 K319	V312-S316 PolarHBondContact O-N 3.46Å; V312-S316 PolarHBondContact O-OG 3.16Å; N313-S316 WeakPolarHBondContact O-CB 3.27Å; N313-S316 PolarHBondContact O-N 2.78Å; L314-S316 PolarHBondContact O-N 2.8Å; S316-K319 VanDerWaalsContact O-CB 3.29Å; S316-K319 WeakPolarHBondContact O-CB 3.29Å; S316-K319 PolarHBondContact O-N 3.42Å
317	I	79.6	Confident	79.2	Confident	104 Å²	104	65.1 Å²	65.1	53%	0.533	36%	0.357	S	S	.	.	H	α-helix	trans	-68.4	-38.8	175.3	-62.9	169.3	0	0	0	111	N313 L314 K319 L320	N313-I317 PolarHBondContact O-N 2.82Å; L314-I317 PolarHBondContact O-N 3.41Å; L314-I317 VanDerWaalsContact O-N 3.14Å; I317-K319 PolarHBondContact O-N 3.19Å; I317-K319 VanDerWaalsContact O-N 3.13Å; I317-L320 WeakPolarHBondContact O-CB 3.37Å; I317-L320 VanDerWaalsContact O-CD1 3.29Å; I317-L320 WeakPolarHBondContact O-CD1 3.36Å; I317-L320 PolarHBondContact O-N 3.24Å
318	L	82.9	Confident	80	Confident	66 Å²	66	57.7 Å²	57.7	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-61.8	-20.9	177.5	-73.3	170.9	0	0	0	112.7	F299 L314 S315 L320 A321	F299-L318 HydrophobicContact CB-CB 4.02Å; F299-L318 HydrophobicContact CD1-CB 4.07Å; F299-L318 HydrophobicContact CD1-CD1 4.28Å; F299-L318 HydrophobicContact CD2-CB 4.38Å; F299-L318 WeakPolarHBondContact CD2-O 3.17Å; F299-L318 HydrophobicContact CG-CB 3.91Å; L314-L318 HydrophobicContact CG-CD1 4.17Å; L314-L318 HydrophobicContact CG-CG 4.36Å; L314-L318 WeakPolarHBondContact O-CB 3.31Å; L314-L318 VanDerWaalsContact O-CG 3.29Å; L314-L318 WeakPolarHBondContact O-CG 3.25Å; L314-L318 PolarHBondContact O-N 2.82Å; S315-L318 PolarHBondContact O-N 3.33Å; L318-L320 PolarHBondContact O-N 3.26Å; L318-L320 VanDerWaalsContact O-N 3.14Å; L318-A321 VanDerWaalsContact O-CB 3.23Å; L318-A321 WeakPolarHBondContact O-CB 3.31Å; L318-A321 PolarHBondContact O-N 2.9Å
319	K	81.5	Confident	80.3	Confident	32 Å²	32	52.5 Å²	52.5	14%	0.139	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-56.4	-27.1	169.7	-62.2	-176.7	-178.9	-176.5	0	112.3	I226 V230 S315 S316 I317 A321 R322	I226-K319 HydrophobicContact CG2-CB 4.41Å; V230-K319 HydrophobicContact CG2-CB 4.32Å; S315-K319 PolarHBondContact O-N 3.43Å; S316-K319 VanDerWaalsContact O-CB 3.29Å; S316-K319 WeakPolarHBondContact O-CB 3.29Å; S316-K319 PolarHBondContact O-N 3.42Å; I317-K319 PolarHBondContact O-N 3.19Å; I317-K319 VanDerWaalsContact O-N 3.13Å; K319-A321 PolarHBondContact O-N 3.31Å; K319-R322 VanDerWaalsContact O-CB 3.23Å; K319-R322 WeakPolarHBondContact O-CB 3.33Å; K319-R322 WeakPolarHBondContact O-CG 3.44Å; K319-R322 PolarHBondContact O-N 3.09Å
320	L	84.2	Confident	80.7	Confident	76 Å²	76	52.1 Å²	52.1	40%	0.398	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-62.3	-23.4	175.4	-84.7	79.5	0	0	0	112.8	V230 I317 L318 R322 L323	V230-L320 HydrophobicContact CB-CD1 4.12Å; V230-L320 HydrophobicContact CG1-CD1 3.78Å; V230-L320 HydrophobicContact CG2-CD1 3.68Å; I317-L320 WeakPolarHBondContact O-CB 3.37Å; I317-L320 VanDerWaalsContact O-CD1 3.29Å; I317-L320 WeakPolarHBondContact O-CD1 3.36Å; I317-L320 PolarHBondContact O-N 3.24Å; L318-L320 PolarHBondContact O-N 3.26Å; L318-L320 VanDerWaalsContact O-N 3.14Å; L320-R322 PolarHBondContact O-N 2.93Å; L320-R322 VanDerWaalsContact O-N 3.13Å; L320-L323 HydrophobicContact CG-CD1 4.36Å; L320-L323 VanDerWaalsContact O-CB 3.25Å; L320-L323 WeakPolarHBondContact O-CB 3.29Å; L320-L323 WeakPolarHBondContact O-CG 3.32Å; L320-L323 PolarHBondContact O-N 3.05Å
321	A	85.9	Confident	80.8	Confident	24 Å²	24	50.8 Å²	50.8	20%	0.198	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-60	-23.8	174.7	0	0	0	0	0	112.2	I294 F299 L318 K319 L323 L324	I294-A321 HydrophobicContact CG2-CB 4.31Å; F299-A321 HydrophobicContact CD2-CB 4.47Å; F299-A321 HydrophobicContact CE2-CB 3.71Å; F299-A321 HydrophobicContact CZ-CB 4.25Å; L318-A321 VanDerWaalsContact O-CB 3.23Å; L318-A321 WeakPolarHBondContact O-CB 3.31Å; L318-A321 PolarHBondContact O-N 2.9Å; K319-A321 PolarHBondContact O-N 3.31Å; A321-L323 PolarHBondContact O-N 3.36Å; A321-L324 VanDerWaalsContact O-CB 3.23Å; A321-L324 WeakPolarHBondContact O-CB 3.47Å; A321-L324 VanDerWaalsContact O-CG 3.26Å; A321-L324 WeakPolarHBondContact O-CG 3.14Å; A321-L324 PolarHBondContact O-N 2.98Å; A321-L324 VanDerWaalsContact O-N 3.14Å
322	R	86.5	Confident	80.7	Confident	8 Å²	8	48.9 Å²	48.9	3%	0.03	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-64.6	-20.8	172.4	-64.4	176.9	171.2	173.9	-5.4	112.6	I226 E247 D251 K319 L320 L324 R325	I226-R322 HydrophobicContact CD1-CB 3.42Å; I226-R322 VanDerWaalsContact CD1-CB 3.42Å; I226-R322 HydrophobicContact CD1-CG 4.21Å; E247-R322 IonicContact OE2-CZ 3.25Å; E247-R322 IonicContact OE2-NH1 2.81Å; E247-R322 PolarHBondContact OE2-NH1 2.82Å; D251-R322 IonicContact OD1-CZ 2.95Å; D251-R322 IonicContact OD1-NE 3.1Å; D251-R322 IonicContact OD2-CZ 3.23Å; D251-R322 IonicContact OD2-NE 3.34Å; D251-R322 IonicContact OD2-NH2 3.38Å; D251-R322 PolarHBondContact OD2-NH2 2.87Å; K319-R322 VanDerWaalsContact O-CB 3.23Å; K319-R322 WeakPolarHBondContact O-CB 3.33Å; K319-R322 WeakPolarHBondContact O-CG 3.44Å; K319-R322 PolarHBondContact O-N 3.09Å; L320-R322 PolarHBondContact O-N 2.93Å; L320-R322 VanDerWaalsContact O-N 3.13Å; R322-L324 PolarHBondContact O-N 2.94Å; R322-R325 VanDerWaalsContact O-CB 3.27Å; R322-R325 WeakPolarHBondContact O-CB 3.27Å; R322-R325 WeakPolarHBondContact O-CD 3.45Å; R322-R325 WeakPolarHBondContact O-CG 3.43Å; R322-R325 PolarHBondContact O-N 2.95Å
323	L	87.8	Confident	81	Confident	32 Å²	32	48.6 Å²	48.6	17%	0.168	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-64.8	-18.5	173.5	-65.5	175.7	0	0	0	112.7	P227 L320 A321 R325 L326 W357	P227-L323 HydrophobicContact CG-CD1 4.47Å; P227-L323 HydrophobicContact CG-CD2 4.29Å; L320-L323 HydrophobicContact CG-CD1 4.36Å; L320-L323 VanDerWaalsContact O-CB 3.25Å; L320-L323 WeakPolarHBondContact O-CB 3.29Å; L320-L323 WeakPolarHBondContact O-CG 3.32Å; L320-L323 PolarHBondContact O-N 3.05Å; A321-L323 PolarHBondContact O-N 3.36Å; L323-R325 PolarHBondContact O-N 3.21Å; L323-R325 VanDerWaalsContact O-N 3.08Å; L323-L326 VanDerWaalsContact O-CB 3.3Å; L323-L326 WeakPolarHBondContact O-CB 3.49Å; L323-L326 PolarHBondContact O-N 2.94Å; L323-W357 HydrophobicContact CD1-CZ2 4.48Å; L323-W357 HydrophobicContact CD2-CZ2 3.99Å
324	L	89.1	Confident	81.1	Confident	70 Å²	70	49.4 Å²	49.4	37%	0.366	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-60.3	-15.2	170.5	-63.4	174.2	0	0	0	112.7	V291 I294 A321 R322 L326 C327	V291-L324 HydrophobicContact CG1-CB 4.22Å; I294-L324 HydrophobicContact CB-CD1 4.46Å; I294-L324 HydrophobicContact CG2-CD1 3.85Å; A321-L324 VanDerWaalsContact O-CB 3.23Å; A321-L324 WeakPolarHBondContact O-CB 3.47Å; A321-L324 VanDerWaalsContact O-CG 3.26Å; A321-L324 WeakPolarHBondContact O-CG 3.14Å; A321-L324 PolarHBondContact O-N 2.98Å; A321-L324 VanDerWaalsContact O-N 3.14Å; R322-L324 PolarHBondContact O-N 2.94Å; L324-L326 PolarHBondContact O-N 3.21Å; L324-L326 VanDerWaalsContact O-N 3.13Å; L324-C327 WeakPolarHBondContact O-CB 3.45Å; L324-C327 PolarHBondContact O-N 2.86Å
325	R	87.6	Confident	80.7	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.008	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-54.9	-27.6	169.2	-69.2	168.8	-168.3	-172.2	2	112.1	T219 D251 F254 S295 R322 L323 C327 R328	T219-R325 HydrophobicContact CG2-CB 4Å; D251-R325 IonicContact OD1-CZ 2.91Å; D251-R325 IonicContact OD1-NH1 3.79Å; D251-R325 PolarHBondContact OD1-NH1 3.42Å; D251-R325 VanDerWaalsContact OD1-NH1 3.1Å; D251-R325 IonicContact OD1-NH2 3.96Å; D251-R325 PolarHBondContact OD1-NH2 3.35Å; F254-R325 HydrophobicContact CD1-CG 4.43Å; F254-R325 VanDerWaalsContact CD2-NH1 3.34Å; F254-R325 HydrophobicContact CE1-CB 4.45Å; F254-R325 HydrophobicContact CE1-CG 4.19Å; F254-R325 HydrophobicContact CZ-CG 4.32Å; S295-R325 PolarHBondContact O-NE 3.19Å; S295-R325 PolarHBondContact O-NH2 3.17Å; R322-R325 VanDerWaalsContact O-CB 3.27Å; R322-R325 WeakPolarHBondContact O-CB 3.27Å; R322-R325 WeakPolarHBondContact O-CD 3.45Å; R322-R325 WeakPolarHBondContact O-CG 3.43Å; R322-R325 PolarHBondContact O-N 2.95Å; L323-R325 PolarHBondContact O-N 3.21Å; L323-R325 VanDerWaalsContact O-N 3.08Å; R325-C327 PolarHBondContact O-N 2.83Å; R325-R328 VanDerWaalsContact O-CB 3.23Å; R325-R328 WeakPolarHBondContact O-CB 3.45Å; R325-R328 WeakPolarHBondContact O-CG 3.46Å; R325-R328 PolarHBondContact O-N 2.99Å
326	L	86.4	Confident	80.6	Confident	64 Å²	64	49.2 Å²	49.2	34%	0.335	26%	0.256	S	S	.	.	H	α-helix	trans	-60.4	-27.5	176.3	-166.7	66.1	0	0	0	112.6	L323 L324 R328 V329 L330 W357	L323-L326 VanDerWaalsContact O-CB 3.3Å; L323-L326 WeakPolarHBondContact O-CB 3.49Å; L323-L326 PolarHBondContact O-N 2.94Å; L324-L326 PolarHBondContact O-N 3.21Å; L324-L326 VanDerWaalsContact O-N 3.13Å; L326-R328 PolarHBondContact O-N 2.93Å; L326-R328 VanDerWaalsContact O-N 3.17Å; L326-V329 HydrophobicContact CD1-CB 4.44Å; L326-V329 HydrophobicContact CD1-CG2 4.19Å; L326-V329 WeakPolarHBondContact O-CB 3.3Å; L326-V329 PolarHBondContact O-N 2.81Å; L326-L330 PolarHBondContact O-N 3.16Å; L326-W357 HydrophobicContact CD2-CH2 4.23Å
327	C	85.9	Confident	80.6	Confident	31 Å²	31	50 Å²	50	21%	0.209	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-26.9	172.9	-66.5	0	0	0	0	112.6	W288 V291 L324 R325 V329 L330 R331	W288-C327 HydrophobicContact CZ3-CB 3.92Å; V291-C327 HydrophobicContact CG1-CB 3.87Å; L324-C327 WeakPolarHBondContact O-CB 3.45Å; L324-C327 PolarHBondContact O-N 2.86Å; R325-C327 PolarHBondContact O-N 2.83Å; C327-V329 VanDerWaalsContact C-N 3.31Å; C327-V329 PolarHBondContact O-N 2.85Å; C327-L330 WeakPolarHBondContact O-CB 3.5Å; C327-L330 PolarHBondContact O-N 3.08Å; C327-R331 PolarHBondContact O-N 3.03Å
328	R	84	Confident	80.2	Confident	6 Å²	6	47.5 Å²	47.5	2%	0.023	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-35.5	174.9	-57	-173.6	-174.1	-120.7	-0.6	112	D257 D292 S295 R325 L326 L330 R331	D257-R328 IonicContact OD2-CZ 3.16Å; D257-R328 IonicContact OD2-NH1 3.91Å; D257-R328 PolarHBondContact OD2-NH1 3.23Å; D292-R328 PolarHBondContact O-NH2 2.07Å; D292-R328 WeakPolarHBondContact OD1-CG 3.27Å; D292-R328 IonicContact OD1-CZ 3.85Å; D292-R328 IonicContact OD1-NE 3.36Å; D292-R328 PolarHBondContact OD1-NE 2.75Å; D292-R328 VanDerWaalsContact OD1-NE 3.16Å; D292-R328 IonicContact OD1-NH1 3.73Å; D292-R328 IonicContact OD1-NH2 3.97Å; D292-R328 PolarHBondContact OD1-NH2 2.88Å; D292-R328 IonicContact OD2-CZ 3.86Å; D292-R328 IonicContact OD2-NH1 3.48Å; S295-R328 PolarHBondContact OG-NH2 2.79Å; R325-R328 VanDerWaalsContact O-CB 3.23Å; R325-R328 WeakPolarHBondContact O-CB 3.45Å; R325-R328 WeakPolarHBondContact O-CG 3.46Å; R325-R328 PolarHBondContact O-N 2.99Å; L326-R328 PolarHBondContact O-N 2.93Å; L326-R328 VanDerWaalsContact O-N 3.17Å; R328-L330 VanDerWaalsContact C-N 3.34Å; R328-R331 WeakPolarHBondContact O-CB 3.34Å; R328-R331 PolarHBondContact O-N 3.3Å
329	V	80.8	Confident	79.8	Confident	19 Å²	19	49.9 Å²	49.9	12%	0.115	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-40.2	175.5	-176.4	0	0	0	0	110	F216 T219 L326 C327 R331 K332 L333	F216-V329 HydrophobicContact CD2-CG1 3.98Å; F216-V329 HydrophobicContact CD2-CG2 4Å; F216-V329 HydrophobicContact CE2-CG1 3.81Å; F216-V329 HydrophobicContact CE2-CG2 4.38Å; T219-V329 HydrophobicContact CG2-CG2 3.9Å; L326-V329 HydrophobicContact CD1-CB 4.44Å; L326-V329 HydrophobicContact CD1-CG2 4.19Å; L326-V329 WeakPolarHBondContact O-CB 3.3Å; L326-V329 PolarHBondContact O-N 2.81Å; C327-V329 VanDerWaalsContact C-N 3.31Å; C327-V329 PolarHBondContact O-N 2.85Å; V329-R331 VanDerWaalsContact C-N 3.26Å; V329-R331 PolarHBondContact O-N 3Å; V329-K332 CarbonylContact O-C 3.44Å; V329-K332 PolarHBondContact O-N 3.48Å; V329-L333 PolarHBondContact O-N 3.43Å
330	L	79.6	Confident	79.4	Confident	99 Å²	99	51.1 Å²	51.1	52%	0.518	26%	0.258	S	S	.	.	H	α-helix	trans	-57.3	-37.3	177.5	-62.2	178.4	0	0	0	112.4	L326 C327 R328 K332 L333	L326-L330 PolarHBondContact O-N 3.16Å; C327-L330 WeakPolarHBondContact O-CB 3.5Å; C327-L330 PolarHBondContact O-N 3.08Å; R328-L330 VanDerWaalsContact C-N 3.34Å; L330-K332 PolarHBondContact O-N 3.43Å; L330-L333 HydrophobicContact CD2-CD2 4.18Å; L330-L333 WeakPolarHBondContact O-CB 3.39Å; L330-L333 PolarHBondContact O-N 2.94Å
331	R	76.8	Confident	79	Confident	71 Å²	71	51.2 Å²	51.2	27%	0.268	27%	0.269	S	S	.	.	H	α-helix	trans	-60.4	-26.8	176	-59.6	-173.2	-63.7	-159.2	-0.9	113.7	W288 D292 C327 R328 V329	W288-R331 HydrophobicContact CD2-CG 3.89Å; W288-R331 HydrophobicContact CE3-CG 4.29Å; W288-R331 HydrophobicContact CG-CG 4.38Å; W288-R331 HydrophobicContact CH2-CG 4.21Å; W288-R331 HydrophobicContact CZ2-CG 3.79Å; W288-R331 HydrophobicContact CZ3-CG 4.45Å; D292-R331 IonicContact OD1-NH1 3.97Å; D292-R331 IonicContact OD1-NH2 3.96Å; D292-R331 IonicContact OD2-CZ 3.76Å; D292-R331 IonicContact OD2-NH1 2.68Å; D292-R331 PolarHBondContact OD2-NH1 3.5Å; D292-R331 IonicContact OD2-NH2 3.69Å; D292-R331 PolarHBondContact OD2-NH2 3.43Å; C327-R331 PolarHBondContact O-N 3.03Å; R328-R331 WeakPolarHBondContact O-CB 3.34Å; R328-R331 PolarHBondContact O-N 3.3Å; V329-R331 VanDerWaalsContact C-N 3.26Å; V329-R331 PolarHBondContact O-N 3Å
332	K	72.6	Confident	78.6	Confident	44 Å²	44	51.8 Å²	51.8	19%	0.191	27%	0.272	C	S	.	.	H	α-helix	trans	-111.2	0.3	-176.4	-73.1	177.4	163.1	-87	0	112.8	D212 V329 L330 D334 Q335 Y336	D212-K332 HydrophobicContact CB-CD 4.13Å; D212-K332 VanDerWaalsContact CB-CE 3.42Å; D212-K332 VanDerWaalsContact OD1-CE 3.25Å; D212-K332 WeakPolarHBondContact OD1-CE 3.4Å; D212-K332 IonicContact OD1-NZ 2.72Å; D212-K332 WeakPolarHBondContact OD2-CE 3.44Å; D212-K332 IonicContact OD2-NZ 3.56Å; D212-K332 PolarHBondContact OD2-NZ 3.33Å; V329-K332 CarbonylContact O-C 3.44Å; V329-K332 PolarHBondContact O-N 3.48Å; L330-K332 PolarHBondContact O-N 3.43Å; K332-D334 PolarHBondContact O-N 2.89Å; K332-Q335 WeakPolarHBondContact O-CA 3.5Å; K332-Q335 VanDerWaalsContact O-CB 3.29Å; K332-Q335 WeakPolarHBondContact O-CB 3.46Å; K332-Q335 PolarHBondContact O-N 3.47Å; K332-Y336 HydrophobicContact CB-CD2 4.16Å; K332-Y336 HydrophobicContact CB-CE2 3.57Å; K332-Y336 WeakPolarHBondContact O-CD2 3.42Å; K332-Y336 PolarHBondContact O-N 3.3Å
333	L	76.4	Confident	78.5	Confident	47 Å²	47	53 Å²	53	25%	0.246	28%	0.279	C	S	.	.	H	α-helix	trans	-57.2	-39.8	-177.2	-171.1	63.5	0	0	0	110.3	V329 L330 Q335 Y336 L337	V329-L333 PolarHBondContact O-N 3.43Å; L330-L333 HydrophobicContact CD2-CD2 4.18Å; L330-L333 WeakPolarHBondContact O-CB 3.39Å; L330-L333 PolarHBondContact O-N 2.94Å; L333-Q335 PolarHBondContact O-N 3.45Å; L333-Q335 VanDerWaalsContact O-N 3.15Å; L333-Y336 PolarHBondContact O-N 2.75Å; L333-L337 HydrophobicContact CD1-CD1 4.31Å; L333-L337 HydrophobicContact CD1-CD2 4.23Å; L333-L337 HydrophobicContact CD1-CG 4.05Å; L333-L337 HydrophobicContact CD2-CD1 4.13Å; L333-L337 HydrophobicContact CG-CD1 3.68Å; L333-L337 HydrophobicContact CG-CD2 4.48Å; L333-L337 HydrophobicContact CG-CG 3.88Å; L333-L337 WeakPolarHBondContact O-CB 3.38Å; L333-L337 VanDerWaalsContact O-CG 3.25Å; L333-L337 WeakPolarHBondContact O-CG 3.17Å; L333-L337 PolarHBondContact O-N 3.05Å
334	D	72.1	Confident	78.3	Confident	112 Å²	112	55.5 Å²	55.5	60%	0.599	29%	0.292	S	S	*	.	H	α-helix	trans	-58.4	-29	174.8	-72.2	-16.1	0	0	0	114.2	R5 K332	R5-D334 PolarHBondContact NH1-O 3.26Å; R5-D334 PolarHBondContact NH2-O 3.2Å; K332-D334 PolarHBondContact O-N 2.89Å
335	Q	69.1	Low	78.1	Confident	75 Å²	75	57.9 Å²	57.9	35%	0.35	30%	0.304	S	S	.	.	H	α-helix	trans	-74.5	-41	174.5	-172.3	177.3	-1.4	0	0	111.3	K332 L333	K332-Q335 WeakPolarHBondContact O-CA 3.5Å; K332-Q335 VanDerWaalsContact O-CB 3.29Å; K332-Q335 WeakPolarHBondContact O-CB 3.46Å; K332-Q335 PolarHBondContact O-N 3.47Å; L333-Q335 PolarHBondContact O-N 3.45Å; L333-Q335 VanDerWaalsContact O-N 3.15Å
336	Y	70.7	Confident	78	Confident	11 Å²	11	59.2 Å²	59.2	4%	0.043	31%	0.311	C	S	.	.	H	α-helix	trans	-76.8	-32	-179.4	-56.4	-55.5	0	0	0	112.7	W213 F216 K332 L333 E338 S342 I346	W213-Y336 HydrophobicContact CD2-CE1 4.42Å; W213-Y336 HydrophobicContact CE3-CE1 4.3Å; W213-Y336 AromaticContact CH2-CD1 3.84Å; W213-Y336 HydrophobicContact CH2-CD1 3.84Å; W213-Y336 AromaticContact CH2-CE1 3.5Å; W213-Y336 HydrophobicContact CH2-CE1 3.5Å; W213-Y336 HydrophobicContact CZ2-CD1 4.13Å; W213-Y336 AromaticContact CZ2-CE1 3.63Å; W213-Y336 HydrophobicContact CZ2-CE1 3.63Å; W213-Y336 HydrophobicContact CZ3-CD1 4.44Å; W213-Y336 AromaticContact CZ3-CE1 3.85Å; W213-Y336 HydrophobicContact CZ3-CE1 3.85Å; F216-Y336 HydrophobicContact CD2-CE2 4.15Å; F216-Y336 HydrophobicContact CE2-CE2 4.49Å; K332-Y336 HydrophobicContact CB-CD2 4.16Å; K332-Y336 HydrophobicContact CB-CE2 3.57Å; K332-Y336 WeakPolarHBondContact O-CD2 3.42Å; K332-Y336 PolarHBondContact O-N 3.3Å; L333-Y336 PolarHBondContact O-N 2.75Å; Y336-E338 PolarHBondContact O-N 3.43Å; Y336-S342 VanDerWaalsContact O-CB 3.27Å; Y336-S342 WeakPolarHBondContact O-CB 3.2Å; Y336-I346 HydrophobicContact CG-CD1 4.26Å
337	L	74	Confident	78	Confident	58 Å²	58	58.2 Å²	58.2	30%	0.304	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-1.6	178.1	-64.3	-179.8	0	0	0	114	L333 Y339 I343	L333-L337 HydrophobicContact CD1-CD1 4.31Å; L333-L337 HydrophobicContact CD1-CD2 4.23Å; L333-L337 HydrophobicContact CD1-CG 4.05Å; L333-L337 HydrophobicContact CD2-CD1 4.13Å; L333-L337 HydrophobicContact CG-CD1 3.68Å; L333-L337 HydrophobicContact CG-CD2 4.48Å; L333-L337 HydrophobicContact CG-CG 3.88Å; L333-L337 WeakPolarHBondContact O-CB 3.38Å; L333-L337 VanDerWaalsContact O-CG 3.25Å; L333-L337 WeakPolarHBondContact O-CG 3.17Å; L333-L337 PolarHBondContact O-N 3.05Å; L337-Y339 VanDerWaalsContact C-N 3.31Å; L337-I343 HydrophobicContact CB-CG1 4.44Å; L337-I343 HydrophobicContact CD2-CB 4.37Å; L337-I343 HydrophobicContact CD2-CD1 4.38Å; L337-I343 HydrophobicContact CD2-CG1 3.74Å; L337-I343 HydrophobicContact CD2-CG2 4.24Å
338	E	71.5	Confident	78.2	Confident	50 Å²	50	61.3 Å²	61.3	23%	0.234	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-32.1	174.7	-169.4	167.1	-170.8	0	0	111.4	M1 A2 Y336	M1-E338 VanDerWaalsContact CA-OE1 3.32Å; M1-E338 WeakPolarHBondContact CA-OE1 3.47Å; M1-E338 PolarHBondContact N-OE1 2.97Å; A2-E338 PolarHBondContact N-OE1 3.13Å; Y336-E338 PolarHBondContact O-N 3.43Å
339	Y	72.7	Confident	78.4	Confident	116 Å²	116	64.9 Å²	64.9	46%	0.455	34%	0.335	S	S	.	.	S	Bend	trans	-99.2	122.5	-178.3	-62	-80	0	0	0	111.6	L337 A341 S342 I343 T785	L337-Y339 VanDerWaalsContact C-N 3.31Å; Y339-A341 VanDerWaalsContact C-N 3.31Å; Y339-A341 PolarHBondContact O-N 3.17Å; Y339-S342 WeakPolarHBondContact O-CB 3.43Å; Y339-S342 PolarHBondContact O-N 3.19Å; Y339-I343 PolarHBondContact O-N 3.01Å; Y339-T785 HydrophobicContact CE1-CG2 4.22Å
340	V	74.4	Confident	78.9	Confident	58 Å²	58	67 Å²	67	35%	0.352	35%	0.351	S	S	.	.	H	α-helix	trans	-53.8	-44.6	-177.7	179.3	0	0	0	0	112.5	S342 I343 I459	V340-S342 VanDerWaalsContact C-N 3.34Å; V340-S342 PolarHBondContact O-N 3.29Å; V340-I343 WeakPolarHBondContact O-CB 3.41Å; V340-I343 PolarHBondContact O-N 2.98Å; V340-I459 HydrophobicContact CG1-CB 4.16Å; V340-I459 HydrophobicContact CG1-CG1 3.96Å; V340-I459 HydrophobicContact CG1-CG2 3.44Å; V340-I459 VanDerWaalsContact CG1-CG2 3.44Å
341	A	75	Confident	79.5	Confident	78 Å²	78	63.5 Å²	63.5	65%	0.645	33%	0.331	S	S	*	.	H	α-helix	trans	-66.8	-34.1	179.3	0	0	0	0	0	113.1	Y339 I343 L344 L345	Y339-A341 VanDerWaalsContact C-N 3.31Å; Y339-A341 PolarHBondContact O-N 3.17Å; A341-I343 VanDerWaalsContact C-N 3.32Å; A341-I343 PolarHBondContact O-N 3.31Å; A341-L344 PolarHBondContact O-N 3.22Å; A341-L345 PolarHBondContact O-N 2.84Å; A341-L345 VanDerWaalsContact O-N 3.15Å
342	S	78.8	Confident	80.3	Confident	36 Å²	36	64 Å²	64	25%	0.252	34%	0.338	S	S	.	.	H	α-helix	trans	-67.2	-34.4	177.9	-58.9	0	0	0	0	111.8	Y336 Y339 V340 L345 I346	Y336-S342 VanDerWaalsContact O-CB 3.27Å; Y336-S342 WeakPolarHBondContact O-CB 3.2Å; Y339-S342 WeakPolarHBondContact O-CB 3.43Å; Y339-S342 PolarHBondContact O-N 3.19Å; V340-S342 VanDerWaalsContact C-N 3.34Å; V340-S342 PolarHBondContact O-N 3.29Å; S342-L345 PolarHBondContact O-N 3.46Å; S342-I346 WeakPolarHBondContact O-CB 3.39Å; S342-I346 VanDerWaalsContact O-CG1 3.25Å; S342-I346 WeakPolarHBondContact O-CG1 3.31Å; S342-I346 PolarHBondContact O-N 3.34Å
343	I	82.7	Confident	81.2	Confident	34 Å²	34	62.6 Å²	62.6	17%	0.174	33%	0.332	C	S	.	.	H	α-helix	trans	-58.8	-49.6	174.3	-56.2	177.8	0	0	0	110.2	L337 Y339 V340 A341 L345 I346 M347 I459	L337-I343 HydrophobicContact CB-CG1 4.44Å; L337-I343 HydrophobicContact CD2-CB 4.37Å; L337-I343 HydrophobicContact CD2-CD1 4.38Å; L337-I343 HydrophobicContact CD2-CG1 3.74Å; L337-I343 HydrophobicContact CD2-CG2 4.24Å; Y339-I343 PolarHBondContact O-N 3.01Å; V340-I343 WeakPolarHBondContact O-CB 3.41Å; V340-I343 PolarHBondContact O-N 2.98Å; A341-I343 VanDerWaalsContact C-N 3.32Å; A341-I343 PolarHBondContact O-N 3.31Å; I343-L345 PolarHBondContact O-N 2.78Å; I343-I346 PolarHBondContact O-N 3.06Å; I343-M347 HydrophobicContact CG2-CG 4.25Å; I343-M347 WeakPolarHBondContact O-CB 3.44Å; I343-M347 WeakPolarHBondContact O-CG 3.39Å; I343-M347 PolarHBondContact O-N 3.01Å; I343-I459 HydrophobicContact CB-CD1 4.42Å; I343-I459 HydrophobicContact CG2-CD1 4.34Å
344	L	84.1	Confident	82.1	Confident	84 Å²	84	62 Å²	62	44%	0.44	33%	0.329	S	S	.	.	H	α-helix	trans	-60.9	-45.9	-179.8	-179	64.8	0	0	0	111.8	A341 I346 M347 L348 V456 I459	A341-L344 PolarHBondContact O-N 3.22Å; L344-I346 PolarHBondContact O-N 3.36Å; L344-M347 PolarHBondContact O-N 3.09Å; L344-L348 WeakPolarHBondContact O-CB 3.27Å; L344-L348 PolarHBondContact O-N 3.02Å; L344-V456 HydrophobicContact CD1-CG2 3.79Å; L344-I459 HydrophobicContact CB-CD1 4.37Å
345	L	85.1	Confident	83.2	Confident	121 Å²	121	56.6 Å²	56.6	63%	0.634	30%	0.301	S	S	*	.	H	α-helix	trans	-62.9	-43.1	179.9	-175.6	67.1	0	0	0	111.9	A341 S342 I343 L348 F349	A341-L345 PolarHBondContact O-N 2.84Å; A341-L345 VanDerWaalsContact O-N 3.15Å; S342-L345 PolarHBondContact O-N 3.46Å; I343-L345 PolarHBondContact O-N 2.78Å; L345-L348 PolarHBondContact O-N 3.27Å; L345-F349 WeakPolarHBondContact O-CB 3.29Å; L345-F349 PolarHBondContact O-N 3.17Å
346	I	85.3	Confident	84.5	Confident	30 Å²	30	53.4 Å²	53.4	15%	0.154	29%	0.286	C	S	.	.	H	α-helix	trans	-66.2	-43.5	177.5	-70.6	168.3	0	0	0	110.6	Y336 S342 I343 L344 L348 F349 C350	Y336-I346 HydrophobicContact CG-CD1 4.26Å; S342-I346 WeakPolarHBondContact O-CB 3.39Å; S342-I346 VanDerWaalsContact O-CG1 3.25Å; S342-I346 WeakPolarHBondContact O-CG1 3.31Å; S342-I346 PolarHBondContact O-N 3.34Å; I343-I346 PolarHBondContact O-N 3.06Å; L344-I346 PolarHBondContact O-N 3.36Å; I346-L348 VanDerWaalsContact C-N 3.35Å; I346-L348 PolarHBondContact O-N 2.9Å; I346-F349 PolarHBondContact O-N 3.48Å; I346-C350 WeakPolarHBondContact O-CB 3.06Å; I346-C350 PolarHBondContact O-N 3.4Å; I346-C350 PolarHBondContact O-SG 2.9Å
347	M	86.5	Confident	85.7	Confident	43 Å²	43	56.4 Å²	56.4	21%	0.212	30%	0.297	C	S	.	.	H	α-helix	trans	-60.1	-44.3	176.4	-73.3	-70.9	-55.7	0	0	111.6	I343 L344 C350 F351 I452	I343-M347 HydrophobicContact CG2-CG 4.25Å; I343-M347 WeakPolarHBondContact O-CB 3.44Å; I343-M347 WeakPolarHBondContact O-CG 3.39Å; I343-M347 PolarHBondContact O-N 3.01Å; L344-M347 PolarHBondContact O-N 3.09Å; M347-C350 PolarHBondContact O-N 3.08Å; M347-F351 WeakPolarHBondContact O-CB 3.41Å; M347-F351 PolarHBondContact O-N 3.25Å; M347-I452 HydrophobicContact CE-CB 4.25Å; M347-I452 HydrophobicContact CE-CG1 3.42Å; M347-I452 VanDerWaalsContact CE-CG1 3.42Å
348	L	89.4	Confident	86.7	Confident	95 Å²	95	54.3 Å²	54.3	50%	0.497	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-44.4	176.4	-179.7	64.7	0	0	0	111.6	L344 L345 I346 F351 I352	L344-L348 WeakPolarHBondContact O-CB 3.27Å; L344-L348 PolarHBondContact O-N 3.02Å; L345-L348 PolarHBondContact O-N 3.27Å; I346-L348 VanDerWaalsContact C-N 3.35Å; I346-L348 PolarHBondContact O-N 2.9Å; L348-F351 WeakPolarHBondContact O-CB 3.14Å; L348-F351 PolarHBondContact O-N 3.39Å; L348-I352 HydrophobicContact CD1-CD1 4.31Å; L348-I352 HydrophobicContact CG-CD1 4.14Å; L348-I352 WeakPolarHBondContact O-CG1 3.44Å; L348-I352 PolarHBondContact O-N 2.89Å
349	F	89.7	Confident	87.9	Confident	81 Å²	81	52 Å²	52	36%	0.355	28%	0.275	S	S	.	.	H	α-helix	trans	-62	-45.5	176.4	-179.5	-100.2	0	0	0	111.7	I224 L345 I346 F351 I352 L353	I224-F349 HydrophobicContact CD1-CE2 4.4Å; I224-F349 HydrophobicContact CD1-CZ 4.46Å; L345-F349 WeakPolarHBondContact O-CB 3.29Å; L345-F349 PolarHBondContact O-N 3.17Å; I346-F349 PolarHBondContact O-N 3.48Å; F349-F351 VanDerWaalsContact C-N 3.29Å; F349-F351 PolarHBondContact O-N 3.14Å; F349-I352 PolarHBondContact O-N 2.9Å; F349-L353 HydrophobicContact CE1-CD2 4.33Å; F349-L353 VanDerWaalsContact O-CB 3.28Å; F349-L353 WeakPolarHBondContact O-CB 3.48Å; F349-L353 PolarHBondContact O-N 3.25Å
350	C	90	Very high	88.9	Confident	65 Å²	65	46.6 Å²	46.6	44%	0.439	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-36.1	175.3	-71.3	0	0	0	0	112.3	I346 M347 L353 L354	I346-C350 WeakPolarHBondContact O-CB 3.06Å; I346-C350 PolarHBondContact O-N 3.4Å; I346-C350 PolarHBondContact O-SG 2.9Å; M347-C350 PolarHBondContact O-N 3.08Å; C350-L353 PolarHBondContact O-N 3.26Å; C350-L354 WeakPolarHBondContact O-CB 3.38Å; C350-L354 PolarHBondContact O-N 2.97Å
351	F	92.7	Very high	89.9	Confident	25 Å²	25	47 Å²	47	11%	0.11	26%	0.257	C	S	.	.	H	α-helix	trans	-66	-46.4	176.3	-177.8	-105.9	0	0	0	112.2	M347 L348 F349 L353 L354 A355 L416 I419 T420 V448 I452	M347-F351 WeakPolarHBondContact O-CB 3.41Å; M347-F351 PolarHBondContact O-N 3.25Å; L348-F351 WeakPolarHBondContact O-CB 3.14Å; L348-F351 PolarHBondContact O-N 3.39Å; F349-F351 VanDerWaalsContact C-N 3.29Å; F349-F351 PolarHBondContact O-N 3.14Å; F351-L353 VanDerWaalsContact C-N 3.32Å; F351-L353 PolarHBondContact O-N 2.81Å; F351-L354 PolarHBondContact O-N 2.83Å; F351-A355 PolarHBondContact O-N 3.02Å; F351-L416 HydrophobicContact CE1-CD1 3.93Å; F351-L416 HydrophobicContact CZ-CD1 4.45Å; F351-I419 HydrophobicContact CD2-CD1 4.35Å; F351-I419 HydrophobicContact CE1-CD1 4.15Å; F351-I419 HydrophobicContact CE2-CB 4.4Å; F351-I419 HydrophobicContact CE2-CD1 3.68Å; F351-I419 HydrophobicContact CE2-CG1 3.92Å; F351-I419 HydrophobicContact CZ-CD1 3.58Å; F351-I419 HydrophobicContact CZ-CG1 3.67Å; F351-T420 HydrophobicContact CE1-CG2 4.09Å; F351-T420 HydrophobicContact CZ-CG2 3.7Å; F351-V448 HydrophobicContact CD2-CG1 3.99Å; F351-I452 HydrophobicContact CB-CD1 3.79Å; F351-I452 HydrophobicContact CD2-CD1 3.36Å; F351-I452 HydrophobicContact CE2-CD1 4.09Å; F351-I452 HydrophobicContact CG-CD1 3.71Å
352	I	93	Very high	90.8	Very high	82 Å²	82	43.2 Å²	43.2	42%	0.421	23%	0.226	S	C	.	.	H	α-helix	trans	-63.4	-41.2	175.4	-65.7	167.2	0	0	0	110.4	L348 F349 A355 H356 F412	L348-I352 HydrophobicContact CD1-CD1 4.31Å; L348-I352 HydrophobicContact CG-CD1 4.14Å; L348-I352 WeakPolarHBondContact O-CG1 3.44Å; L348-I352 PolarHBondContact O-N 2.89Å; F349-I352 PolarHBondContact O-N 2.9Å; I352-A355 WeakPolarHBondContact O-CB 3.34Å; I352-A355 PolarHBondContact O-N 3.31Å; I352-H356 WeakPolarHBondContact O-CB 3.12Å; I352-H356 PolarHBondContact O-N 3.02Å; I352-F412 HydrophobicContact CG2-CZ 4.46Å
353	L	93.2	Very high	91.6	Very high	13 Å²	13	42.4 Å²	42.4	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-41.5	178	-175.1	65.3	0	0	0	111.9	C223 I224 F349 C350 F351 H356 W357	C223-L353 HydrophobicContact CB-CD1 3.76Å; C223-L353 HydrophobicContact CB-CD2 3.81Å; C223-L353 HydrophobicContact CB-CG 4.39Å; C223-L353 WeakPolarHBondContact O-CD1 3.46Å; I224-L353 HydrophobicContact CG1-CD1 3.93Å; F349-L353 HydrophobicContact CE1-CD2 4.33Å; F349-L353 VanDerWaalsContact O-CB 3.28Å; F349-L353 WeakPolarHBondContact O-CB 3.48Å; F349-L353 PolarHBondContact O-N 3.25Å; C350-L353 PolarHBondContact O-N 3.26Å; F351-L353 VanDerWaalsContact C-N 3.32Å; F351-L353 PolarHBondContact O-N 2.81Å; L353-H356 WeakPolarHBondContact O-CB 3.35Å; L353-H356 PolarHBondContact O-N 3.45Å; L353-W357 HydrophobicContact CD2-CZ2 4Å; L353-W357 HydrophobicContact CG-CZ2 4.19Å; L353-W357 PolarHBondContact O-N 3.12Å
354	L	94.8	Very high	92	Very high	34 Å²	34	44.6 Å²	44.6	18%	0.178	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-48.4	173.8	177.8	66	0	0	0	110.8	C350 F351 H356 W357 L358 I444 V448	C350-L354 WeakPolarHBondContact O-CB 3.38Å; C350-L354 PolarHBondContact O-N 2.97Å; F351-L354 PolarHBondContact O-N 2.83Å; L354-H356 PolarHBondContact O-N 3.15Å; L354-W357 PolarHBondContact O-N 2.93Å; L354-W357 VanDerWaalsContact O-N 3.11Å; L354-L358 HydrophobicContact CD1-CD1 4.3Å; L354-L358 HydrophobicContact CD1-CD2 4.36Å; L354-L358 HydrophobicContact CD1-CG 4.16Å; L354-L358 HydrophobicContact CG-CD1 4.16Å; L354-L358 HydrophobicContact CG-CG 4.36Å; L354-L358 VanDerWaalsContact O-CG 3.31Å; L354-L358 WeakPolarHBondContact O-CG 3.44Å; L354-L358 PolarHBondContact O-N 3.39Å; L354-I444 HydrophobicContact CD1-CG2 4.29Å; L354-I444 HydrophobicContact CD2-CG2 4.05Å; L354-V448 HydrophobicContact CD2-CB 4.15Å; L354-V448 HydrophobicContact CD2-CG1 4.02Å; L354-V448 HydrophobicContact CD2-CG2 3.75Å
355	A	95.7	Very high	92.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-54.4	-43.7	175.8	0	0	0	0	0	111.2	F351 I352 L358 A359 F412 T415 L416 I419	F351-A355 PolarHBondContact O-N 3.02Å; I352-A355 WeakPolarHBondContact O-CB 3.34Å; I352-A355 PolarHBondContact O-N 3.31Å; A355-L358 PolarHBondContact O-N 3.35Å; A355-A359 VanDerWaalsContact O-CB 3.3Å; A355-A359 WeakPolarHBondContact O-CB 3.37Å; A355-A359 PolarHBondContact O-N 3.45Å; A355-F412 HydrophobicContact CB-CD2 4.37Å; A355-F412 HydrophobicContact CB-CE2 3.67Å; A355-F412 HydrophobicContact CB-CZ 4.21Å; A355-T415 PolarHBondContact O-OG1 3.12Å; A355-L416 HydrophobicContact CB-CD1 4.3Å; A355-I419 HydrophobicContact CB-CD1 3.49Å; A355-I419 VanDerWaalsContact CB-CD1 3.49Å
356	H	95.8	Very high	92.8	Very high	7 Å²	7	36.1 Å²	36.1	3%	0.032	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-43.9	176.6	174.7	72.3	0	0	0	112.8	I224 I352 L353 L354 A359 C360 Y408 F412	I224-H356 PolarHBondContact O-NE2 3.32Å; I352-H356 WeakPolarHBondContact O-CB 3.12Å; I352-H356 PolarHBondContact O-N 3.02Å; L353-H356 WeakPolarHBondContact O-CB 3.35Å; L353-H356 PolarHBondContact O-N 3.45Å; L354-H356 PolarHBondContact O-N 3.15Å; H356-A359 WeakPolarHBondContact O-CB 3.43Å; H356-A359 PolarHBondContact O-N 2.88Å; H356-C360 PolarHBondContact O-N 3.09Å; H356-C360 PolarHBondContact O-SG 2.87Å; H356-Y408 AromaticContact CE1-CE2 3.76Å; H356-Y408 AromaticContact ND1-CE2 3.51Å; H356-Y408 AromaticContact ND1-CZ 3.69Å; H356-Y408 PolarHBondContact ND1-OH 3.13Å; H356-F412 HydrophobicContact CB-CE2 4.24Å
357	W	95.2	Very high	93	Very high	74 Å²	74	36.6 Å²	36.6	28%	0.28	19%	0.188	S	C	.	.	H	α-helix	trans	-64.8	-45	177.4	-69	2.5	0	0	0	112	C223 P227 L323 L326 L353 L354 A359 C360 V361	C223-W357 HydrophobicContact CB-CZ2 4.25Å; C223-W357 PolarHBondContact O-NE1 2.91Å; P227-W357 HydrophobicContact CG-CG 4.48Å; L323-W357 HydrophobicContact CD1-CZ2 4.48Å; L323-W357 HydrophobicContact CD2-CZ2 3.99Å; L326-W357 HydrophobicContact CD2-CH2 4.23Å; L353-W357 HydrophobicContact CD2-CZ2 4Å; L353-W357 HydrophobicContact CG-CZ2 4.19Å; L353-W357 PolarHBondContact O-N 3.12Å; L354-W357 PolarHBondContact O-N 2.93Å; L354-W357 VanDerWaalsContact O-N 3.11Å; W357-A359 VanDerWaalsContact C-N 3.27Å; W357-A359 PolarHBondContact O-N 3.35Å; W357-C360 PolarHBondContact O-N 3.03Å; W357-V361 WeakPolarHBondContact O-CG2 3.31Å; W357-V361 PolarHBondContact O-N 3.21Å
358	L	95.9	Very high	93.2	Very high	15 Å²	15	39.7 Å²	39.7	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-62.9	-36.8	176	-59.4	-178.1	0	0	0	110.8	L354 A355 C360 V361 W362 T415 I419 F441	L354-L358 HydrophobicContact CD1-CD1 4.3Å; L354-L358 HydrophobicContact CD1-CD2 4.36Å; L354-L358 HydrophobicContact CD1-CG 4.16Å; L354-L358 HydrophobicContact CG-CD1 4.16Å; L354-L358 HydrophobicContact CG-CG 4.36Å; L354-L358 VanDerWaalsContact O-CG 3.31Å; L354-L358 WeakPolarHBondContact O-CG 3.44Å; L354-L358 PolarHBondContact O-N 3.39Å; A355-L358 PolarHBondContact O-N 3.35Å; L358-C360 PolarHBondContact O-N 2.99Å; L358-V361 PolarHBondContact O-N 3.12Å; L358-W362 WeakPolarHBondContact O-CB 3.23Å; L358-W362 PolarHBondContact O-N 3.46Å; L358-T415 HydrophobicContact CB-CG2 3.99Å; L358-I419 HydrophobicContact CD1-CG2 3.64Å; L358-F441 HydrophobicContact CB-CD1 4.47Å; L358-F441 HydrophobicContact CB-CD2 4.39Å; L358-F441 HydrophobicContact CB-CE1 4.12Å; L358-F441 HydrophobicContact CB-CE2 4.03Å; L358-F441 HydrophobicContact CB-CZ 3.88Å; L358-F441 HydrophobicContact CD1-CD1 4.26Å; L358-F441 HydrophobicContact CD1-CG 4.3Å; L358-F441 HydrophobicContact CD2-CD1 3.75Å; L358-F441 HydrophobicContact CD2-CE1 3.54Å; L358-F441 HydrophobicContact CD2-CZ 4.17Å; L358-F441 HydrophobicContact CG-CD1 4.36Å; L358-F441 HydrophobicContact CG-CE1 4.27Å; L358-F441 WeakPolarHBondContact O-CZ 3.45Å
359	A	96.1	Very high	93.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-40.8	176.4	0	0	0	0	0	112	A355 H356 W357 V361 W362 Y363 F412 T415	A355-A359 VanDerWaalsContact O-CB 3.3Å; A355-A359 WeakPolarHBondContact O-CB 3.37Å; A355-A359 PolarHBondContact O-N 3.45Å; H356-A359 WeakPolarHBondContact O-CB 3.43Å; H356-A359 PolarHBondContact O-N 2.88Å; W357-A359 VanDerWaalsContact C-N 3.27Å; W357-A359 PolarHBondContact O-N 3.35Å; A359-V361 VanDerWaalsContact C-N 3.35Å; A359-W362 PolarHBondContact O-N 3.48Å; A359-Y363 PolarHBondContact O-N 2.87Å; A359-F412 HydrophobicContact CB-CB 4.13Å; A359-F412 HydrophobicContact CB-CD2 4.18Å; A359-T415 HydrophobicContact CB-CG2 4.37Å
360	C	94.3	Very high	93.1	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.027	17%	0.167	C	C	.	.	H	α-helix	trans	-63.4	-41.5	174.7	-63.9	0	0	0	0	111.3	P227 A231 H356 W357 L358 Y363 L364	P227-C360 HydrophobicContact CB-CB 4.19Å; A231-C360 HydrophobicContact CB-CB 3.82Å; H356-C360 PolarHBondContact O-N 3.09Å; H356-C360 PolarHBondContact O-SG 2.87Å; W357-C360 PolarHBondContact O-N 3.03Å; L358-C360 PolarHBondContact O-N 2.99Å; C360-Y363 PolarHBondContact O-N 3.4Å; C360-L364 WeakPolarHBondContact O-CG 3.33Å; C360-L364 PolarHBondContact O-N 3.41Å; C360-L364 VanDerWaalsContact O-N 3.08Å
361	V	93.8	Very high	93	Very high	65 Å²	65	36.1 Å²	36.1	39%	0.394	18%	0.175	S	C	.	.	H	α-helix	trans	-64.7	-43	174.8	173.6	0	0	0	0	111.3	W357 L358 A359 Y363 L364 I365 F441	W357-V361 WeakPolarHBondContact O-CG2 3.31Å; W357-V361 PolarHBondContact O-N 3.21Å; L358-V361 PolarHBondContact O-N 3.12Å; A359-V361 VanDerWaalsContact C-N 3.35Å; V361-Y363 VanDerWaalsContact C-N 3.31Å; V361-Y363 PolarHBondContact O-N 3.1Å; V361-L364 PolarHBondContact O-N 2.88Å; V361-I365 HydrophobicContact CG1-CD1 3.87Å; V361-I365 WeakPolarHBondContact O-CD1 3.4Å; V361-I365 WeakPolarHBondContact O-CG1 3.39Å; V361-I365 PolarHBondContact O-N 3.42Å; V361-I365 VanDerWaalsContact O-N 3.09Å; V361-F441 HydrophobicContact CB-CZ 4.11Å; V361-F441 HydrophobicContact CG1-CE1 4.26Å; V361-F441 HydrophobicContact CG1-CZ 3.96Å
362	W	95.6	Very high	92.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59	-42.9	177	-173.8	-107.7	0	0	0	112.3	L358 A359 I365 G366 W378 F414 T415 V427 A429 E434 F441	L358-W362 WeakPolarHBondContact O-CB 3.23Å; L358-W362 PolarHBondContact O-N 3.46Å; A359-W362 PolarHBondContact O-N 3.48Å; W362-I365 PolarHBondContact O-N 3.43Å; W362-G366 PolarHBondContact O-N 3.23Å; W362-G366 VanDerWaalsContact O-N 3.14Å; W362-W378 AromaticContact CD1-CE2 3.65Å; W362-W378 AromaticContact CD1-CZ2 3.79Å; W362-W378 AromaticContact CD1-NE1 3.82Å; W362-W378 AromaticContact CE2-CD1 3.56Å; W362-W378 AromaticContact CE2-CG 3.82Å; W362-W378 AromaticContact CE2-NE1 3.68Å; W362-W378 HydrophobicContact CZ2-CB 3.93Å; W362-W378 AromaticContact CZ2-CD1 3.52Å; W362-W378 HydrophobicContact CZ2-CD2 4.38Å; W362-W378 AromaticContact CZ2-CG 3.67Å; W362-W378 HydrophobicContact CZ2-CG 3.67Å; W362-W378 AromaticContact NE1-CD1 3.62Å; W362-W378 AromaticContact NE1-CD2 3.38Å; W362-W378 AromaticContact NE1-CE2 3.31Å; W362-W378 VanDerWaalsContact NE1-CE2 3.31Å; W362-W378 AromaticContact NE1-CE3 3.96Å; W362-W378 AromaticContact NE1-CG 3.62Å; W362-W378 AromaticContact NE1-CZ2 3.88Å; W362-W378 AromaticContact NE1-NE1 3.41Å; W362-W378 PolarHBondContact O-NE1 2.97Å; W362-F414 AromaticContact CD1-CD1 3.93Å; W362-F414 AromaticContact CD2-CD1 3.5Å; W362-F414 HydrophobicContact CD2-CD1 3.5Å; W362-F414 AromaticContact CD2-CE1 3.48Å; W362-F414 HydrophobicContact CD2-CE1 3.48Å; W362-F414 VanDerWaalsContact CD2-CE1 3.48Å; W362-F414 AromaticContact CE2-CD1 3.39Å; W362-F414 AromaticContact CE2-CE1 3.48Å; W362-F414 VanDerWaalsContact CE2-CE1 3.48Å; W362-F414 HydrophobicContact CE3-CD1 4.04Å; W362-F414 AromaticContact CE3-CE1 3.51Å; W362-F414 HydrophobicContact CE3-CE1 3.51Å; W362-F414 HydrophobicContact CE3-CZ 4.42Å; W362-F414 AromaticContact CG-CD1 3.84Å; W362-F414 HydrophobicContact CG-CD1 3.84Å; W362-F414 HydrophobicContact CG-CE1 4.25Å; W362-F414 HydrophobicContact CH2-CD1 4.31Å; W362-F414 AromaticContact CH2-CE1 3.55Å; W362-F414 HydrophobicContact CH2-CE1 3.55Å; W362-F414 AromaticContact CH2-CZ 3.69Å; W362-F414 HydrophobicContact CH2-CZ 3.69Å; W362-F414 AromaticContact CZ2-CD1 3.83Å; W362-F414 HydrophobicContact CZ2-CD1 3.83Å; W362-F414 AromaticContact CZ2-CE1 3.53Å; W362-F414 HydrophobicContact CZ2-CE1 3.53Å; W362-F414 HydrophobicContact CZ2-CE2 4.38Å; W362-F414 HydrophobicContact CZ2-CG 4.37Å; W362-F414 AromaticContact CZ2-CZ 3.82Å; W362-F414 HydrophobicContact CZ2-CZ 3.82Å; W362-F414 HydrophobicContact CZ3-CD1 4.41Å; W362-F414 AromaticContact CZ3-CE1 3.55Å; W362-F414 HydrophobicContact CZ3-CE1 3.55Å; W362-F414 HydrophobicContact CZ3-CZ 4.02Å; W362-F414 AromaticContact NE1-CD1 3.64Å; W362-T415 HydrophobicContact CB-CG2 4.03Å; W362-T415 HydrophobicContact CG-CG2 4.45Å; W362-V427 HydrophobicContact CZ2-CG1 4.4Å; W362-A429 HydrophobicContact CH2-CB 4.08Å; W362-E434 HydrophobicContact CH2-CB 3.78Å; W362-E434 HydrophobicContact CH2-CG 3.83Å; W362-E434 HydrophobicContact CZ2-CG 4.49Å; W362-E434 HydrophobicContact CZ3-CB 4.05Å; W362-E434 HydrophobicContact CZ3-CG 4.19Å; W362-F441 HydrophobicContact CB-CE2 4.17Å; W362-F441 HydrophobicContact CE3-CE2 4.11Å
363	Y	94.3	Very high	92.4	Very high	18 Å²	18	42.6 Å²	42.6	7%	0.071	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-47.4	174.5	176	-99.8	0	0	0	112.6	A231 F232 A359 C360 V361 I365 G366 M367 L407	A231-Y363 HydrophobicContact CB-CD1 4.08Å; A231-Y363 WeakPolarHBondContact O-CE1 3.22Å; F232-Y363 HydrophobicContact CD1-CD1 4.05Å; F232-Y363 HydrophobicContact CD1-CD2 4.21Å; F232-Y363 AromaticContact CD1-CE1 3.88Å; F232-Y363 HydrophobicContact CD1-CE1 3.88Å; F232-Y363 HydrophobicContact CD1-CE2 4.06Å; F232-Y363 HydrophobicContact CD1-CG 4.18Å; F232-Y363 AromaticContact CD1-CZ 3.87Å; F232-Y363 HydrophobicContact CD2-CD1 4.42Å; F232-Y363 AromaticContact CE1-CD1 3.85Å; F232-Y363 HydrophobicContact CE1-CD1 3.85Å; F232-Y363 AromaticContact CE1-CD2 3.46Å; F232-Y363 HydrophobicContact CE1-CD2 3.46Å; F232-Y363 VanDerWaalsContact CE1-CD2 3.46Å; F232-Y363 HydrophobicContact CE1-CE1 4.06Å; F232-Y363 AromaticContact CE1-CE2 3.71Å; F232-Y363 HydrophobicContact CE1-CE2 3.71Å; F232-Y363 AromaticContact CE1-CG 3.52Å; F232-Y363 HydrophobicContact CE1-CG 3.52Å; F232-Y363 AromaticContact CE1-CZ 3.98Å; F232-Y363 HydrophobicContact CE2-CD1 4.22Å; F232-Y363 HydrophobicContact CE2-CG 4.17Å; F232-Y363 HydrophobicContact CG-CD1 4.32Å; F232-Y363 HydrophobicContact CG-CE1 4.26Å; F232-Y363 AromaticContact CZ-CD1 3.92Å; F232-Y363 HydrophobicContact CZ-CD1 3.92Å; F232-Y363 AromaticContact CZ-CD2 3.85Å; F232-Y363 HydrophobicContact CZ-CD2 3.85Å; F232-Y363 AromaticContact CZ-CG 3.5Å; F232-Y363 HydrophobicContact CZ-CG 3.5Å; F232-Y363 VanDerWaalsContact CZ-CG 3.5Å; A359-Y363 PolarHBondContact O-N 2.87Å; C360-Y363 PolarHBondContact O-N 3.4Å; V361-Y363 VanDerWaalsContact C-N 3.31Å; V361-Y363 PolarHBondContact O-N 3.1Å; Y363-I365 VanDerWaalsContact C-N 3.27Å; Y363-I365 PolarHBondContact O-N 3Å; Y363-G366 PolarHBondContact O-N 3.46Å; Y363-G366 VanDerWaalsContact O-N 3.15Å; Y363-M367 HydrophobicContact CD1-CG 4.25Å; Y363-M367 HydrophobicContact CD2-CG 4.34Å; Y363-M367 HydrophobicContact CE1-CG 3.65Å; Y363-M367 HydrophobicContact CE2-CG 3.75Å; Y363-M367 HydrophobicContact CE2-SD 4.08Å; Y363-M367 PolarHBondContact O-N 3.24Å; Y363-L407 HydrophobicContact CD2-CB 4.28Å; Y363-L407 HydrophobicContact CE2-CB 4.1Å; Y363-L407 HydrophobicContact CE2-CD1 4.07Å; Y363-L407 HydrophobicContact CE2-CG 4.47Å
364	L	91.8	Very high	92.1	Very high	80 Å²	80	44.1 Å²	44.1	42%	0.419	21%	0.212	S	C	.	.	H	α-helix	trans	-58.2	-38.6	178.7	-75.6	170.7	0	0	0	112.5	A231 C360 V361 M367 H368	A231-L364 HydrophobicContact CB-CD1 4.43Å; A231-L364 HydrophobicContact CB-CD2 4.4Å; A231-L364 HydrophobicContact CB-CG 4.1Å; C360-L364 WeakPolarHBondContact O-CG 3.33Å; C360-L364 PolarHBondContact O-N 3.41Å; C360-L364 VanDerWaalsContact O-N 3.08Å; V361-L364 PolarHBondContact O-N 2.88Å; L364-M367 PolarHBondContact O-N 3.04Å; L364-H368 WeakPolarHBondContact O-CB 3.44Å; L364-H368 PolarHBondContact O-N 2.62Å
365	I	93.2	Very high	91.7	Very high	25 Å²	25	46.1 Å²	46.1	13%	0.128	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-44.6	177	-65	153.1	0	0	0	110.9	V361 W362 Y363 M367 H368 D369 E434 V437	V361-I365 HydrophobicContact CG1-CD1 3.87Å; V361-I365 WeakPolarHBondContact O-CD1 3.4Å; V361-I365 WeakPolarHBondContact O-CG1 3.39Å; V361-I365 PolarHBondContact O-N 3.42Å; V361-I365 VanDerWaalsContact O-N 3.09Å; W362-I365 PolarHBondContact O-N 3.43Å; Y363-I365 VanDerWaalsContact C-N 3.27Å; Y363-I365 PolarHBondContact O-N 3Å; I365-M367 VanDerWaalsContact C-N 3.29Å; I365-M367 PolarHBondContact O-N 2.79Å; I365-H368 WeakPolarHBondContact O-CB 3.47Å; I365-H368 PolarHBondContact O-N 2.96Å; I365-H368 VanDerWaalsContact O-N 3.15Å; I365-D369 PolarHBondContact O-N 3.35Å; I365-E434 HydrophobicContact CG2-CG 4.11Å; I365-V437 HydrophobicContact CD1-CB 3.74Å; I365-V437 HydrophobicContact CD1-CG1 3.5Å; I365-V437 HydrophobicContact CD1-CG2 3.52Å; I365-V437 HydrophobicContact CG1-CG2 4.5Å
366	G	92.3	Very high	91.3	Very high	3 Å²	3	51 Å²	51	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-40	176.9	0	0	0	0	0	112.5	W362 Y363 L370 W378	W362-G366 PolarHBondContact O-N 3.23Å; W362-G366 VanDerWaalsContact O-N 3.14Å; Y363-G366 PolarHBondContact O-N 3.46Å; Y363-G366 VanDerWaalsContact O-N 3.15Å; G366-L370 WeakPolarHBondContact O-CB 3.36Å; G366-L370 PolarHBondContact O-N 2.83Å; G366-W378 VanDerWaalsContact CA-NE1 3.34Å
367	M	89.8	Confident	91.1	Very high	40 Å²	40	50.8 Å²	50.8	20%	0.197	24%	0.241	C	C	.	.	H	α-helix	trans	-70.4	-32.9	175.9	-71.2	-56.5	-60.4	0	0	112.9	Y363 L364 I365 L370 K371 I379	Y363-M367 HydrophobicContact CD1-CG 4.25Å; Y363-M367 HydrophobicContact CD2-CG 4.34Å; Y363-M367 HydrophobicContact CE1-CG 3.65Å; Y363-M367 HydrophobicContact CE2-CG 3.75Å; Y363-M367 HydrophobicContact CE2-SD 4.08Å; Y363-M367 PolarHBondContact O-N 3.24Å; L364-M367 PolarHBondContact O-N 3.04Å; I365-M367 VanDerWaalsContact C-N 3.29Å; I365-M367 PolarHBondContact O-N 2.79Å; M367-L370 HydrophobicContact CE-CD2 4.27Å; M367-L370 HydrophobicContact SD-CD2 4.3Å; M367-K371 WeakPolarHBondContact O-CG 3.24Å; M367-K371 PolarHBondContact O-N 2.8Å; M367-K371 VanDerWaalsContact O-N 3.07Å; M367-I379 HydrophobicContact CG-CD1 4.25Å; M367-I379 HydrophobicContact SD-CD1 3.9Å
368	H	89.8	Confident	91	Very high	107 Å²	107	47.5 Å²	47.5	50%	0.495	23%	0.228	S	C	.	.	H	α-helix	trans	-67	-47.8	173.5	-172.7	-77.5	0	0	0	111.1	L364 I365 L370 K371 D372	L364-H368 WeakPolarHBondContact O-CB 3.44Å; L364-H368 PolarHBondContact O-N 2.62Å; I365-H368 WeakPolarHBondContact O-CB 3.47Å; I365-H368 PolarHBondContact O-N 2.96Å; I365-H368 VanDerWaalsContact O-N 3.15Å; H368-L370 PolarHBondContact O-N 2.79Å; H368-K371 WeakPolarHBondContact O-CB 3.42Å; H368-K371 PolarHBondContact O-N 2.76Å; H368-K371 VanDerWaalsContact O-N 3.07Å; H368-D372 IonicContact CE1-OD1 3.96Å; H368-D372 IonicContact CE1-OD2 2.92Å; H368-D372 PolarHBondContact CE1-OD2 3.3Å; H368-D372 IonicContact ND1-OD2 3.14Å; H368-D372 PolarHBondContact ND1-OD2 3.01Å; H368-D372 VanDerWaalsContact ND1-OD2 3.14Å; H368-D372 PolarHBondContact O-N 2.77Å
369	D	91.2	Very high	90.9	Very high	5 Å²	5	46.9 Å²	46.9	3%	0.027	23%	0.225	C	C	.	.	H	α-helix	trans	-59.7	-36.3	176.6	-74.8	2.8	0	0	0	111	I365 D372 K373 I374 T431 S433	I365-D369 PolarHBondContact O-N 3.35Å; D369-D372 PolarHBondContact O-N 2.8Å; D369-K373 PolarHBondContact O-N 2.58Å; D369-I374 HydrophobicContact CB-CB 4.27Å; D369-I374 HydrophobicContact CB-CD1 4.32Å; D369-I374 VanDerWaalsContact O-CB 3.32Å; D369-I374 WeakPolarHBondContact O-CB 3.34Å; D369-I374 PolarHBondContact O-N 2.96Å; D369-T431 WeakPolarHBondContact OD2-CB 3.42Å; D369-T431 VanDerWaalsContact OD2-CG2 3.32Å; D369-T431 WeakPolarHBondContact OD2-CG2 3.29Å; D369-T431 PolarHBondContact OD2-OG1 3.13Å; D369-S433 PolarHBondContact OD1-OG 2.96Å; D369-S433 PolarHBondContact OD2-OG 2.76Å
370	L	87.6	Confident	90.6	Very high	21 Å²	21	47 Å²	47	11%	0.11	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-42.7	173.7	-167.9	67.7	0	0	0	112.6	G366 M367 H368 D372 K373 I380 L397 L401	G366-L370 WeakPolarHBondContact O-CB 3.36Å; G366-L370 PolarHBondContact O-N 2.83Å; M367-L370 HydrophobicContact CE-CD2 4.27Å; M367-L370 HydrophobicContact SD-CD2 4.3Å; H368-L370 PolarHBondContact O-N 2.79Å; L370-D372 VanDerWaalsContact C-N 3.32Å; L370-D372 PolarHBondContact O-N 2.76Å; L370-K373 PolarHBondContact O-N 3.06Å; L370-K373 VanDerWaalsContact O-N 3.16Å; L370-I380 HydrophobicContact CD1-CD1 3.67Å; L370-I380 HydrophobicContact CD1-CG1 4.32Å; L370-L397 HydrophobicContact CD1-CD1 3.69Å; L370-L397 HydrophobicContact CD1-CD2 4Å; L370-L397 HydrophobicContact CD1-CG 4.29Å; L370-L397 HydrophobicContact CG-CD1 4.03Å; L370-L401 HydrophobicContact CD2-CD1 4.42Å
371	K	86.7	Confident	90.5	Very high	141 Å²	141	51 Å²	51	61%	0.613	24%	0.244	S	C	*	.	H	α-helix	trans	-65	-35.4	176.6	-75.8	175.8	-179.2	-179.6	0	112.1	M367 H368 K373	M367-K371 WeakPolarHBondContact O-CG 3.24Å; M367-K371 PolarHBondContact O-N 2.8Å; M367-K371 VanDerWaalsContact O-N 3.07Å; H368-K371 WeakPolarHBondContact O-CB 3.42Å; H368-K371 PolarHBondContact O-N 2.76Å; H368-K371 VanDerWaalsContact O-N 3.07Å; K371-K373 PolarHBondContact O-N 3.3Å
372	D	88	Confident	90.4	Very high	92 Å²	92	48.3 Å²	48.3	49%	0.492	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	5.5	175.7	-72.8	-10.9	0	0	0	113.5	H368 D369 L370 I374	H368-D372 IonicContact CE1-OD1 3.96Å; H368-D372 IonicContact CE1-OD2 2.92Å; H368-D372 PolarHBondContact CE1-OD2 3.3Å; H368-D372 IonicContact ND1-OD2 3.14Å; H368-D372 PolarHBondContact ND1-OD2 3.01Å; H368-D372 VanDerWaalsContact ND1-OD2 3.14Å; H368-D372 PolarHBondContact O-N 2.77Å; D369-D372 PolarHBondContact O-N 2.8Å; L370-D372 VanDerWaalsContact C-N 3.32Å; L370-D372 PolarHBondContact O-N 2.76Å; D372-I374 VanDerWaalsContact C-N 3.31Å; D372-I374 HydrophobicContact CB-CD1 4.09Å; D372-I374 HydrophobicContact CB-CG1 4.02Å; D372-I374 PolarHBondContact O-N 2.96Å
373	K	85.7	Confident	90.1	Very high	150 Å²	150	48.3 Å²	48.3	65%	0.652	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	34.8	-179.7	-54.8	179.9	-180	179.4	0	113.3	D369 L370 K371 Y375	D369-K373 PolarHBondContact O-N 2.58Å; L370-K373 PolarHBondContact O-N 3.06Å; L370-K373 VanDerWaalsContact O-N 3.16Å; K371-K373 PolarHBondContact O-N 3.3Å; K373-Y375 HydrophobicContact CB-CE2 4.18Å; K373-Y375 WeakPolarHBondContact O-CD2 3.42Å; K373-Y375 WeakPolarHBondContact O-CE2 3.44Å; K373-Y375 PolarHBondContact O-N 3.29Å
374	I	87.1	Confident	89.8	Confident	45 Å²	45	49.7 Å²	49.7	23%	0.231	24%	0.236	C	C	.	.			trans	-87.9	98.8	176.7	-55.2	178.4	0	0	0	109.6	D369 D372 H376 T431	D369-I374 HydrophobicContact CB-CB 4.27Å; D369-I374 HydrophobicContact CB-CD1 4.32Å; D369-I374 VanDerWaalsContact O-CB 3.32Å; D369-I374 WeakPolarHBondContact O-CB 3.34Å; D369-I374 PolarHBondContact O-N 2.96Å; D372-I374 VanDerWaalsContact C-N 3.31Å; D372-I374 HydrophobicContact CB-CD1 4.09Å; D372-I374 HydrophobicContact CB-CG1 4.02Å; D372-I374 PolarHBondContact O-N 2.96Å; I374-H376 WeakPolarHBondContact CG2-CE1 3.49Å; I374-H376 PolarHBondContact O-N 2.73Å; I374-H376 VanDerWaalsContact O-N 3.14Å; I374-T431 HydrophobicContact CG2-CG2 3.74Å
375	Y	85.7	Confident	89.6	Confident	77 Å²	77	52.4 Å²	52.4	30%	0.302	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	25.9	-174.2	-55	-67.4	0	0	0	115.7	K373 W392 T393 L397	K373-Y375 HydrophobicContact CB-CE2 4.18Å; K373-Y375 WeakPolarHBondContact O-CD2 3.42Å; K373-Y375 WeakPolarHBondContact O-CE2 3.44Å; K373-Y375 PolarHBondContact O-N 3.29Å; Y375-W392 HydrophobicContact CD1-CB 3.42Å; Y375-W392 VanDerWaalsContact CD1-CB 3.42Å; Y375-W392 HydrophobicContact CD1-CG 4.42Å; Y375-W392 HydrophobicContact CE1-CB 3.92Å; Y375-W392 HydrophobicContact CG-CB 3.98Å; Y375-T393 HydrophobicContact CD2-CG2 4.26Å; Y375-T393 HydrophobicContact CE2-CG2 4.11Å; Y375-L397 HydrophobicContact CE1-CD1 4.27Å; Y375-L397 HydrophobicContact CE1-CD2 4.26Å
376	H	87.8	Confident	89.3	Confident	101 Å²	101	54.7 Å²	54.7	47%	0.468	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.1	17.2	177	62.3	-88.2	0	0	0	113	I374 N430	I374-H376 WeakPolarHBondContact CG2-CE1 3.49Å; I374-H376 PolarHBondContact O-N 2.73Å; I374-H376 VanDerWaalsContact O-N 3.14Å; H376-N430 WeakPolarHBondContact O-CB 3.47Å
377	G	91.4	Very high	89	Confident	4 Å²	4	57.4 Å²	57.4	4%	0.041	28%	0.278	C	S	.	.	S	Bend	trans	-75.7	170.8	172.3	0	0	0	0	0	113.1	I379 I380 H381 E434	G377-I379 VanDerWaalsContact C-N 3.31Å; G377-I379 PolarHBondContact O-N 2.77Å; G377-I380 PolarHBondContact O-N 3.03Å; G377-H381 PolarHBondContact O-CD2 3.31Å; G377-H381 PolarHBondContact O-N 3.29Å; G377-H381 VanDerWaalsContact O-N 3.14Å; G377-E434 WeakPolarHBondContact CA-OE1 3.43Å
378	W	93.7	Very high	88.7	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.015	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-33.5	-174.8	78.1	-96.1	0	0	0	113.3	W362 G366 H381 L382 L407 T410 S411 V427 E434	W362-W378 AromaticContact CD1-CE2 3.65Å; W362-W378 AromaticContact CD1-CZ2 3.79Å; W362-W378 AromaticContact CD1-NE1 3.82Å; W362-W378 AromaticContact CE2-CD1 3.56Å; W362-W378 AromaticContact CE2-CG 3.82Å; W362-W378 AromaticContact CE2-NE1 3.68Å; W362-W378 HydrophobicContact CZ2-CB 3.93Å; W362-W378 AromaticContact CZ2-CD1 3.52Å; W362-W378 HydrophobicContact CZ2-CD2 4.38Å; W362-W378 AromaticContact CZ2-CG 3.67Å; W362-W378 HydrophobicContact CZ2-CG 3.67Å; W362-W378 AromaticContact NE1-CD1 3.62Å; W362-W378 AromaticContact NE1-CD2 3.38Å; W362-W378 AromaticContact NE1-CE2 3.31Å; W362-W378 VanDerWaalsContact NE1-CE2 3.31Å; W362-W378 AromaticContact NE1-CE3 3.96Å; W362-W378 AromaticContact NE1-CG 3.62Å; W362-W378 AromaticContact NE1-CZ2 3.88Å; W362-W378 AromaticContact NE1-NE1 3.41Å; W362-W378 PolarHBondContact O-NE1 2.97Å; G366-W378 VanDerWaalsContact CA-NE1 3.34Å; W378-H381 PolarHBondContact O-N 3.09Å; W378-L382 HydrophobicContact CZ3-CD2 4.06Å; W378-L382 PolarHBondContact O-N 2.71Å; W378-L407 HydrophobicContact CH2-CD2 4.16Å; W378-T410 HydrophobicContact CE3-CG2 4.46Å; W378-T410 HydrophobicContact CZ3-CG2 3.95Å; W378-S411 VanDerWaalsContact CH2-OG 3.24Å; W378-S411 WeakPolarHBondContact CH2-OG 3.46Å; W378-V427 HydrophobicContact CB-CG1 4.24Å; W378-V427 HydrophobicContact CE3-CG1 4.18Å; W378-E434 PolarHBondContact N-OE1 3.48Å
379	I	92.7	Very high	88.4	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-42.3	177.1	-62.8	-174	0	0	0	110.5	M367 G377 H381 L382 M383 L401 L407	M367-I379 HydrophobicContact CG-CD1 4.25Å; M367-I379 HydrophobicContact SD-CD1 3.9Å; G377-I379 VanDerWaalsContact C-N 3.31Å; G377-I379 PolarHBondContact O-N 2.77Å; I379-H381 VanDerWaalsContact C-N 3.33Å; I379-L382 WeakPolarHBondContact O-CB 3.46Å; I379-L382 PolarHBondContact O-N 3.36Å; I379-M383 HydrophobicContact CG2-CG 4.4Å; I379-M383 HydrophobicContact CG2-SD 3.96Å; I379-M383 VanDerWaalsContact O-CG 3.3Å; I379-M383 WeakPolarHBondContact O-CG 3.33Å; I379-M383 PolarHBondContact O-N 3.31Å; I379-L401 HydrophobicContact CG2-CD1 3.82Å; I379-L407 HydrophobicContact CG2-CD2 4.34Å
380	I	90.7	Very high	87.8	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.015	31%	0.311	C	S	.	.	H	α-helix	trans	-66.7	-38.7	178.5	-62.5	-66.1	0	0	0	110.7	L370 G377 L382 M383 N384 W392 L397	L370-I380 HydrophobicContact CD1-CD1 3.67Å; L370-I380 HydrophobicContact CD1-CG1 4.32Å; G377-I380 PolarHBondContact O-N 3.03Å; I380-L382 VanDerWaalsContact C-N 3.34Å; I380-L382 PolarHBondContact O-N 3.4Å; I380-M383 HydrophobicContact CD1-SD 3.92Å; I380-M383 PolarHBondContact O-N 3.3Å; I380-N384 PolarHBondContact O-N 2.94Å; I380-W392 HydrophobicContact CD1-CD2 4.38Å; I380-W392 HydrophobicContact CD1-CG 4.39Å; I380-W392 HydrophobicContact CG2-CD2 4.48Å; I380-W392 HydrophobicContact CG2-CG 4.18Å; I380-L397 HydrophobicContact CD1-CD2 4.16Å
381	H	90.6	Very high	87.5	Confident	86 Å²	86	65.1 Å²	65.1	40%	0.398	33%	0.333	S	S	.	.	H	α-helix	trans	-58.8	-45.6	171.1	-86.4	-81.5	0	0	0	111.7	G377 W378 I379 M383 N384 E385 N430	G377-H381 PolarHBondContact O-CD2 3.31Å; G377-H381 PolarHBondContact O-N 3.29Å; G377-H381 VanDerWaalsContact O-N 3.14Å; W378-H381 PolarHBondContact O-N 3.09Å; I379-H381 VanDerWaalsContact C-N 3.33Å; H381-M383 VanDerWaalsContact C-N 3.35Å; H381-M383 PolarHBondContact O-N 3.32Å; H381-N384 PolarHBondContact O-N 3.38Å; H381-E385 WeakPolarHBondContact O-CG 3.39Å; H381-E385 PolarHBondContact O-N 3.48Å; H381-N430 PolarHBondContact CD2-ND2 3.26Å; H381-N430 PolarHBondContact NE2-ND2 3.24Å
382	L	91.7	Very high	87.3	Confident	9 Å²	9	59 Å²	59	5%	0.047	31%	0.306	C	S	.	.	H	α-helix	trans	-62.8	-39	175.3	-178.7	66.9	0	0	0	112.6	W378 I379 I380 E385 T386 P402 M406 L407 T410	W378-L382 HydrophobicContact CZ3-CD2 4.06Å; W378-L382 PolarHBondContact O-N 2.71Å; I379-L382 WeakPolarHBondContact O-CB 3.46Å; I379-L382 PolarHBondContact O-N 3.36Å; I380-L382 VanDerWaalsContact C-N 3.34Å; I380-L382 PolarHBondContact O-N 3.4Å; L382-E385 PolarHBondContact O-N 3.18Å; L382-T386 HydrophobicContact CD1-CG2 4.34Å; L382-T386 WeakPolarHBondContact O-CB 3.44Å; L382-T386 WeakPolarHBondContact O-CG2 3.33Å; L382-T386 PolarHBondContact O-N 3.07Å; L382-T386 PolarHBondContact O-OG1 3.45Å; L382-P402 HydrophobicContact CD2-CG 4.14Å; L382-P402 HydrophobicContact CG-CG 4.29Å; L382-M406 HydrophobicContact CD1-CE 4.13Å; L382-L407 HydrophobicContact CD2-CD2 4.08Å; L382-T410 HydrophobicContact CD1-CG2 4.23Å; L382-T410 HydrophobicContact CD2-CG2 4.11Å
383	M	89.5	Confident	86.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-42.2	175.8	-72.4	168.5	78.4	0	0	111.6	I379 I380 H381 E385 T386 T387 W392 Y400 L401 P402	I379-M383 HydrophobicContact CG2-CG 4.4Å; I379-M383 HydrophobicContact CG2-SD 3.96Å; I379-M383 VanDerWaalsContact O-CG 3.3Å; I379-M383 WeakPolarHBondContact O-CG 3.33Å; I379-M383 PolarHBondContact O-N 3.31Å; I380-M383 HydrophobicContact CD1-SD 3.92Å; I380-M383 PolarHBondContact O-N 3.3Å; H381-M383 VanDerWaalsContact C-N 3.35Å; H381-M383 PolarHBondContact O-N 3.32Å; M383-E385 VanDerWaalsContact C-N 3.31Å; M383-E385 PolarHBondContact O-N 3.39Å; M383-T386 WeakPolarHBondContact CA-OG1 3.26Å; M383-T386 PolarHBondContact O-N 3.41Å; M383-T386 PolarHBondContact O-OG1 3.44Å; M383-T387 PolarHBondContact O-N 3.44Å; M383-T387 PolarHBondContact O-OG1 3.44Å; M383-W392 HydrophobicContact CB-CH2 3.77Å; M383-W392 HydrophobicContact CB-CZ2 3.79Å; M383-W392 HydrophobicContact CE-CE3 4.11Å; M383-W392 HydrophobicContact CE-CH2 3.66Å; M383-W392 HydrophobicContact CE-CZ3 3.41Å; M383-W392 VanDerWaalsContact CE-CZ3 3.41Å; M383-Y400 WeakPolarHBondContact CE-O 3.26Å; M383-L401 HydrophobicContact SD-CD1 4.28Å; M383-P402 HydrophobicContact CG-CG 4.16Å
384	N	88.9	Confident	86.3	Confident	47 Å²	47	58.2 Å²	58.2	25%	0.251	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-37.9	175.3	-76.4	-24.9	0	0	0	112	I380 H381 G388 W392	I380-N384 PolarHBondContact O-N 2.94Å; H381-N384 PolarHBondContact O-N 3.38Å; N384-G388 CarbonylContact O-C 3.21Å; N384-G388 WeakPolarHBondContact O-CA 3.23Å; N384-G388 PolarHBondContact O-N 3.25Å; N384-W392 VanDerWaalsContact OD1-CE2 3.29Å; N384-W392 WeakPolarHBondContact OD1-CZ2 3.39Å; N384-W392 PolarHBondContact OD1-NE1 3.28Å
385	E	87.6	Confident	85.7	Confident	137 Å²	137	58 Å²	58	64%	0.64	31%	0.312	S	S	*	.	H	α-helix	trans	-70.3	-36.5	176.9	-72.8	-176.2	169.5	0	0	112.8	H381 L382 M383	H381-E385 WeakPolarHBondContact O-CG 3.39Å; H381-E385 PolarHBondContact O-N 3.48Å; L382-E385 PolarHBondContact O-N 3.18Å; M383-E385 VanDerWaalsContact C-N 3.31Å; M383-E385 PolarHBondContact O-N 3.39Å
386	T	86.9	Confident	85.2	Confident	73 Å²	73	57.6 Å²	57.6	45%	0.448	32%	0.321	S	S	.	.	H	α-helix	trans	-85.8	-36.7	-175.6	48.8	0	0	0	0	113.8	L382 M383	L382-T386 HydrophobicContact CD1-CG2 4.34Å; L382-T386 WeakPolarHBondContact O-CB 3.44Å; L382-T386 WeakPolarHBondContact O-CG2 3.33Å; L382-T386 PolarHBondContact O-N 3.07Å; L382-T386 PolarHBondContact O-OG1 3.45Å; M383-T386 WeakPolarHBondContact CA-OG1 3.26Å; M383-T386 PolarHBondContact O-N 3.41Å; M383-T386 PolarHBondContact O-OG1 3.44Å
387	T	86.1	Confident	84.8	Confident	61 Å²	61	54.6 Å²	54.6	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-112.8	-6.1	-174.9	64.8	0	0	0	0	114.1	M383 Y400	M383-T387 PolarHBondContact O-N 3.44Å; M383-T387 PolarHBondContact O-OG1 3.44Å; T387-Y400 HydrophobicContact CG2-CD1 4.37Å
388	G	82.6	Confident	84	Confident	27 Å²	27	63.1 Å²	63.1	28%	0.278	35%	0.347	S	S	.	.			trans	88.6	160.9	-170.9	0	0	0	0	0	112.8	N384 K390	N384-G388 CarbonylContact O-C 3.21Å; N384-G388 WeakPolarHBondContact O-CA 3.23Å; N384-G388 PolarHBondContact O-N 3.25Å; G388-K390 PolarHBondContact O-N 3.06Å
389	P	83.4	Confident	83.2	Confident	120 Å²	120	69.5 Å²	69.5	78%	0.779	38%	0.377	S	S	*	.			trans	-67.5	123.8	-178.7	27.3	-33.5	0	0	0	111.1
390	K	79.9	Confident	82.7	Confident	82 Å²	82	72.2 Å²	72.2	36%	0.357	39%	0.387	S	S	.	.			trans	-126.3	160	177.4	-71.2	-171.3	176.4	-174.4	0	112.1	G388 W392 Y400	G388-K390 PolarHBondContact O-N 3.06Å; K390-W392 HydrophobicContact CB-CH2 4.22Å; K390-W392 HydrophobicContact CB-CZ2 4.11Å; K390-W392 HydrophobicContact CB-CZ3 4.48Å; K390-W392 VanDerWaalsContact O-CD1 3.28Å; K390-W392 PolarHBondContact O-N 3.04Å; K390-W392 PolarHBondContact O-NE1 3.33Å; K390-Y400 HydrophobicContact CD-CE1 4.35Å; K390-Y400 PolarHBondContact NZ-OH 3.4Å; K390-Y400 VanDerWaalsContact NZ-OH 3.17Å
391	N	81.7	Confident	82.4	Confident	106 Å²	106	74.8 Å²	74.8	57%	0.567	40%	0.401	S	S	*	.			trans	-82.6	99.4	172.1	-167	1.4	0	0	0	110.2	T393 T395	N391-T393 PolarHBondContact O-N 2.84Å; N391-T393 PolarHBondContact OD1-OG1 2.86Å; N391-T395 PolarHBondContact O-OG1 3.16Å
392	W	81.7	Confident	82.3	Confident	13 Å²	13	71.6 Å²	71.6	5%	0.049	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-71.6	-13.3	-172.8	-58.5	110	0	0	0	114.5	Y375 I380 M383 N384 K390 N394 L397 Y400	Y375-W392 HydrophobicContact CD1-CB 3.42Å; Y375-W392 VanDerWaalsContact CD1-CB 3.42Å; Y375-W392 HydrophobicContact CD1-CG 4.42Å; Y375-W392 HydrophobicContact CE1-CB 3.92Å; Y375-W392 HydrophobicContact CG-CB 3.98Å; I380-W392 HydrophobicContact CD1-CD2 4.38Å; I380-W392 HydrophobicContact CD1-CG 4.39Å; I380-W392 HydrophobicContact CG2-CD2 4.48Å; I380-W392 HydrophobicContact CG2-CG 4.18Å; M383-W392 HydrophobicContact CB-CH2 3.77Å; M383-W392 HydrophobicContact CB-CZ2 3.79Å; M383-W392 HydrophobicContact CE-CE3 4.11Å; M383-W392 HydrophobicContact CE-CH2 3.66Å; M383-W392 HydrophobicContact CE-CZ3 3.41Å; M383-W392 VanDerWaalsContact CE-CZ3 3.41Å; N384-W392 VanDerWaalsContact OD1-CE2 3.29Å; N384-W392 WeakPolarHBondContact OD1-CZ2 3.39Å; N384-W392 PolarHBondContact OD1-NE1 3.28Å; K390-W392 HydrophobicContact CB-CH2 4.22Å; K390-W392 HydrophobicContact CB-CZ2 4.11Å; K390-W392 HydrophobicContact CB-CZ3 4.48Å; K390-W392 VanDerWaalsContact O-CD1 3.28Å; K390-W392 PolarHBondContact O-N 3.04Å; K390-W392 PolarHBondContact O-NE1 3.33Å; W392-N394 VanDerWaalsContact C-N 3.3Å; W392-N394 PolarHBondContact O-N 2.63Å; W392-L397 HydrophobicContact CE3-CD2 4.01Å; W392-Y400 HydrophobicContact CZ3-CD2 4.42Å; W392-Y400 HydrophobicContact CZ3-CG 4.24Å
393	T	80.1	Confident	82.1	Confident	78 Å²	78	74.6 Å²	74.6	48%	0.479	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-68.1	-28.9	-178.4	61.7	0	0	0	0	113.6	Y375 N391	Y375-T393 HydrophobicContact CD2-CG2 4.26Å; Y375-T393 HydrophobicContact CE2-CG2 4.11Å; N391-T393 PolarHBondContact O-N 2.84Å; N391-T393 PolarHBondContact OD1-OG1 2.86Å
394	N	72.9	Confident	82	Confident	147 Å²	147	77.2 Å²	77.2	79%	0.786	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-115.3	9.3	-173.8	-67.7	1.3	0	0	0	113.2	W392	W392-N394 VanDerWaalsContact C-N 3.3Å; W392-N394 PolarHBondContact O-N 2.63Å
395	T	73.7	Confident	82	Confident	41 Å²	41	78.6 Å²	78.6	25%	0.252	44%	0.435	S	S	.	.	S	Bend	trans	-112	138.5	-171.1	-54.2	0	0	0	0	110.8	N391 L397 Y400	N391-T395 PolarHBondContact O-OG1 3.16Å; T395-L397 PolarHBondContact O-N 3.44Å; T395-Y400 HydrophobicContact CG2-CD2 3.44Å; T395-Y400 VanDerWaalsContact CG2-CD2 3.44Å; T395-Y400 HydrophobicContact CG2-CE2 3.2Å
396	S	76.7	Confident	82.2	Confident	68 Å²	68	75.8 Å²	75.8	48%	0.476	42%	0.423	S	S	.	.			trans	-62	101.9	169.6	34.4	0	0	0	0	110.4	E398 E399 Y400	S396-E398 PolarHBondContact O-N 2.96Å; S396-E399 PolarHBondContact O-N 2.91Å; S396-E399 PolarHBondContact OG-OE2 2.94Å; S396-Y400 WeakPolarHBondContact O-CD2 3.37Å
397	L	78.6	Confident	82.5	Confident	37 Å²	37	72.4 Å²	72.4	19%	0.194	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-58.1	-33.5	-176.8	-67	167.8	0	0	0	113.3	L370 Y375 I380 W392 T395 E399 Y400 L401	L370-L397 HydrophobicContact CD1-CD1 3.69Å; L370-L397 HydrophobicContact CD1-CD2 4Å; L370-L397 HydrophobicContact CD1-CG 4.29Å; L370-L397 HydrophobicContact CG-CD1 4.03Å; Y375-L397 HydrophobicContact CE1-CD1 4.27Å; Y375-L397 HydrophobicContact CE1-CD2 4.26Å; I380-L397 HydrophobicContact CD1-CD2 4.16Å; W392-L397 HydrophobicContact CE3-CD2 4.01Å; T395-L397 PolarHBondContact O-N 3.44Å; L397-E399 VanDerWaalsContact C-N 3.31Å; L397-E399 PolarHBondContact O-N 3.38Å; L397-Y400 PolarHBondContact O-N 2.95Å; L397-L401 PolarHBondContact O-N 3.28Å
398	E	74.8	Confident	82.9	Confident	184 Å²	184	71.9 Å²	71.9	86%	0.86	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-64.6	-31.7	-176.9	-65.7	176.8	179.4	0	0	113.2	S396 Y400	S396-E398 PolarHBondContact O-N 2.96Å; E398-Y400 VanDerWaalsContact C-N 3.34Å; E398-Y400 PolarHBondContact O-N 3.46Å
399	E	76.5	Confident	83.5	Confident	138 Å²	138	76.3 Å²	76.3	65%	0.645	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-74.8	-26.6	-177.2	-170.9	178.4	178.7	0	0	112.7	S396 L397	S396-E399 PolarHBondContact O-N 2.91Å; S396-E399 PolarHBondContact OG-OE2 2.94Å; L397-E399 VanDerWaalsContact C-N 3.31Å; L397-E399 PolarHBondContact O-N 3.38Å
400	Y	82.3	Confident	84.1	Confident	60 Å²	60	71.2 Å²	71.2	24%	0.235	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-104.2	3.8	-175.5	-64.3	-75.5	0	0	0	113.3	M383 T387 K390 W392 T395 S396 L397 E398	M383-Y400 WeakPolarHBondContact CE-O 3.26Å; T387-Y400 HydrophobicContact CG2-CD1 4.37Å; K390-Y400 HydrophobicContact CD-CE1 4.35Å; K390-Y400 PolarHBondContact NZ-OH 3.4Å; K390-Y400 VanDerWaalsContact NZ-OH 3.17Å; W392-Y400 HydrophobicContact CZ3-CD2 4.42Å; W392-Y400 HydrophobicContact CZ3-CG 4.24Å; T395-Y400 HydrophobicContact CG2-CD2 3.44Å; T395-Y400 VanDerWaalsContact CG2-CD2 3.44Å; T395-Y400 HydrophobicContact CG2-CE2 3.2Å; S396-Y400 WeakPolarHBondContact O-CD2 3.37Å; L397-Y400 PolarHBondContact O-N 2.95Å; E398-Y400 VanDerWaalsContact C-N 3.34Å; E398-Y400 PolarHBondContact O-N 3.46Å
401	L	84.8	Confident	84.8	Confident	57 Å²	57	67.3 Å²	67.3	30%	0.298	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-69.5	129.4	-178.8	-164.7	68.4	0	0	0	109.6	L370 I379 M383 L397 L407	L370-L401 HydrophobicContact CD2-CD1 4.42Å; I379-L401 HydrophobicContact CG2-CD1 3.82Å; M383-L401 HydrophobicContact SD-CD1 4.28Å; L397-L401 PolarHBondContact O-N 3.28Å; L401-L407 HydrophobicContact CD1-CD1 4.39Å; L401-L407 HydrophobicContact CD2-CD1 4.23Å; L401-L407 HydrophobicContact CG-CD1 4.03Å
402	P	87.2	Confident	85.5	Confident	19 Å²	19	64.3 Å²	64.3	12%	0.123	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-60.4	160.2	178.3	-22.4	33.5	0	0	0	111.7	L382 M383 M406 L407	L382-P402 HydrophobicContact CD2-CG 4.14Å; L382-P402 HydrophobicContact CG-CG 4.29Å; M383-P402 HydrophobicContact CG-CG 4.16Å; P402-M406 HydrophobicContact CB-CB 4.23Å; P402-M406 HydrophobicContact CB-CG 4.29Å; P402-L407 HydrophobicContact CB-CG 4.29Å; P402-L407 HydrophobicContact CG-CD2 4.44Å; P402-L407 VanDerWaalsContact O-CD1 3.3Å; P402-L407 WeakPolarHBondContact O-CD1 3.27Å
403	S	88.6	Confident	86.1	Confident	72 Å²	72	67.4 Å²	67.4	50%	0.503	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-55.4	146.4	176.6	64.3	0	0	0	0	111.8	S405 M406 L407	S403-S405 PolarHBondContact O-N 3.38Å; S403-S405 VanDerWaalsContact O-N 3.14Å; S403-S405 PolarHBondContact OG-OG 3.16Å; S403-S405 VanDerWaalsContact OG-OG 3.1Å; S403-M406 WeakPolarHBondContact O-CA 3.25Å; S403-M406 WeakPolarHBondContact O-CB 3.32Å; S403-M406 PolarHBondContact O-N 3.23Å; S403-M406 PolarHBondContact OG-N 2.86Å; S403-L407 PolarHBondContact O-N 3.06Å
404	Q	86.6	Confident	86.9	Confident	55 Å²	55	64.2 Å²	64.2	26%	0.257	33%	0.331	S	S	.	.	H	α-helix	trans	-55.5	-34.7	-179.9	-68.8	-177.2	-13.3	0	0	112.4	D235 L407 Y408	D235-Q404 PolarHBondContact OD2-NE2 3.37Å; Q404-L407 PolarHBondContact O-N 3.34Å; Q404-Y408 WeakPolarHBondContact O-CB 3.44Å; Q404-Y408 PolarHBondContact O-N 2.92Å
405	S	90.1	Very high	88	Confident	76 Å²	76	57.2 Å²	57.2	53%	0.531	29%	0.294	S	S	.	.	H	α-helix	trans	-62.8	-41.4	174.1	55.5	0	0	0	0	112.3	S403 M409	S403-S405 PolarHBondContact O-N 3.38Å; S403-S405 VanDerWaalsContact O-N 3.14Å; S403-S405 PolarHBondContact OG-OG 3.16Å; S403-S405 VanDerWaalsContact OG-OG 3.1Å; S405-M409 WeakPolarHBondContact O-CB 3.43Å; S405-M409 WeakPolarHBondContact O-CG 3.43Å; S405-M409 PolarHBondContact O-N 3.1Å
406	M	92.3	Very high	89	Confident	78 Å²	78	58 Å²	58	38%	0.384	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-45.6	177.8	-172.6	65.7	-175.6	0	0	110.7	L382 P402 S403 Y408 M409 T410	L382-M406 HydrophobicContact CD1-CE 4.13Å; P402-M406 HydrophobicContact CB-CB 4.23Å; P402-M406 HydrophobicContact CB-CG 4.29Å; S403-M406 WeakPolarHBondContact O-CA 3.25Å; S403-M406 WeakPolarHBondContact O-CB 3.32Å; S403-M406 PolarHBondContact O-N 3.23Å; S403-M406 PolarHBondContact OG-N 2.86Å; M406-Y408 VanDerWaalsContact C-N 3.34Å; M406-Y408 PolarHBondContact O-N 2.93Å; M406-M409 PolarHBondContact O-N 3.36Å; M406-T410 WeakPolarHBondContact O-CB 3.39Å; M406-T410 PolarHBondContact O-N 3.35Å; M406-T410 PolarHBondContact O-OG1 3.14Å
407	L	93.2	Very high	89.8	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-44.2	178.1	-71.3	163	0	0	0	112.1	F232 Y363 W378 I379 L382 L401 P402 S403 Q404 S411	F232-L407 HydrophobicContact CE1-CB 4.28Å; Y363-L407 HydrophobicContact CD2-CB 4.28Å; Y363-L407 HydrophobicContact CE2-CB 4.1Å; Y363-L407 HydrophobicContact CE2-CD1 4.07Å; Y363-L407 HydrophobicContact CE2-CG 4.47Å; W378-L407 HydrophobicContact CH2-CD2 4.16Å; I379-L407 HydrophobicContact CG2-CD2 4.34Å; L382-L407 HydrophobicContact CD2-CD2 4.08Å; L401-L407 HydrophobicContact CD1-CD1 4.39Å; L401-L407 HydrophobicContact CD2-CD1 4.23Å; L401-L407 HydrophobicContact CG-CD1 4.03Å; P402-L407 HydrophobicContact CB-CG 4.29Å; P402-L407 HydrophobicContact CG-CD2 4.44Å; P402-L407 VanDerWaalsContact O-CD1 3.3Å; P402-L407 WeakPolarHBondContact O-CD1 3.27Å; S403-L407 PolarHBondContact O-N 3.06Å; Q404-L407 PolarHBondContact O-N 3.34Å; L407-S411 WeakPolarHBondContact O-CB 3.48Å; L407-S411 PolarHBondContact O-N 3.46Å; L407-S411 PolarHBondContact O-OG 2.98Å
408	Y	94.3	Very high	90.6	Very high	51 Å²	51	54.4 Å²	54.4	20%	0.2	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-50.6	175.2	174	-102.6	0	0	0	111.8	Y228 F232 H356 Q404 M406 T410 S411 F412	Y228-Y408 HydrophobicContact CD2-CD2 4.11Å; Y228-Y408 HydrophobicContact CD2-CE2 4.32Å; Y228-Y408 HydrophobicContact CE2-CD2 4.19Å; Y228-Y408 HydrophobicContact CE2-CG 4.39Å; F232-Y408 AromaticContact CE2-CD2 3.78Å; F232-Y408 HydrophobicContact CE2-CD2 3.78Å; F232-Y408 AromaticContact CZ-CD2 3.85Å; F232-Y408 HydrophobicContact CZ-CD2 3.85Å; F232-Y408 HydrophobicContact CZ-CG 4.37Å; H356-Y408 AromaticContact CE1-CE2 3.76Å; H356-Y408 AromaticContact ND1-CE2 3.51Å; H356-Y408 AromaticContact ND1-CZ 3.69Å; H356-Y408 PolarHBondContact ND1-OH 3.13Å; Q404-Y408 WeakPolarHBondContact O-CB 3.44Å; Q404-Y408 PolarHBondContact O-N 2.92Å; M406-Y408 VanDerWaalsContact C-N 3.34Å; M406-Y408 PolarHBondContact O-N 2.93Å; Y408-T410 VanDerWaalsContact C-N 3.33Å; Y408-T410 PolarHBondContact O-N 3.28Å; Y408-S411 PolarHBondContact O-N 3.42Å; Y408-F412 VanDerWaalsContact O-CB 3.31Å; Y408-F412 WeakPolarHBondContact O-CB 3.45Å; Y408-F412 PolarHBondContact O-N 3.31Å
409	M	94.5	Very high	91.5	Very high	119 Å²	119	45.8 Å²	45.8	59%	0.586	23%	0.233	S	C	*	.	H	α-helix	trans	-63.2	-39.7	-177.7	-69.8	-67.1	-96.6	0	0	111.8	S405 M406 F412 Y413	S405-M409 WeakPolarHBondContact O-CB 3.43Å; S405-M409 WeakPolarHBondContact O-CG 3.43Å; S405-M409 PolarHBondContact O-N 3.1Å; M406-M409 PolarHBondContact O-N 3.36Å; M409-F412 PolarHBondContact O-N 2.99Å; M409-Y413 WeakPolarHBondContact O-CB 3.26Å; M409-Y413 PolarHBondContact O-N 3.21Å
410	T	95	Very high	92.4	Very high	13 Å²	13	40.4 Å²	40.4	8%	0.08	21%	0.21	C	C	.	.	H	α-helix	trans	-67.2	-41.8	175.6	-59.4	0	0	0	0	111.9	W378 L382 M406 Y408 Y413 F414 V427	W378-T410 HydrophobicContact CE3-CG2 4.46Å; W378-T410 HydrophobicContact CZ3-CG2 3.95Å; L382-T410 HydrophobicContact CD1-CG2 4.23Å; L382-T410 HydrophobicContact CD2-CG2 4.11Å; M406-T410 WeakPolarHBondContact O-CB 3.39Å; M406-T410 PolarHBondContact O-N 3.35Å; M406-T410 PolarHBondContact O-OG1 3.14Å; Y408-T410 VanDerWaalsContact C-N 3.33Å; Y408-T410 PolarHBondContact O-N 3.28Å; T410-Y413 PolarHBondContact O-N 3.4Å; T410-F414 WeakPolarHBondContact O-CB 3.47Å; T410-F414 PolarHBondContact O-N 2.78Å; T410-V427 HydrophobicContact CG2-CG2 3.46Å; T410-V427 VanDerWaalsContact CG2-CG2 3.46Å
411	S	95.4	Very high	92.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-42.3	176.1	-57.8	0	0	0	0	111.8	W378 L407 Y408 T415	W378-S411 VanDerWaalsContact CH2-OG 3.24Å; W378-S411 WeakPolarHBondContact CH2-OG 3.46Å; L407-S411 WeakPolarHBondContact O-CB 3.48Å; L407-S411 PolarHBondContact O-N 3.46Å; L407-S411 PolarHBondContact O-OG 2.98Å; Y408-S411 PolarHBondContact O-N 3.42Å; S411-T415 WeakPolarHBondContact O-CG2 3.45Å; S411-T415 PolarHBondContact O-N 2.66Å; S411-T415 PolarHBondContact O-OG1 2.62Å
412	F	95.8	Very high	93.3	Very high	44 Å²	44	44.3 Å²	44.3	19%	0.193	24%	0.241	C	C	.	.	H	α-helix	trans	-67.1	-41.8	176.6	-172.9	-104.3	0	0	0	111.6	I352 A355 H356 A359 Y408 M409 T415 L416	I352-F412 HydrophobicContact CG2-CZ 4.46Å; A355-F412 HydrophobicContact CB-CD2 4.37Å; A355-F412 HydrophobicContact CB-CE2 3.67Å; A355-F412 HydrophobicContact CB-CZ 4.21Å; H356-F412 HydrophobicContact CB-CE2 4.24Å; A359-F412 HydrophobicContact CB-CB 4.13Å; A359-F412 HydrophobicContact CB-CD2 4.18Å; Y408-F412 VanDerWaalsContact O-CB 3.31Å; Y408-F412 WeakPolarHBondContact O-CB 3.45Å; Y408-F412 PolarHBondContact O-N 3.31Å; M409-F412 PolarHBondContact O-N 2.99Å; F412-T415 WeakPolarHBondContact CA-OG1 3.46Å; F412-T415 PolarHBondContact O-OG1 2.77Å; F412-T415 VanDerWaalsContact O-OG1 3.09Å; F412-L416 HydrophobicContact CE1-CD2 4.23Å; F412-L416 WeakPolarHBondContact O-CB 3.33Å; F412-L416 PolarHBondContact O-N 3.34Å
413	Y	95.5	Very high	93.5	Very high	78 Å²	78	45.7 Å²	45.7	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-59.2	-48.7	174	165.9	-102.6	0	0	0	111.9	M409 T410 L416 S417 F424 N426 V427	M409-Y413 WeakPolarHBondContact O-CB 3.26Å; M409-Y413 PolarHBondContact O-N 3.21Å; T410-Y413 PolarHBondContact O-N 3.4Å; Y413-L416 PolarHBondContact O-N 3.42Å; Y413-S417 WeakPolarHBondContact O-CB 3.45Å; Y413-S417 PolarHBondContact O-N 2.99Å; Y413-F424 AromaticContact CE2-CD2 3.62Å; Y413-F424 HydrophobicContact CE2-CD2 3.62Å; Y413-F424 AromaticContact CE2-CE2 3.85Å; Y413-F424 HydrophobicContact CE2-CE2 3.85Å; Y413-F424 AromaticContact CZ-CD2 3.56Å; Y413-F424 WeakPolarHBondContact OH-CB 3.26Å; Y413-F424 WeakPolarHBondContact OH-CD2 3.42Å; Y413-F424 VanDerWaalsContact OH-CG 3.22Å; Y413-F424 WeakPolarHBondContact OH-CG 3.47Å; Y413-N426 HydrophobicContact CE1-CB 4.45Å; Y413-N426 PolarHBondContact OH-ND2 3.16Å; Y413-V427 HydrophobicContact CD1-CG2 4.45Å
414	F	95.4	Very high	93.7	Very high	10 Å²	10	47.9 Å²	47.9	4%	0.044	26%	0.26	C	S	.	.	H	α-helix	trans	-58.7	-54.5	178.2	171.7	-106.7	0	0	0	110.8	W362 T410 L416 S417 V418 V427	W362-F414 AromaticContact CD1-CD1 3.93Å; W362-F414 AromaticContact CD2-CD1 3.5Å; W362-F414 HydrophobicContact CD2-CD1 3.5Å; W362-F414 AromaticContact CD2-CE1 3.48Å; W362-F414 HydrophobicContact CD2-CE1 3.48Å; W362-F414 VanDerWaalsContact CD2-CE1 3.48Å; W362-F414 AromaticContact CE2-CD1 3.39Å; W362-F414 AromaticContact CE2-CE1 3.48Å; W362-F414 VanDerWaalsContact CE2-CE1 3.48Å; W362-F414 HydrophobicContact CE3-CD1 4.04Å; W362-F414 AromaticContact CE3-CE1 3.51Å; W362-F414 HydrophobicContact CE3-CE1 3.51Å; W362-F414 HydrophobicContact CE3-CZ 4.42Å; W362-F414 AromaticContact CG-CD1 3.84Å; W362-F414 HydrophobicContact CG-CD1 3.84Å; W362-F414 HydrophobicContact CG-CE1 4.25Å; W362-F414 HydrophobicContact CH2-CD1 4.31Å; W362-F414 AromaticContact CH2-CE1 3.55Å; W362-F414 HydrophobicContact CH2-CE1 3.55Å; W362-F414 AromaticContact CH2-CZ 3.69Å; W362-F414 HydrophobicContact CH2-CZ 3.69Å; W362-F414 AromaticContact CZ2-CD1 3.83Å; W362-F414 HydrophobicContact CZ2-CD1 3.83Å; W362-F414 AromaticContact CZ2-CE1 3.53Å; W362-F414 HydrophobicContact CZ2-CE1 3.53Å; W362-F414 HydrophobicContact CZ2-CE2 4.38Å; W362-F414 HydrophobicContact CZ2-CG 4.37Å; W362-F414 AromaticContact CZ2-CZ 3.82Å; W362-F414 HydrophobicContact CZ2-CZ 3.82Å; W362-F414 HydrophobicContact CZ3-CD1 4.41Å; W362-F414 AromaticContact CZ3-CE1 3.55Å; W362-F414 HydrophobicContact CZ3-CE1 3.55Å; W362-F414 HydrophobicContact CZ3-CZ 4.02Å; W362-F414 AromaticContact NE1-CD1 3.64Å; T410-F414 WeakPolarHBondContact O-CB 3.47Å; T410-F414 PolarHBondContact O-N 2.78Å; F414-L416 PolarHBondContact O-N 2.99Å; F414-S417 PolarHBondContact O-N 3.36Å; F414-S417 VanDerWaalsContact O-N 3.11Å; F414-S417 PolarHBondContact O-OG 2.66Å; F414-V418 HydrophobicContact CD1-CG2 4.48Å; F414-V418 HydrophobicContact CD2-CG2 4.18Å; F414-V418 HydrophobicContact CE1-CG2 4.06Å; F414-V418 HydrophobicContact CE2-CG2 3.74Å; F414-V418 HydrophobicContact CZ-CG2 3.68Å; F414-V418 WeakPolarHBondContact O-CG2 3.34Å; F414-V418 PolarHBondContact O-N 3.44Å; F414-V427 HydrophobicContact CB-CB 4.08Å; F414-V427 HydrophobicContact CB-CG1 3.94Å; F414-V427 HydrophobicContact CD2-CB 3.89Å; F414-V427 HydrophobicContact CD2-CG1 3.83Å; F414-V427 VanDerWaalsContact CD2-O 3.23Å; F414-V427 WeakPolarHBondContact CD2-O 3.5Å; F414-V427 WeakPolarHBondContact CE2-O 3.26Å; F414-V427 HydrophobicContact CG-CB 4.29Å; F414-V427 HydrophobicContact CG-CG1 3.95Å
415	T	96	Very high	93.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-40.5	-177.1	51.7	0	0	0	0	112.5	A355 L358 A359 W362 S411 F412 S417 V418 I419 F441	A355-T415 PolarHBondContact O-OG1 3.12Å; L358-T415 HydrophobicContact CB-CG2 3.99Å; A359-T415 HydrophobicContact CB-CG2 4.37Å; W362-T415 HydrophobicContact CB-CG2 4.03Å; W362-T415 HydrophobicContact CG-CG2 4.45Å; S411-T415 WeakPolarHBondContact O-CG2 3.45Å; S411-T415 PolarHBondContact O-N 2.66Å; S411-T415 PolarHBondContact O-OG1 2.62Å; F412-T415 WeakPolarHBondContact CA-OG1 3.46Å; F412-T415 PolarHBondContact O-OG1 2.77Å; F412-T415 VanDerWaalsContact O-OG1 3.09Å; T415-S417 VanDerWaalsContact C-N 3.35Å; T415-S417 PolarHBondContact O-N 2.65Å; T415-V418 PolarHBondContact O-N 2.81Å; T415-I419 WeakPolarHBondContact O-CG1 3.34Å; T415-I419 WeakPolarHBondContact O-CG2 3.22Å; T415-I419 PolarHBondContact O-N 3.28Å; T415-F441 HydrophobicContact CG2-CD2 4.04Å; T415-F441 HydrophobicContact CG2-CE2 3.72Å
416	L	94.7	Very high	93.8	Very high	59 Å²	59	49.2 Å²	49.2	31%	0.309	28%	0.275	S	S	.	.	H	α-helix	trans	-60	-44.7	173.1	-171.3	63.3	0	0	0	111.1	F351 A355 F412 Y413 F414 V418 I419 T420	F351-L416 HydrophobicContact CE1-CD1 3.93Å; F351-L416 HydrophobicContact CZ-CD1 4.45Å; A355-L416 HydrophobicContact CB-CD1 4.3Å; F412-L416 HydrophobicContact CE1-CD2 4.23Å; F412-L416 WeakPolarHBondContact O-CB 3.33Å; F412-L416 PolarHBondContact O-N 3.34Å; Y413-L416 PolarHBondContact O-N 3.42Å; F414-L416 PolarHBondContact O-N 2.99Å; L416-V418 VanDerWaalsContact C-N 3.31Å; L416-V418 PolarHBondContact O-N 3.45Å; L416-I419 HydrophobicContact CD1-CD1 4.18Å; L416-I419 HydrophobicContact CD1-CG1 4.45Å; L416-I419 WeakPolarHBondContact O-CG1 3.36Å; L416-I419 PolarHBondContact O-N 3.46Å; L416-T420 HydrophobicContact CD1-CG2 4.11Å; L416-T420 HydrophobicContact CG-CG2 4.41Å; L416-T420 VanDerWaalsContact O-CB 3.31Å; L416-T420 WeakPolarHBondContact O-CB 3.41Å; L416-T420 VanDerWaalsContact O-CG2 3.28Å; L416-T420 WeakPolarHBondContact O-CG2 3.45Å; L416-T420 PolarHBondContact O-N 2.71Å; L416-T420 PolarHBondContact O-OG1 3.47Å
417	S	95.2	Very high	93.8	Very high	7 Å²	7	46.4 Å²	46.4	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-33.6	177.9	80.5	0	0	0	0	113.4	Y413 F414 T415 T420 S421 I422 G423	Y413-S417 WeakPolarHBondContact O-CB 3.45Å; Y413-S417 PolarHBondContact O-N 2.99Å; F414-S417 PolarHBondContact O-N 3.36Å; F414-S417 VanDerWaalsContact O-N 3.11Å; F414-S417 PolarHBondContact O-OG 2.66Å; T415-S417 VanDerWaalsContact C-N 3.35Å; T415-S417 PolarHBondContact O-N 2.65Å; S417-T420 PolarHBondContact O-OG1 3.46Å; S417-S421 PolarHBondContact O-N 3.4Å; S417-I422 PolarHBondContact O-N 3.16Å; S417-G423 PolarHBondContact O-N 3.25Å; S417-G423 VanDerWaalsContact O-N 3.08Å
418	V	94.6	Very high	93.7	Very high	22 Å²	22	48.4 Å²	48.4	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-73.2	-50	177.3	171.5	0	0	0	0	110.9	F414 T415 L416 T420 S421 F441 M442	F414-V418 HydrophobicContact CD1-CG2 4.48Å; F414-V418 HydrophobicContact CD2-CG2 4.18Å; F414-V418 HydrophobicContact CE1-CG2 4.06Å; F414-V418 HydrophobicContact CE2-CG2 3.74Å; F414-V418 HydrophobicContact CZ-CG2 3.68Å; F414-V418 WeakPolarHBondContact O-CG2 3.34Å; F414-V418 PolarHBondContact O-N 3.44Å; T415-V418 PolarHBondContact O-N 2.81Å; L416-V418 VanDerWaalsContact C-N 3.31Å; L416-V418 PolarHBondContact O-N 3.45Å; V418-T420 VanDerWaalsContact C-N 3.29Å; V418-T420 PolarHBondContact O-N 3.22Å; V418-S421 PolarHBondContact O-N 2.76Å; V418-S421 VanDerWaalsContact O-N 3.08Å; V418-F441 HydrophobicContact CG1-CB 3.88Å; V418-M442 HydrophobicContact CG1-CB 4.48Å; V418-M442 HydrophobicContact CG1-CG 3.61Å
419	I	94.5	Very high	93.7	Very high	2 Å²	2	47 Å²	47	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-71.5	-24	-177.5	67.5	-179.1	0	0	0	113.1	F351 A355 L358 T415 L416 S421	F351-I419 HydrophobicContact CD2-CD1 4.35Å; F351-I419 HydrophobicContact CE1-CD1 4.15Å; F351-I419 HydrophobicContact CE2-CB 4.4Å; F351-I419 HydrophobicContact CE2-CD1 3.68Å; F351-I419 HydrophobicContact CE2-CG1 3.92Å; F351-I419 HydrophobicContact CZ-CD1 3.58Å; F351-I419 HydrophobicContact CZ-CG1 3.67Å; A355-I419 HydrophobicContact CB-CD1 3.49Å; A355-I419 VanDerWaalsContact CB-CD1 3.49Å; L358-I419 HydrophobicContact CD1-CG2 3.64Å; T415-I419 WeakPolarHBondContact O-CG1 3.34Å; T415-I419 WeakPolarHBondContact O-CG2 3.22Å; T415-I419 PolarHBondContact O-N 3.28Å; L416-I419 HydrophobicContact CD1-CD1 4.18Å; L416-I419 HydrophobicContact CD1-CG1 4.45Å; L416-I419 WeakPolarHBondContact O-CG1 3.36Å; L416-I419 PolarHBondContact O-N 3.46Å; I419-S421 VanDerWaalsContact C-N 3.3Å
420	T	93.8	Very high	93.6	Very high	25 Å²	25	44 Å²	44	15%	0.153	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	1.2	172.6	55.5	0	0	0	0	113.1	F351 L416 S417 V418 I422	F351-T420 HydrophobicContact CE1-CG2 4.09Å; F351-T420 HydrophobicContact CZ-CG2 3.7Å; L416-T420 HydrophobicContact CD1-CG2 4.11Å; L416-T420 HydrophobicContact CG-CG2 4.41Å; L416-T420 VanDerWaalsContact O-CB 3.31Å; L416-T420 WeakPolarHBondContact O-CB 3.41Å; L416-T420 VanDerWaalsContact O-CG2 3.28Å; L416-T420 WeakPolarHBondContact O-CG2 3.45Å; L416-T420 PolarHBondContact O-N 2.71Å; L416-T420 PolarHBondContact O-OG1 3.47Å; S417-T420 PolarHBondContact O-OG1 3.46Å; V418-T420 VanDerWaalsContact C-N 3.29Å; V418-T420 PolarHBondContact O-N 3.22Å; T420-I422 PolarHBondContact O-N 3.39Å; T420-I422 WeakPolarHBondContact OG1-CD1 3.39Å; T420-I422 WeakPolarHBondContact OG1-CG1 3.4Å
421	S	92.9	Very high	93.6	Very high	97 Å²	97	43.6 Å²	43.6	68%	0.678	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	21.6	-178.1	66.4	0	0	0	0	115.5	S417 V418 I419	S417-S421 PolarHBondContact O-N 3.4Å; V418-S421 PolarHBondContact O-N 2.76Å; V418-S421 VanDerWaalsContact O-N 3.08Å; I419-S421 VanDerWaalsContact C-N 3.3Å
422	I	94.5	Very high	93.5	Very high	102 Å²	102	50.3 Å²	50.3	52%	0.523	30%	0.297	S	S	.	.			trans	-80.4	-50.4	177.8	-60	171.8	0	0	0	110.6	S417 T420 F424	S417-I422 PolarHBondContact O-N 3.16Å; T420-I422 PolarHBondContact O-N 3.39Å; T420-I422 WeakPolarHBondContact OG1-CD1 3.39Å; T420-I422 WeakPolarHBondContact OG1-CG1 3.4Å; I422-F424 HydrophobicContact CB-CE2 4.44Å; I422-F424 HydrophobicContact CG2-CD1 4Å; I422-F424 HydrophobicContact CG2-CD2 4.01Å; I422-F424 HydrophobicContact CG2-CE1 3.7Å; I422-F424 HydrophobicContact CG2-CE2 3.71Å; I422-F424 HydrophobicContact CG2-CG 4.16Å; I422-F424 HydrophobicContact CG2-CZ 3.55Å
423	G	90	Very high	93.4	Very high	49 Å²	49	50.5 Å²	50.5	51%	0.505	30%	0.303	S	S	.	.			trans	56.1	62.6	175.6	0	0	0	0	0	115.4	S417 G425	S417-G423 PolarHBondContact O-N 3.25Å; S417-G423 VanDerWaalsContact O-N 3.08Å; G423-G425 PolarHBondContact O-N 2.87Å; G423-G425 VanDerWaalsContact O-N 3.17Å
424	F	93	Very high	93.4	Very high	117 Å²	117	46.8 Å²	46.8	51%	0.513	29%	0.288	S	S	.	.			trans	-58.1	-29.5	-176.7	-68.1	-73	0	0	0	115.3	Y413 I422	Y413-F424 AromaticContact CE2-CD2 3.62Å; Y413-F424 HydrophobicContact CE2-CD2 3.62Å; Y413-F424 AromaticContact CE2-CE2 3.85Å; Y413-F424 HydrophobicContact CE2-CE2 3.85Å; Y413-F424 AromaticContact CZ-CD2 3.56Å; Y413-F424 WeakPolarHBondContact OH-CB 3.26Å; Y413-F424 WeakPolarHBondContact OH-CD2 3.42Å; Y413-F424 VanDerWaalsContact OH-CG 3.22Å; Y413-F424 WeakPolarHBondContact OH-CG 3.47Å; I422-F424 HydrophobicContact CB-CE2 4.44Å; I422-F424 HydrophobicContact CG2-CD1 4Å; I422-F424 HydrophobicContact CG2-CD2 4.01Å; I422-F424 HydrophobicContact CG2-CE1 3.7Å; I422-F424 HydrophobicContact CG2-CE2 3.71Å; I422-F424 HydrophobicContact CG2-CG 4.16Å; I422-F424 HydrophobicContact CG2-CZ 3.55Å
425	G	88.9	Confident	93.4	Very high	52 Å²	52	51.4 Å²	51.4	54%	0.536	31%	0.309	S	S	.	.	S	Bend	trans	90.5	-8.2	176.1	0	0	0	0	0	116.3	G423 V427	G423-G425 PolarHBondContact O-N 2.87Å; G423-G425 VanDerWaalsContact O-N 3.17Å; G425-V427 VanDerWaalsContact C-N 3.27Å; G425-V427 PolarHBondContact O-N 3.15Å
426	N	90	Very high	93.4	Very high	107 Å²	107	55.1 Å²	55.1	57%	0.572	33%	0.331	S	S	*	.	S	Bend	trans	-63.3	-34.5	176.9	-57.1	-1.3	0	0	0	112.3	Y413	Y413-N426 HydrophobicContact CE1-CB 4.45Å; Y413-N426 PolarHBondContact OH-ND2 3.16Å
427	V	92.4	Very high	93.4	Very high	19 Å²	19	53.6 Å²	53.6	12%	0.115	32%	0.324	C	S	.	.	S	Bend	trans	-117.4	125.5	171.1	-176.3	0	0	0	0	106.3	W362 W378 T410 Y413 F414 G425	W362-V427 HydrophobicContact CZ2-CG1 4.4Å; W378-V427 HydrophobicContact CB-CG1 4.24Å; W378-V427 HydrophobicContact CE3-CG1 4.18Å; T410-V427 HydrophobicContact CG2-CG2 3.46Å; T410-V427 VanDerWaalsContact CG2-CG2 3.46Å; Y413-V427 HydrophobicContact CD1-CG2 4.45Å; F414-V427 HydrophobicContact CB-CB 4.08Å; F414-V427 HydrophobicContact CB-CG1 3.94Å; F414-V427 HydrophobicContact CD2-CB 3.89Å; F414-V427 HydrophobicContact CD2-CG1 3.83Å; F414-V427 VanDerWaalsContact CD2-O 3.23Å; F414-V427 WeakPolarHBondContact CD2-O 3.5Å; F414-V427 WeakPolarHBondContact CE2-O 3.26Å; F414-V427 HydrophobicContact CG-CB 4.29Å; F414-V427 HydrophobicContact CG-CG1 3.95Å; G425-V427 VanDerWaalsContact C-N 3.27Å; G425-V427 PolarHBondContact O-N 3.15Å
428	A	91.7	Very high	93.4	Very high	43 Å²	43	53.8 Å²	53.8	36%	0.355	33%	0.326	S	S	.	.			trans	-140.6	155.6	-176.5	0	0	0	0	0	110.8	N430	A428-N430 PolarHBondContact O-N 3.21Å; A428-N430 PolarHBondContact O-ND2 2.83Å
429	A	93.6	Very high	93.4	Very high	21 Å²	21	58 Å²	58	17%	0.174	35%	0.346	C	S	.	.			trans	-78.3	116.5	174.6	0	0	0	0	0	111	W362 E434 K435 S438	W362-A429 HydrophobicContact CH2-CB 4.08Å; A429-E434 HydrophobicContact CB-CB 3.64Å; A429-K435 HydrophobicContact CB-CB 4.47Å; A429-K435 HydrophobicContact CB-CG 3.83Å; A429-K435 VanDerWaalsContact O-CE 3.3Å; A429-K435 WeakPolarHBondContact O-CE 3.49Å; A429-S438 WeakPolarHBondContact CB-OG 3.31Å
430	N	93	Very high	93.5	Very high	57 Å²	57	61.8 Å²	61.8	31%	0.305	37%	0.366	S	S	.	.			trans	-104.2	-41.7	-179.9	-65.8	-59.4	0	0	0	110.8	H376 H381 A428 E434 K435	H376-N430 WeakPolarHBondContact O-CB 3.47Å; H381-N430 PolarHBondContact CD2-ND2 3.26Å; H381-N430 PolarHBondContact NE2-ND2 3.24Å; A428-N430 PolarHBondContact O-N 3.21Å; A428-N430 PolarHBondContact O-ND2 2.83Å; N430-E434 PolarHBondContact N-OE2 2.89Å; N430-K435 WeakPolarHBondContact O-CE 3.5Å; N430-K435 PolarHBondContact O-NZ 2.96Å
431	T	94.2	Very high	93.6	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.031	36%	0.36	C	S	.	.	S	Bend	trans	-79.6	161.5	-179.4	71.4	0	0	0	0	111.7	D369 I374 S433 E434 K435	D369-T431 WeakPolarHBondContact OD2-CB 3.42Å; D369-T431 VanDerWaalsContact OD2-CG2 3.32Å; D369-T431 WeakPolarHBondContact OD2-CG2 3.29Å; D369-T431 PolarHBondContact OD2-OG1 3.13Å; I374-T431 HydrophobicContact CG2-CG2 3.74Å; T431-S433 VanDerWaalsContact C-N 3.33Å; T431-S433 PolarHBondContact OG1-OG 2.98Å; T431-E434 PolarHBondContact N-OE2 2.94Å; T431-E434 PolarHBondContact O-N 3.4Å; T431-E434 VanDerWaalsContact OG1-CB 3.24Å; T431-E434 WeakPolarHBondContact OG1-CB 3.41Å; T431-E434 WeakPolarHBondContact OG1-CG 3.4Å; T431-E434 PolarHBondContact OG1-N 3.36Å; T431-E434 VanDerWaalsContact OG1-N 3.14Å; T431-E434 PolarHBondContact OG1-OE2 2.77Å; T431-K435 WeakPolarHBondContact O-CB 3.49Å; T431-K435 VanDerWaalsContact O-CG 3.28Å; T431-K435 WeakPolarHBondContact O-CG 3.33Å; T431-K435 PolarHBondContact O-N 3.09Å
432	I	94	Very high	93.7	Very high	141 Å²	141	61.1 Å²	61.1	72%	0.723	35%	0.351	S	S	*	.	H	α-helix	trans	-64.6	-41.8	178.2	-62.1	172	0	0	0	110.2	K435 V436	I432-K435 PolarHBondContact O-N 2.84Å; I432-V436 HydrophobicContact CG2-CG2 4.48Å; I432-V436 WeakPolarHBondContact O-CG2 3.16Å; I432-V436 PolarHBondContact O-N 3.09Å
433	S	93.1	Very high	93.7	Very high	47 Å²	47	62 Å²	62	33%	0.329	36%	0.356	S	S	.	.	H	α-helix	trans	-58.2	-51.1	175.3	40.2	0	0	0	0	111.2	D369 T431 K435 V436 V437	D369-S433 PolarHBondContact OD1-OG 2.96Å; D369-S433 PolarHBondContact OD2-OG 2.76Å; T431-S433 VanDerWaalsContact C-N 3.33Å; T431-S433 PolarHBondContact OG1-OG 2.98Å; S433-K435 VanDerWaalsContact C-N 3.32Å; S433-K435 PolarHBondContact O-N 3.09Å; S433-V436 PolarHBondContact O-N 3.46Å; S433-V437 WeakPolarHBondContact O-CG2 3.47Å; S433-V437 PolarHBondContact O-N 2.88Å; S433-V437 VanDerWaalsContact O-N 3.09Å
434	E	95.5	Very high	93.9	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-58.6	-41.4	176.5	-74.4	168.7	175.8	0	0	112.3	W362 I365 G377 W378 A429 N430 T431 V437 S438	W362-E434 HydrophobicContact CH2-CB 3.78Å; W362-E434 HydrophobicContact CH2-CG 3.83Å; W362-E434 HydrophobicContact CZ2-CG 4.49Å; W362-E434 HydrophobicContact CZ3-CB 4.05Å; W362-E434 HydrophobicContact CZ3-CG 4.19Å; I365-E434 HydrophobicContact CG2-CG 4.11Å; G377-E434 WeakPolarHBondContact CA-OE1 3.43Å; W378-E434 PolarHBondContact N-OE1 3.48Å; A429-E434 HydrophobicContact CB-CB 3.64Å; N430-E434 PolarHBondContact N-OE2 2.89Å; T431-E434 PolarHBondContact N-OE2 2.94Å; T431-E434 PolarHBondContact O-N 3.4Å; T431-E434 VanDerWaalsContact OG1-CB 3.24Å; T431-E434 WeakPolarHBondContact OG1-CB 3.41Å; T431-E434 WeakPolarHBondContact OG1-CG 3.4Å; T431-E434 PolarHBondContact OG1-N 3.36Å; T431-E434 VanDerWaalsContact OG1-N 3.14Å; T431-E434 PolarHBondContact OG1-OE2 2.77Å; E434-V437 PolarHBondContact O-N 3.13Å; E434-S438 VanDerWaalsContact O-CB 3.3Å; E434-S438 WeakPolarHBondContact O-CB 3.37Å; E434-S438 PolarHBondContact O-N 3.18Å; E434-S438 PolarHBondContact O-OG 3.26Å
435	K	95.4	Very high	94	Very high	107 Å²	107	57 Å²	57	47%	0.465	32%	0.323	S	S	.	.	H	α-helix	trans	-66.9	-45.1	-179.8	-77	171.3	-179	163.5	0	112	A429 N430 T431 I432 S433 V437 S438 I439	A429-K435 HydrophobicContact CB-CB 4.47Å; A429-K435 HydrophobicContact CB-CG 3.83Å; A429-K435 VanDerWaalsContact O-CE 3.3Å; A429-K435 WeakPolarHBondContact O-CE 3.49Å; N430-K435 WeakPolarHBondContact O-CE 3.5Å; N430-K435 PolarHBondContact O-NZ 2.96Å; T431-K435 WeakPolarHBondContact O-CB 3.49Å; T431-K435 VanDerWaalsContact O-CG 3.28Å; T431-K435 WeakPolarHBondContact O-CG 3.33Å; T431-K435 PolarHBondContact O-N 3.09Å; I432-K435 PolarHBondContact O-N 2.84Å; S433-K435 VanDerWaalsContact C-N 3.32Å; S433-K435 PolarHBondContact O-N 3.09Å; K435-V437 VanDerWaalsContact C-N 3.32Å; K435-V437 PolarHBondContact O-N 3.43Å; K435-S438 PolarHBondContact O-N 2.97Å; K435-I439 VanDerWaalsContact O-CG1 3.31Å; K435-I439 WeakPolarHBondContact O-CG1 3.38Å; K435-I439 PolarHBondContact O-N 3.39Å
436	V	96	Very high	94.2	Very high	78 Å²	78	57.5 Å²	57.5	47%	0.473	32%	0.322	S	S	.	.	H	α-helix	trans	-59.5	-45.7	176.8	170.5	0	0	0	0	110.3	I432 S433 I439 I440	I432-V436 HydrophobicContact CG2-CG2 4.48Å; I432-V436 WeakPolarHBondContact O-CG2 3.16Å; I432-V436 PolarHBondContact O-N 3.09Å; S433-V436 PolarHBondContact O-N 3.46Å; V436-I439 PolarHBondContact O-N 3.26Å; V436-I440 HydrophobicContact CG1-CD1 4.22Å; V436-I440 WeakPolarHBondContact O-CG1 3.48Å; V436-I440 PolarHBondContact O-N 3.24Å; V436-I440 VanDerWaalsContact O-N 3.15Å
437	V	94.7	Very high	94.4	Very high	27 Å²	27	57.8 Å²	57.8	16%	0.164	32%	0.323	C	S	.	.	H	α-helix	trans	-68.3	-38.3	179.6	173.3	0	0	0	0	111.7	I365 S433 E434 K435 I439 I440 F441	I365-V437 HydrophobicContact CD1-CB 3.74Å; I365-V437 HydrophobicContact CD1-CG1 3.5Å; I365-V437 HydrophobicContact CD1-CG2 3.52Å; I365-V437 HydrophobicContact CG1-CG2 4.5Å; S433-V437 WeakPolarHBondContact O-CG2 3.47Å; S433-V437 PolarHBondContact O-N 2.88Å; S433-V437 VanDerWaalsContact O-N 3.09Å; E434-V437 PolarHBondContact O-N 3.13Å; K435-V437 VanDerWaalsContact C-N 3.32Å; K435-V437 PolarHBondContact O-N 3.43Å; V437-I439 VanDerWaalsContact C-N 3.31Å; V437-I439 PolarHBondContact O-N 3Å; V437-I440 WeakPolarHBondContact O-CB 3.25Å; V437-I440 PolarHBondContact O-N 3.26Å; V437-I440 VanDerWaalsContact O-N 3.14Å; V437-F441 HydrophobicContact CG1-CD1 3.83Å; V437-F441 HydrophobicContact CG1-CD2 4.24Å; V437-F441 HydrophobicContact CG1-CE1 3.36Å; V437-F441 HydrophobicContact CG1-CE2 3.81Å; V437-F441 HydrophobicContact CG1-CG 4.26Å; V437-F441 HydrophobicContact CG1-CZ 3.36Å; V437-F441 WeakPolarHBondContact O-CD1 3.2Å; V437-F441 WeakPolarHBondContact O-CG 3.29Å; V437-F441 PolarHBondContact O-N 2.89Å
438	S	94.8	Very high	94.4	Very high	12 Å²	12	58.7 Å²	58.7	8%	0.084	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-38.5	174.7	-62.1	0	0	0	0	112.3	A429 E434 K435 I440 F441 M442	A429-S438 WeakPolarHBondContact CB-OG 3.31Å; E434-S438 VanDerWaalsContact O-CB 3.3Å; E434-S438 WeakPolarHBondContact O-CB 3.37Å; E434-S438 PolarHBondContact O-N 3.18Å; E434-S438 PolarHBondContact O-OG 3.26Å; K435-S438 PolarHBondContact O-N 2.97Å; S438-I440 VanDerWaalsContact C-N 3.34Å; S438-F441 PolarHBondContact O-N 3.42Å; S438-M442 WeakPolarHBondContact O-CB 3.35Å; S438-M442 WeakPolarHBondContact O-CG 3.44Å; S438-M442 PolarHBondContact O-N 3.2Å
439	I	95.2	Very high	94.4	Very high	109 Å²	109	60.7 Å²	60.7	56%	0.559	33%	0.328	S	S	*	.	H	α-helix	trans	-61.5	-43.8	173.5	-68.3	164.3	0	0	0	110.8	K435 V436 V437 M442 L443	K435-I439 VanDerWaalsContact O-CG1 3.31Å; K435-I439 WeakPolarHBondContact O-CG1 3.38Å; K435-I439 PolarHBondContact O-N 3.39Å; V436-I439 PolarHBondContact O-N 3.26Å; V437-I439 VanDerWaalsContact C-N 3.31Å; V437-I439 PolarHBondContact O-N 3Å; I439-M442 HydrophobicContact CB-CE 4.47Å; I439-M442 HydrophobicContact CG1-CE 4.07Å; I439-M442 PolarHBondContact O-N 2.95Å; I439-L443 PolarHBondContact O-N 2.82Å
440	I	96.1	Very high	94.3	Very high	83 Å²	83	62.7 Å²	62.7	43%	0.426	34%	0.344	S	S	.	.	H	α-helix	trans	-63.8	-44.2	176.7	-64.5	166.5	0	0	0	110.7	V436 V437 S438 M442 L443 I444	V436-I440 HydrophobicContact CG1-CD1 4.22Å; V436-I440 WeakPolarHBondContact O-CG1 3.48Å; V436-I440 PolarHBondContact O-N 3.24Å; V436-I440 VanDerWaalsContact O-N 3.15Å; V437-I440 WeakPolarHBondContact O-CB 3.25Å; V437-I440 PolarHBondContact O-N 3.26Å; V437-I440 VanDerWaalsContact O-N 3.14Å; S438-I440 VanDerWaalsContact C-N 3.34Å; I440-M442 VanDerWaalsContact C-N 3.35Å; I440-M442 PolarHBondContact O-N 3.07Å; I440-L443 PolarHBondContact O-N 2.91Å; I440-I444 HydrophobicContact CG2-CD1 3.79Å; I440-I444 HydrophobicContact CG2-CG1 4.43Å; I440-I444 WeakPolarHBondContact O-CG1 3.15Å; I440-I444 PolarHBondContact O-N 3.17Å
441	F	96	Very high	94.2	Very high	6 Å²	6	63.5 Å²	63.5	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-41.1	177.4	-72.2	3.7	0	0	0	111.9	L358 V361 W362 T415 V418 V437 S438 G445	L358-F441 HydrophobicContact CB-CD1 4.47Å; L358-F441 HydrophobicContact CB-CD2 4.39Å; L358-F441 HydrophobicContact CB-CE1 4.12Å; L358-F441 HydrophobicContact CB-CE2 4.03Å; L358-F441 HydrophobicContact CB-CZ 3.88Å; L358-F441 HydrophobicContact CD1-CD1 4.26Å; L358-F441 HydrophobicContact CD1-CG 4.3Å; L358-F441 HydrophobicContact CD2-CD1 3.75Å; L358-F441 HydrophobicContact CD2-CE1 3.54Å; L358-F441 HydrophobicContact CD2-CZ 4.17Å; L358-F441 HydrophobicContact CG-CD1 4.36Å; L358-F441 HydrophobicContact CG-CE1 4.27Å; L358-F441 WeakPolarHBondContact O-CZ 3.45Å; V361-F441 HydrophobicContact CB-CZ 4.11Å; V361-F441 HydrophobicContact CG1-CE1 4.26Å; V361-F441 HydrophobicContact CG1-CZ 3.96Å; W362-F441 HydrophobicContact CB-CE2 4.17Å; W362-F441 HydrophobicContact CE3-CE2 4.11Å; T415-F441 HydrophobicContact CG2-CD2 4.04Å; T415-F441 HydrophobicContact CG2-CE2 3.72Å; V418-F441 HydrophobicContact CG1-CB 3.88Å; V437-F441 HydrophobicContact CG1-CD1 3.83Å; V437-F441 HydrophobicContact CG1-CD2 4.24Å; V437-F441 HydrophobicContact CG1-CE1 3.36Å; V437-F441 HydrophobicContact CG1-CE2 3.81Å; V437-F441 HydrophobicContact CG1-CG 4.26Å; V437-F441 HydrophobicContact CG1-CZ 3.36Å; V437-F441 WeakPolarHBondContact O-CD1 3.2Å; V437-F441 WeakPolarHBondContact O-CG 3.29Å; V437-F441 PolarHBondContact O-N 2.89Å; S438-F441 PolarHBondContact O-N 3.42Å; F441-G445 WeakPolarHBondContact O-CA 3.47Å; F441-G445 PolarHBondContact O-N 3.21Å
442	M	94.9	Very high	94	Very high	102 Å²	102	64.6 Å²	64.6	50%	0.502	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-42.5	174.7	-75.1	-173.9	-66.2	0	0	111.8	V418 S438 I439 I440 G445 A446	V418-M442 HydrophobicContact CG1-CB 4.48Å; V418-M442 HydrophobicContact CG1-CG 3.61Å; S438-M442 WeakPolarHBondContact O-CB 3.35Å; S438-M442 WeakPolarHBondContact O-CG 3.44Å; S438-M442 PolarHBondContact O-N 3.2Å; I439-M442 HydrophobicContact CB-CE 4.47Å; I439-M442 HydrophobicContact CG1-CE 4.07Å; I439-M442 PolarHBondContact O-N 2.95Å; I440-M442 VanDerWaalsContact C-N 3.35Å; I440-M442 PolarHBondContact O-N 3.07Å; M442-G445 PolarHBondContact O-N 3.07Å; M442-A446 VanDerWaalsContact O-CB 3.3Å; M442-A446 WeakPolarHBondContact O-CB 3.27Å; M442-A446 PolarHBondContact O-N 3.32Å
443	L	95.5	Very high	93.8	Very high	119 Å²	119	63.3 Å²	63.3	62%	0.623	35%	0.346	S	S	*	.	H	α-helix	trans	-65	-46.6	178.7	-173.8	68.4	0	0	0	112	I439 I440 L447	I439-L443 PolarHBondContact O-N 2.82Å; I440-L443 PolarHBondContact O-N 2.91Å; L443-L447 WeakPolarHBondContact O-CG 3.47Å; L443-L447 PolarHBondContact O-N 3.17Å
444	I	94.9	Very high	93.6	Very high	60 Å²	60	62.7 Å²	62.7	31%	0.308	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-45.8	176.7	-66	171.3	0	0	0	110.2	L354 I440 L447 V448	L354-I444 HydrophobicContact CD1-CG2 4.29Å; L354-I444 HydrophobicContact CD2-CG2 4.05Å; I440-I444 HydrophobicContact CG2-CD1 3.79Å; I440-I444 HydrophobicContact CG2-CG1 4.43Å; I440-I444 WeakPolarHBondContact O-CG1 3.15Å; I440-I444 PolarHBondContact O-N 3.17Å; I444-L447 PolarHBondContact O-N 2.95Å; I444-V448 HydrophobicContact CG2-CG2 4.33Å; I444-V448 WeakPolarHBondContact O-CG2 3.33Å; I444-V448 PolarHBondContact O-N 3.11Å
445	G	94.1	Very high	93.3	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-57.4	-49.5	178	0	0	0	0	0	112.2	F441 M442 L447 V448 Y449	F441-G445 WeakPolarHBondContact O-CA 3.47Å; F441-G445 PolarHBondContact O-N 3.21Å; M442-G445 PolarHBondContact O-N 3.07Å; G445-L447 PolarHBondContact O-N 3.29Å; G445-V448 PolarHBondContact O-N 3.48Å; G445-Y449 WeakPolarHBondContact O-CB 3.39Å; G445-Y449 PolarHBondContact O-N 2.89Å
446	A	93.6	Very high	93	Very high	63 Å²	63	63.5 Å²	63.5	52%	0.521	36%	0.359	S	S	.	.	H	α-helix	trans	-59.1	-44.4	178.9	0	0	0	0	0	112.6	M442 A450	M442-A446 VanDerWaalsContact O-CB 3.3Å; M442-A446 WeakPolarHBondContact O-CB 3.27Å; M442-A446 PolarHBondContact O-N 3.32Å; A446-A450 VanDerWaalsContact O-CB 3.29Å; A446-A450 WeakPolarHBondContact O-CB 3.29Å; A446-A450 PolarHBondContact O-N 2.92Å
447	L	93.9	Very high	92.7	Very high	113 Å²	113	62 Å²	62	59%	0.592	35%	0.354	S	S	*	.	H	α-helix	trans	-64.5	-49.5	177.7	-71.9	170.7	0	0	0	111.7	L443 I444 G445 A450 T451	L443-L447 WeakPolarHBondContact O-CG 3.47Å; L443-L447 PolarHBondContact O-N 3.17Å; I444-L447 PolarHBondContact O-N 2.95Å; G445-L447 PolarHBondContact O-N 3.29Å; L447-A450 PolarHBondContact O-N 2.93Å; L447-T451 WeakPolarHBondContact O-CG2 3.31Å; L447-T451 PolarHBondContact O-N 3.24Å
448	V	92.5	Very high	92.4	Very high	39 Å²	39	63.5 Å²	63.5	24%	0.236	36%	0.363	C	S	.	.	H	α-helix	trans	-66.1	-44.8	-178	173	0	0	0	0	110.8	F351 L354 I444 G445 A450 T451 I452	F351-V448 HydrophobicContact CD2-CG1 3.99Å; L354-V448 HydrophobicContact CD2-CB 4.15Å; L354-V448 HydrophobicContact CD2-CG1 4.02Å; L354-V448 HydrophobicContact CD2-CG2 3.75Å; I444-V448 HydrophobicContact CG2-CG2 4.33Å; I444-V448 WeakPolarHBondContact O-CG2 3.33Å; I444-V448 PolarHBondContact O-N 3.11Å; G445-V448 PolarHBondContact O-N 3.48Å; V448-A450 VanDerWaalsContact C-N 3.33Å; V448-A450 PolarHBondContact O-N 3.4Å; V448-T451 PolarHBondContact O-N 3.01Å; V448-T451 VanDerWaalsContact O-N 3.13Å; V448-T451 PolarHBondContact O-OG1 3.47Å; V448-I452 HydrophobicContact CG1-CD1 3.93Å; V448-I452 HydrophobicContact CG1-CG1 4.5Å; V448-I452 WeakPolarHBondContact O-CG1 3.29Å; V448-I452 PolarHBondContact O-N 2.88Å
449	Y	90.8	Very high	92	Very high	85 Å²	85	64.2 Å²	64.2	33%	0.333	37%	0.366	S	S	.	.	H	α-helix	trans	-59	-44.4	177.1	-167.6	-108.4	0	0	0	111.4	G445 T451 I452 F453	G445-Y449 WeakPolarHBondContact O-CB 3.39Å; G445-Y449 PolarHBondContact O-N 2.89Å; Y449-T451 PolarHBondContact O-N 2.84Å; Y449-I452 PolarHBondContact O-N 3.22Å; Y449-F453 AromaticContact CD1-CD2 3.99Å; Y449-F453 HydrophobicContact CD1-CD2 3.99Å; Y449-F453 HydrophobicContact CD1-CE2 4.19Å; Y449-F453 HydrophobicContact CD2-CD2 4.23Å; Y449-F453 HydrophobicContact CD2-CE2 4.01Å; Y449-F453 AromaticContact CE1-CD2 3.74Å; Y449-F453 HydrophobicContact CE1-CD2 3.74Å; Y449-F453 AromaticContact CE1-CE2 3.55Å; Y449-F453 HydrophobicContact CE1-CE2 3.55Å; Y449-F453 HydrophobicContact CE1-CZ 4.4Å; Y449-F453 HydrophobicContact CE2-CD2 4Å; Y449-F453 AromaticContact CE2-CE2 3.36Å; Y449-F453 HydrophobicContact CE2-CE2 3.36Å; Y449-F453 HydrophobicContact CE2-CZ 4.35Å; Y449-F453 HydrophobicContact CG-CD2 4.23Å; Y449-F453 HydrophobicContact CG-CE2 4.39Å; Y449-F453 AromaticContact CZ-CD2 3.74Å; Y449-F453 AromaticContact CZ-CE2 3.08Å; Y449-F453 AromaticContact CZ-CZ 3.85Å; Y449-F453 WeakPolarHBondContact O-CD2 3.49Å; Y449-F453 PolarHBondContact O-N 3.37Å; Y449-F453 WeakPolarHBondContact OH-CE2 3.39Å; Y449-F453 WeakPolarHBondContact OH-CZ 3.41Å
450	A	92.4	Very high	91.6	Very high	63 Å²	63	63.7 Å²	63.7	52%	0.521	36%	0.364	S	S	.	.	H	α-helix	trans	-60.3	-41.6	174.4	0	0	0	0	0	112.7	A446 L447 V448 F453 G454	A446-A450 VanDerWaalsContact O-CB 3.29Å; A446-A450 WeakPolarHBondContact O-CB 3.29Å; A446-A450 PolarHBondContact O-N 2.92Å; L447-A450 PolarHBondContact O-N 2.93Å; V448-A450 VanDerWaalsContact C-N 3.33Å; V448-A450 PolarHBondContact O-N 3.4Å; A450-F453 PolarHBondContact O-N 3.3Å; A450-G454 PolarHBondContact O-N 2.88Å
451	T	89.6	Confident	91.2	Very high	73 Å²	73	66.3 Å²	66.3	45%	0.448	38%	0.375	S	S	.	.	H	α-helix	trans	-66.7	-36.9	177	64	0	0	0	0	113	L447 V448 Y449 G454 N455	L447-T451 WeakPolarHBondContact O-CG2 3.31Å; L447-T451 PolarHBondContact O-N 3.24Å; V448-T451 PolarHBondContact O-N 3.01Å; V448-T451 VanDerWaalsContact O-N 3.13Å; V448-T451 PolarHBondContact O-OG1 3.47Å; Y449-T451 PolarHBondContact O-N 2.84Å; T451-G454 PolarHBondContact O-N 3.49Å; T451-N455 WeakPolarHBondContact O-CB 3.48Å; T451-N455 PolarHBondContact O-N 3.37Å; T451-N455 PolarHBondContact O-ND2 3.26Å
452	I	90.4	Very high	90.7	Very high	28 Å²	28	71 Å²	71	14%	0.144	40%	0.396	C	S	.	.	H	α-helix	trans	-63	-51.5	175.3	-68.4	164.8	0	0	0	109.6	M347 F351 V448 Y449 G454 N455 V456	M347-I452 HydrophobicContact CE-CB 4.25Å; M347-I452 HydrophobicContact CE-CG1 3.42Å; M347-I452 VanDerWaalsContact CE-CG1 3.42Å; F351-I452 HydrophobicContact CB-CD1 3.79Å; F351-I452 HydrophobicContact CD2-CD1 3.36Å; F351-I452 HydrophobicContact CE2-CD1 4.09Å; F351-I452 HydrophobicContact CG-CD1 3.71Å; V448-I452 HydrophobicContact CG1-CD1 3.93Å; V448-I452 HydrophobicContact CG1-CG1 4.5Å; V448-I452 WeakPolarHBondContact O-CG1 3.29Å; V448-I452 PolarHBondContact O-N 2.88Å; Y449-I452 PolarHBondContact O-N 3.22Å; I452-G454 VanDerWaalsContact C-N 3.34Å; I452-G454 PolarHBondContact O-N 2.94Å; I452-N455 PolarHBondContact O-N 3.41Å; I452-V456 HydrophobicContact CG2-CG2 4.25Å; I452-V456 WeakPolarHBondContact O-CB 3.37Å; I452-V456 VanDerWaalsContact O-CG2 3.23Å; I452-V456 WeakPolarHBondContact O-CG2 3.48Å; I452-V456 PolarHBondContact O-N 3.23Å
453	F	89.4	Confident	90.1	Very high	114 Å²	114	70.5 Å²	70.5	50%	0.5	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-39.1	178.8	-88.7	-85.9	0	0	0	112.6	Y449 A450 V456 A457	Y449-F453 AromaticContact CD1-CD2 3.99Å; Y449-F453 HydrophobicContact CD1-CD2 3.99Å; Y449-F453 HydrophobicContact CD1-CE2 4.19Å; Y449-F453 HydrophobicContact CD2-CD2 4.23Å; Y449-F453 HydrophobicContact CD2-CE2 4.01Å; Y449-F453 AromaticContact CE1-CD2 3.74Å; Y449-F453 HydrophobicContact CE1-CD2 3.74Å; Y449-F453 AromaticContact CE1-CE2 3.55Å; Y449-F453 HydrophobicContact CE1-CE2 3.55Å; Y449-F453 HydrophobicContact CE1-CZ 4.4Å; Y449-F453 HydrophobicContact CE2-CD2 4Å; Y449-F453 AromaticContact CE2-CE2 3.36Å; Y449-F453 HydrophobicContact CE2-CE2 3.36Å; Y449-F453 HydrophobicContact CE2-CZ 4.35Å; Y449-F453 HydrophobicContact CG-CD2 4.23Å; Y449-F453 HydrophobicContact CG-CE2 4.39Å; Y449-F453 AromaticContact CZ-CD2 3.74Å; Y449-F453 AromaticContact CZ-CE2 3.08Å; Y449-F453 AromaticContact CZ-CZ 3.85Å; Y449-F453 WeakPolarHBondContact O-CD2 3.49Å; Y449-F453 PolarHBondContact O-N 3.37Å; Y449-F453 WeakPolarHBondContact OH-CE2 3.39Å; Y449-F453 WeakPolarHBondContact OH-CZ 3.41Å; A450-F453 PolarHBondContact O-N 3.3Å; F453-V456 PolarHBondContact O-N 3.14Å; F453-A457 WeakPolarHBondContact O-CB 3.5Å; F453-A457 PolarHBondContact O-N 3.47Å
454	G	91	Very high	89.8	Confident	35 Å²	35	69.3 Å²	69.3	36%	0.361	39%	0.391	S	S	.	.	H	α-helix	trans	-62.3	-43.6	174.6	0	0	0	0	0	113.2	A450 T451 I452 A457 T458	A450-G454 PolarHBondContact O-N 2.88Å; T451-G454 PolarHBondContact O-N 3.49Å; I452-G454 VanDerWaalsContact C-N 3.34Å; I452-G454 PolarHBondContact O-N 2.94Å; G454-A457 PolarHBondContact O-N 3.31Å; G454-T458 PolarHBondContact O-N 3.49Å; G454-T458 PolarHBondContact O-OG1 3.4Å
455	N	87.9	Confident	89.5	Confident	65 Å²	65	68.9 Å²	68.9	35%	0.348	40%	0.396	S	S	.	.	H	α-helix	trans	-68.6	-42.4	176.5	-76.2	-27.6	0	0	0	111.9	T451 I452 A457 T458 I459	T451-N455 WeakPolarHBondContact O-CB 3.48Å; T451-N455 PolarHBondContact O-N 3.37Å; T451-N455 PolarHBondContact O-ND2 3.26Å; I452-N455 PolarHBondContact O-N 3.41Å; N455-A457 VanDerWaalsContact C-N 3.34Å; N455-A457 PolarHBondContact O-N 3.38Å; N455-T458 WeakPolarHBondContact O-CB 3.49Å; N455-T458 PolarHBondContact O-N 3.31Å; N455-I459 WeakPolarHBondContact O-CB 3.43Å; N455-I459 VanDerWaalsContact O-CG1 3.23Å; N455-I459 WeakPolarHBondContact O-CG1 3.23Å; N455-I459 PolarHBondContact O-N 3.35Å
456	V	88.8	Confident	89	Confident	59 Å²	59	72.8 Å²	72.8	36%	0.358	42%	0.42	S	S	.	.	H	α-helix	trans	-60.4	-44.3	175.4	170.7	0	0	0	0	110.7	L344 I452 F453 T458 I459 L460	L344-V456 HydrophobicContact CD1-CG2 3.79Å; I452-V456 HydrophobicContact CG2-CG2 4.25Å; I452-V456 WeakPolarHBondContact O-CB 3.37Å; I452-V456 VanDerWaalsContact O-CG2 3.23Å; I452-V456 WeakPolarHBondContact O-CG2 3.48Å; I452-V456 PolarHBondContact O-N 3.23Å; F453-V456 PolarHBondContact O-N 3.14Å; V456-T458 VanDerWaalsContact C-N 3.35Å; V456-T458 PolarHBondContact O-N 3.32Å; V456-I459 PolarHBondContact O-N 2.89Å; V456-L460 WeakPolarHBondContact O-CB 3.38Å; V456-L460 PolarHBondContact O-N 3.45Å
457	A	90.1	Very high	88.7	Confident	45 Å²	45	76.8 Å²	76.8	37%	0.372	42%	0.421	S	S	.	.	H	α-helix	trans	-60.4	-44	175.3	0	0	0	0	0	111.8	F453 G454 N455 L460 Q461	F453-A457 WeakPolarHBondContact O-CB 3.5Å; F453-A457 PolarHBondContact O-N 3.47Å; G454-A457 PolarHBondContact O-N 3.31Å; N455-A457 VanDerWaalsContact C-N 3.34Å; N455-A457 PolarHBondContact O-N 3.38Å; A457-L460 PolarHBondContact O-N 3.29Å; A457-Q461 VanDerWaalsContact O-CG 3.29Å; A457-Q461 WeakPolarHBondContact O-CG 3.28Å; A457-Q461 PolarHBondContact O-N 3.5Å
458	T	88.2	Confident	88.5	Confident	59 Å²	59	73.8 Å²	73.8	36%	0.362	41%	0.413	S	S	.	.	H	α-helix	trans	-62.4	-44.2	176.8	-57.5	0	0	0	0	111.8	G454 N455 V456 L460 Q461 Q462	G454-T458 PolarHBondContact O-N 3.49Å; G454-T458 PolarHBondContact O-OG1 3.4Å; N455-T458 WeakPolarHBondContact O-CB 3.49Å; N455-T458 PolarHBondContact O-N 3.31Å; V456-T458 VanDerWaalsContact C-N 3.35Å; V456-T458 PolarHBondContact O-N 3.32Å; T458-L460 VanDerWaalsContact C-N 3.33Å; T458-L460 PolarHBondContact O-N 3.23Å; T458-Q461 PolarHBondContact O-N 3.21Å; T458-Q462 WeakPolarHBondContact O-CG 3.13Å; T458-Q462 PolarHBondContact O-N 2.99Å
459	I	86.7	Confident	88.3	Confident	28 Å²	28	79.6 Å²	79.6	14%	0.144	43%	0.431	C	S	.	.	H	α-helix	trans	-60.7	-43.9	176.6	-72.4	168.2	0	0	0	110.9	V340 I343 L344 N455 V456 Q462 T463	V340-I459 HydrophobicContact CG1-CB 4.16Å; V340-I459 HydrophobicContact CG1-CG1 3.96Å; V340-I459 HydrophobicContact CG1-CG2 3.44Å; V340-I459 VanDerWaalsContact CG1-CG2 3.44Å; I343-I459 HydrophobicContact CB-CD1 4.42Å; I343-I459 HydrophobicContact CG2-CD1 4.34Å; L344-I459 HydrophobicContact CB-CD1 4.37Å; N455-I459 WeakPolarHBondContact O-CB 3.43Å; N455-I459 VanDerWaalsContact O-CG1 3.23Å; N455-I459 WeakPolarHBondContact O-CG1 3.23Å; N455-I459 PolarHBondContact O-N 3.35Å; V456-I459 PolarHBondContact O-N 2.89Å; I459-Q462 PolarHBondContact O-N 3.32Å; I459-T463 WeakPolarHBondContact O-CB 3.43Å; I459-T463 PolarHBondContact O-N 3.01Å; I459-T463 PolarHBondContact O-OG1 3.09Å
460	L	86.9	Confident	88.2	Confident	98 Å²	98	77.7 Å²	77.7	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-42.3	179.1	-172	64.3	0	0	0	111.3	V456 A457 T458 T463 H464	V456-L460 WeakPolarHBondContact O-CB 3.38Å; V456-L460 PolarHBondContact O-N 3.45Å; A457-L460 PolarHBondContact O-N 3.29Å; T458-L460 VanDerWaalsContact C-N 3.33Å; T458-L460 PolarHBondContact O-N 3.23Å; L460-T463 PolarHBondContact O-N 3.48Å; L460-H464 WeakPolarHBondContact CD1-NE2 3.45Å; L460-H464 PolarHBondContact O-CD2 3.01Å; L460-H464 VanDerWaalsContact O-CD2 3.32Å; L460-H464 PolarHBondContact O-N 3.48Å
461	Q	88.1	Confident	88.1	Confident	138 Å²	138	82 Å²	82	65%	0.645	43%	0.429	S	S	*	.	H	α-helix	trans	-61.2	-45.2	174.1	-73.6	173.5	-7.4	0	0	111.9	A457 T458 H464 A465	A457-Q461 VanDerWaalsContact O-CG 3.29Å; A457-Q461 WeakPolarHBondContact O-CG 3.28Å; A457-Q461 PolarHBondContact O-N 3.5Å; T458-Q461 PolarHBondContact O-N 3.21Å; Q461-H464 PolarHBondContact O-N 2.92Å; Q461-A465 PolarHBondContact O-N 3.31Å
462	Q	85.3	Confident	88.3	Confident	103 Å²	103	84.2 Å²	84.2	48%	0.481	43%	0.434	S	S	.	.	H	α-helix	trans	-63.8	-42.4	177.9	-74	177.5	1.8	0	0	112.2	T458 I459 H464 A465	T458-Q462 WeakPolarHBondContact O-CG 3.13Å; T458-Q462 PolarHBondContact O-N 2.99Å; I459-Q462 PolarHBondContact O-N 3.32Å; Q462-H464 VanDerWaalsContact C-N 3.29Å; Q462-H464 PolarHBondContact O-N 3.23Å; Q462-A465 WeakPolarHBondContact O-CB 3.35Å; Q462-A465 PolarHBondContact O-N 3.06Å
463	T	82.4	Confident	88.4	Confident	93 Å²	93	84.9 Å²	84.9	57%	0.571	44%	0.438	S	S	*	.	H	α-helix	trans	-64.8	-35.3	179	-56.7	0	0	0	0	111.6	I459 L460	I459-T463 WeakPolarHBondContact O-CB 3.43Å; I459-T463 PolarHBondContact O-N 3.01Å; I459-T463 PolarHBondContact O-OG1 3.09Å; L460-T463 PolarHBondContact O-N 3.48Å
464	H	88.1	Confident	88.6	Confident	94 Å²	94	80.9 Å²	80.9	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-91.5	-4.2	179.3	-69.2	-45.3	0	0	0	114.9	L460 Q461 Q462 T466 R467 A468	L460-H464 WeakPolarHBondContact CD1-NE2 3.45Å; L460-H464 PolarHBondContact O-CD2 3.01Å; L460-H464 VanDerWaalsContact O-CD2 3.32Å; L460-H464 PolarHBondContact O-N 3.48Å; Q461-H464 PolarHBondContact O-N 2.92Å; Q462-H464 VanDerWaalsContact C-N 3.29Å; Q462-H464 PolarHBondContact O-N 3.23Å; H464-T466 PolarHBondContact O-N 2.7Å; H464-R467 PolarHBondContact O-N 2.67Å; H464-R467 VanDerWaalsContact O-N 3.1Å; H464-A468 WeakPolarHBondContact O-CB 3.34Å; H464-A468 PolarHBondContact O-N 3.36Å
465	A	88.4	Confident	88.8	Confident	51 Å²	51	82.1 Å²	82.1	42%	0.421	42%	0.424	S	S	.	.	H	α-helix	trans	-54.8	-46.2	-174.3	0	0	0	0	0	113.3	Q461 Q462 R467 A468 R469	Q461-A465 PolarHBondContact O-N 3.31Å; Q462-A465 WeakPolarHBondContact O-CB 3.35Å; Q462-A465 PolarHBondContact O-N 3.06Å; A465-R467 PolarHBondContact O-N 3.5Å; A465-A468 PolarHBondContact O-N 3.3Å; A465-R469 PolarHBondContact O-N 2.88Å
466	T	84.6	Confident	89.2	Confident	83 Å²	83	82.1 Å²	82.1	51%	0.509	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-40.7	179.5	-56.2	0	0	0	0	112.1	H464 R469 L470 W502	H464-T466 PolarHBondContact O-N 2.7Å; T466-R469 PolarHBondContact O-N 2.99Å; T466-L470 PolarHBondContact O-N 2.81Å; T466-W502 HydrophobicContact CG2-CH2 4.46Å; T466-W502 HydrophobicContact CG2-CZ2 3.75Å; T466-W502 WeakPolarHBondContact O-CZ2 3.31Å
467	R	86.5	Confident	89.5	Confident	146 Å²	146	80.4 Å²	80.4	55%	0.551	42%	0.419	S	S	*	.	H	α-helix	trans	-71.6	-37.1	177.8	-170.5	176.8	-172.9	-176.9	1.1	111.6	H464 A465 R469 L470 R471	H464-R467 PolarHBondContact O-N 2.67Å; H464-R467 VanDerWaalsContact O-N 3.1Å; A465-R467 PolarHBondContact O-N 3.5Å; R467-R469 VanDerWaalsContact C-N 3.32Å; R467-L470 PolarHBondContact O-N 3.25Å; R467-R471 WeakPolarHBondContact O-CG 3.32Å; R467-R471 PolarHBondContact O-N 2.93Å
468	A	89.8	Confident	89.7	Confident	51 Å²	51	83.7 Å²	83.7	42%	0.421	43%	0.425	S	S	.	.	H	α-helix	trans	-60.6	-43.1	174.4	0	0	0	0	0	110.8	H464 A465 L470 R471 Q472	H464-A468 WeakPolarHBondContact O-CB 3.34Å; H464-A468 PolarHBondContact O-N 3.36Å; A465-A468 PolarHBondContact O-N 3.3Å; A468-L470 PolarHBondContact O-N 3.2Å; A468-R471 PolarHBondContact O-N 3.47Å; A468-Q472 WeakPolarHBondContact O-CB 3.38Å; A468-Q472 PolarHBondContact O-N 3Å
469	R	88.8	Confident	90.1	Very high	160 Å²	160	84.6 Å²	84.6	60%	0.604	43%	0.427	S	S	*	.	H	α-helix	trans	-60	-44.8	175	-172.5	177	-178.7	178.6	0.4	112.8	A465 T466 R467 Q472 L473 W502	A465-R469 PolarHBondContact O-N 2.88Å; T466-R469 PolarHBondContact O-N 2.99Å; R467-R469 VanDerWaalsContact C-N 3.32Å; R469-Q472 PolarHBondContact O-N 3.36Å; R469-L473 WeakPolarHBondContact O-CB 3.19Å; R469-L473 PolarHBondContact O-N 2.94Å; R469-W502 HydrophobicContact CB-CH2 4.31Å; R469-W502 HydrophobicContact CG-CH2 4.23Å
470	L	88.2	Confident	90.5	Very high	45 Å²	45	85.6 Å²	85.6	24%	0.236	43%	0.431	C	S	.	.	H	α-helix	trans	-60.2	-46.6	174.1	173.8	60.2	0	0	0	111.6	T466 R467 A468 Q472 L473 M474 W502	T466-L470 PolarHBondContact O-N 2.81Å; R467-L470 PolarHBondContact O-N 3.25Å; A468-L470 PolarHBondContact O-N 3.2Å; L470-Q472 VanDerWaalsContact C-N 3.33Å; L470-Q472 PolarHBondContact O-N 3.28Å; L470-L473 PolarHBondContact O-N 3.02Å; L470-M474 WeakPolarHBondContact O-CB 3.42Å; L470-M474 PolarHBondContact O-N 3.03Å; L470-W502 HydrophobicContact CB-CD2 4.16Å; L470-W502 HydrophobicContact CB-CH2 4.27Å; L470-W502 HydrophobicContact CB-CZ2 3.76Å; L470-W502 HydrophobicContact CD1-CB 4.02Å; L470-W502 HydrophobicContact CD1-CD2 3.72Å; L470-W502 HydrophobicContact CD1-CE3 4.19Å; L470-W502 HydrophobicContact CD1-CG 3.61Å; L470-W502 HydrophobicContact CD2-CG 4.21Å; L470-W502 HydrophobicContact CG-CD2 4.33Å; L470-W502 HydrophobicContact CG-CG 4.34Å
471	R	91.9	Very high	91	Very high	155 Å²	155	81.6 Å²	81.6	59%	0.585	41%	0.41	S	S	*	.	H	α-helix	trans	-61.6	-43.2	179.6	-75.3	179.6	179.4	172.8	-1	111.5	R467 A468 M474 S475	R467-R471 WeakPolarHBondContact O-CG 3.32Å; R467-R471 PolarHBondContact O-N 2.93Å; A468-R471 PolarHBondContact O-N 3.47Å; R471-M474 PolarHBondContact O-N 3.02Å; R471-S475 WeakPolarHBondContact O-CB 3.34Å; R471-S475 PolarHBondContact O-N 3.34Å
472	Q	93.5	Very high	91.3	Very high	119 Å²	119	84.9 Å²	84.9	56%	0.556	42%	0.416	S	S	*	.	H	α-helix	trans	-61.7	-49.2	176.6	-176	178.5	-5.5	0	0	111.1	A468 R469 L470 M474 S475 S476	A468-Q472 WeakPolarHBondContact O-CB 3.38Å; A468-Q472 PolarHBondContact O-N 3Å; R469-Q472 PolarHBondContact O-N 3.36Å; L470-Q472 VanDerWaalsContact C-N 3.33Å; L470-Q472 PolarHBondContact O-N 3.28Å; Q472-M474 VanDerWaalsContact C-N 3.34Å; Q472-M474 PolarHBondContact O-N 3.49Å; Q472-S475 WeakPolarHBondContact O-CB 3.47Å; Q472-S475 PolarHBondContact O-N 2.8Å; Q472-S476 PolarHBondContact O-N 2.99Å; Q472-S476 PolarHBondContact O-OG 3.47Å
473	L	91.9	Very high	91.8	Very high	42 Å²	42	85.9 Å²	85.9	22%	0.22	42%	0.424	C	S	.	.	H	α-helix	trans	-56.1	-48.3	175.7	174.4	60.6	0	0	0	111.5	R469 L470 S475 S476 V477 V498 L767	R469-L473 WeakPolarHBondContact O-CB 3.19Å; R469-L473 PolarHBondContact O-N 2.94Å; L470-L473 PolarHBondContact O-N 3.02Å; L473-S475 VanDerWaalsContact C-N 3.33Å; L473-S475 PolarHBondContact O-N 3.03Å; L473-S476 PolarHBondContact O-N 3.26Å; L473-V477 HydrophobicContact CD1-CG2 4.16Å; L473-V477 VanDerWaalsContact O-CG2 3.29Å; L473-V477 WeakPolarHBondContact O-CG2 3.47Å; L473-V477 PolarHBondContact O-N 3.24Å; L473-V498 HydrophobicContact CD2-CG1 4.05Å; L473-V498 HydrophobicContact CG-CG1 4.3Å; L473-L767 HydrophobicContact CD1-CD2 3.35Å; L473-L767 HydrophobicContact CD2-CD2 4.3Å; L473-L767 HydrophobicContact CG-CD2 4.48Å
474	M	93.5	Very high	92.5	Very high	29 Å²	29	87 Å²	87	14%	0.143	42%	0.422	C	S	.	.	H	α-helix	trans	-64	-37.2	179.9	-174.1	57.7	65.9	0	0	112.3	L470 R471 Q472 K478 I495 V498 T499	L470-M474 WeakPolarHBondContact O-CB 3.42Å; L470-M474 PolarHBondContact O-N 3.03Å; R471-M474 PolarHBondContact O-N 3.02Å; Q472-M474 VanDerWaalsContact C-N 3.34Å; Q472-M474 PolarHBondContact O-N 3.49Å; M474-K478 HydrophobicContact CG-CD 4.5Å; M474-K478 WeakPolarHBondContact O-CG 3.24Å; M474-K478 PolarHBondContact O-N 3.07Å; M474-I495 HydrophobicContact CE-CG2 4.28Å; M474-I495 HydrophobicContact SD-CG1 4.38Å; M474-I495 HydrophobicContact SD-CG2 4.07Å; M474-V498 HydrophobicContact CE-CB 4.31Å; M474-V498 HydrophobicContact CE-CG1 3.93Å; M474-T499 WeakPolarHBondContact CE-OG1 3.42Å
475	S	95.4	Very high	92.8	Very high	61 Å²	61	91 Å²	91	43%	0.427	44%	0.441	S	S	.	.	H	α-helix	trans	-61.9	-50.9	173.3	-164.4	0	0	0	0	110.7	R471 Q472 L473 V477 K478 D479	R471-S475 WeakPolarHBondContact O-CB 3.34Å; R471-S475 PolarHBondContact O-N 3.34Å; Q472-S475 WeakPolarHBondContact O-CB 3.47Å; Q472-S475 PolarHBondContact O-N 2.8Å; L473-S475 VanDerWaalsContact C-N 3.33Å; L473-S475 PolarHBondContact O-N 3.03Å; S475-V477 VanDerWaalsContact C-N 3.3Å; S475-V477 PolarHBondContact O-N 3.4Å; S475-K478 PolarHBondContact O-N 3.05Å; S475-K478 VanDerWaalsContact O-N 3.12Å; S475-D479 VanDerWaalsContact O-CG 3.25Å; S475-D479 PolarHBondContact O-N 3.08Å
476	S	95.5	Very high	93.2	Very high	66 Å²	66	90.1 Å²	90.1	46%	0.462	43%	0.43	S	S	.	.	H	α-helix	trans	-60.6	-38.2	179.1	-59.2	0	0	0	0	112.7	Q472 L473 F480	Q472-S476 PolarHBondContact O-N 2.99Å; Q472-S476 PolarHBondContact O-OG 3.47Å; L473-S476 PolarHBondContact O-N 3.26Å; S476-F480 WeakPolarHBondContact O-CB 3.36Å; S476-F480 PolarHBondContact O-N 2.86Å
477	V	95.2	Very high	93.7	Very high	23 Å²	23	90.5 Å²	90.5	14%	0.139	43%	0.434	C	S	.	.	H	α-helix	trans	-63.6	-47.2	174	170.1	0	0	0	0	110.7	L473 S475 D479 F480 L481 V494 V498	L473-V477 HydrophobicContact CD1-CG2 4.16Å; L473-V477 VanDerWaalsContact O-CG2 3.29Å; L473-V477 WeakPolarHBondContact O-CG2 3.47Å; L473-V477 PolarHBondContact O-N 3.24Å; S475-V477 VanDerWaalsContact C-N 3.3Å; S475-V477 PolarHBondContact O-N 3.4Å; V477-D479 PolarHBondContact O-N 3.13Å; V477-F480 WeakPolarHBondContact O-CB 3.39Å; V477-F480 PolarHBondContact O-N 2.99Å; V477-L481 HydrophobicContact CG1-CD1 3.89Å; V477-L481 HydrophobicContact CG1-CG 4.38Å; V477-L481 WeakPolarHBondContact O-CG 3.1Å; V477-L481 PolarHBondContact O-N 3.28Å; V477-V494 HydrophobicContact CG1-CG1 3.84Å; V477-V498 HydrophobicContact CG2-CG2 4.3Å
478	K	95.4	Very high	94.1	Very high	113 Å²	113	90.9 Å²	90.9	49%	0.491	44%	0.44	S	S	.	.	H	α-helix	trans	-63.5	-40.9	178	-74.2	179.5	178.2	-173.1	0	112.5	M474 S475 L481 R482 I495	M474-K478 HydrophobicContact CG-CD 4.5Å; M474-K478 WeakPolarHBondContact O-CG 3.24Å; M474-K478 PolarHBondContact O-N 3.07Å; S475-K478 PolarHBondContact O-N 3.05Å; S475-K478 VanDerWaalsContact O-N 3.12Å; K478-L481 PolarHBondContact O-N 3.44Å; K478-R482 WeakPolarHBondContact O-CB 3.4Å; K478-R482 PolarHBondContact O-N 3.4Å; K478-I495 HydrophobicContact CG-CD1 4.32Å
479	D	95.9	Very high	94.1	Very high	78 Å²	78	96 Å²	96	42%	0.417	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-44.1	176.2	-66.8	-28.6	0	0	0	110.5	S475 V477 R482 I483	S475-D479 VanDerWaalsContact O-CG 3.25Å; S475-D479 PolarHBondContact O-N 3.08Å; V477-D479 PolarHBondContact O-N 3.13Å; D479-R482 PolarHBondContact O-N 2.94Å; D479-I483 WeakPolarHBondContact O-CB 3.27Å; D479-I483 WeakPolarHBondContact O-CD1 3.34Å; D479-I483 WeakPolarHBondContact O-CG1 3.28Å; D479-I483 PolarHBondContact O-N 3.41Å
480	F	96.2	Very high	94.2	Very high	50 Å²	50	92.3 Å²	92.3	22%	0.219	45%	0.447	C	S	.	.	H	α-helix	trans	-58.7	-48.9	174.3	175.9	-92.8	0	0	0	112.2	S476 V477 R482 I483 H484 W763 L766	S476-F480 WeakPolarHBondContact O-CB 3.36Å; S476-F480 PolarHBondContact O-N 2.86Å; V477-F480 WeakPolarHBondContact O-CB 3.39Å; V477-F480 PolarHBondContact O-N 2.99Å; F480-R482 VanDerWaalsContact C-N 3.26Å; F480-R482 PolarHBondContact O-N 3.17Å; F480-I483 PolarHBondContact O-N 3.26Å; F480-H484 AromaticContact CD2-CD2 3.46Å; F480-H484 VanDerWaalsContact CD2-CD2 3.46Å; F480-H484 WeakPolarHBondContact CD2-CD2 3.23Å; F480-H484 AromaticContact CD2-NE2 3.76Å; F480-H484 AromaticContact CE2-CD2 3.26Å; F480-H484 WeakPolarHBondContact CE2-CD2 3.36Å; F480-H484 AromaticContact CE2-NE2 3.41Å; F480-H484 WeakPolarHBondContact CE2-NE2 3.27Å; F480-H484 AromaticContact CZ-CD2 3.7Å; F480-H484 PolarHBondContact O-CD2 2.82Å; F480-H484 PolarHBondContact O-N 3.35Å; F480-H484 VanDerWaalsContact O-N 3.11Å; F480-W763 HydrophobicContact CE1-CH2 4.01Å; F480-W763 HydrophobicContact CE1-CZ3 4Å; F480-W763 HydrophobicContact CZ-CH2 4.37Å; F480-W763 HydrophobicContact CZ-CZ3 4.39Å; F480-L766 HydrophobicContact CD2-CD1 4.09Å; F480-L766 HydrophobicContact CD2-CD2 3.56Å; F480-L766 HydrophobicContact CD2-CG 4.47Å; F480-L766 HydrophobicContact CE1-CD1 4.11Å; F480-L766 HydrophobicContact CE2-CD1 3.6Å; F480-L766 HydrophobicContact CE2-CD2 3.84Å; F480-L766 HydrophobicContact CE2-CG 4.31Å; F480-L766 HydrophobicContact CG-CD2 4.14Å; F480-L766 HydrophobicContact CZ-CD1 3.62Å
481	L	96.1	Very high	94.4	Very high	13 Å²	13	91 Å²	91	7%	0.068	44%	0.442	C	S	.	.	H	α-helix	trans	-60.7	-37.4	179.1	-67.7	170.1	0	0	0	111.7	V477 K478 E485 V486 A491 V494 I495	V477-L481 HydrophobicContact CG1-CD1 3.89Å; V477-L481 HydrophobicContact CG1-CG 4.38Å; V477-L481 WeakPolarHBondContact O-CG 3.1Å; V477-L481 PolarHBondContact O-N 3.28Å; K478-L481 PolarHBondContact O-N 3.44Å; L481-E485 PolarHBondContact O-N 3.21Å; L481-V486 HydrophobicContact CB-CB 4.48Å; L481-V486 HydrophobicContact CD2-CB 3.91Å; L481-V486 HydrophobicContact CD2-CG1 3.88Å; L481-V486 HydrophobicContact CD2-CG2 3.93Å; L481-V486 PolarHBondContact O-N 3.44Å; L481-A491 HydrophobicContact CB-CB 4.44Å; L481-A491 HydrophobicContact CD1-CB 3.98Å; L481-A491 HydrophobicContact CD2-CB 4.19Å; L481-A491 HydrophobicContact CG-CB 4.43Å; L481-V494 HydrophobicContact CD1-CB 4.46Å; L481-V494 HydrophobicContact CD1-CG1 4.35Å; L481-V494 HydrophobicContact CD2-CB 4.34Å; L481-V494 HydrophobicContact CD2-CG1 4.35Å; L481-V494 HydrophobicContact CD2-CG2 4.46Å; L481-I495 HydrophobicContact CD1-CD1 4.12Å; L481-I495 HydrophobicContact CD1-CG1 3.96Å
482	R	94.8	Very high	94.4	Very high	207 Å²	207	88.4 Å²	88.4	78%	0.781	44%	0.437	S	S	*	.	H	α-helix	trans	-71.6	-46.5	177.1	-176.1	-178.4	177.8	-175.8	-0.1	112.5	K478 D479 F480 H484 E485	K478-R482 WeakPolarHBondContact O-CB 3.4Å; K478-R482 PolarHBondContact O-N 3.4Å; D479-R482 PolarHBondContact O-N 2.94Å; F480-R482 VanDerWaalsContact C-N 3.26Å; F480-R482 PolarHBondContact O-N 3.17Å; R482-H484 VanDerWaalsContact C-N 3.26Å; R482-H484 PolarHBondContact O-N 2.99Å; R482-E485 PolarHBondContact O-N 2.76Å
483	I	96.5	Very high	94.1	Very high	125 Å²	125	88 Å²	88	64%	0.641	43%	0.43	S	S	*	.	H	α-helix	trans	-61.6	-36.9	-177.9	-72.6	164.1	0	0	0	111.1	D479 F480	D479-I483 WeakPolarHBondContact O-CB 3.27Å; D479-I483 WeakPolarHBondContact O-CD1 3.34Å; D479-I483 WeakPolarHBondContact O-CG1 3.28Å; D479-I483 PolarHBondContact O-N 3.41Å; F480-I483 PolarHBondContact O-N 3.26Å
484	H	96.1	Very high	94	Very high	116 Å²	116	87.6 Å²	87.6	54%	0.537	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	10.3	-178.7	-69.5	-71.2	0	0	0	114	F480 R482 V486	F480-H484 AromaticContact CD2-CD2 3.46Å; F480-H484 VanDerWaalsContact CD2-CD2 3.46Å; F480-H484 WeakPolarHBondContact CD2-CD2 3.23Å; F480-H484 AromaticContact CD2-NE2 3.76Å; F480-H484 AromaticContact CE2-CD2 3.26Å; F480-H484 WeakPolarHBondContact CE2-CD2 3.36Å; F480-H484 AromaticContact CE2-NE2 3.41Å; F480-H484 WeakPolarHBondContact CE2-NE2 3.27Å; F480-H484 AromaticContact CZ-CD2 3.7Å; F480-H484 PolarHBondContact O-CD2 2.82Å; F480-H484 PolarHBondContact O-N 3.35Å; F480-H484 VanDerWaalsContact O-N 3.11Å; R482-H484 VanDerWaalsContact C-N 3.26Å; R482-H484 PolarHBondContact O-N 2.99Å; H484-V486 HydrophobicContact CB-CG2 4Å; H484-V486 PolarHBondContact O-N 2.92Å; H484-V486 VanDerWaalsContact O-N 3.13Å
485	E	95.4	Very high	94	Very high	178 Å²	178	88.3 Å²	88.3	83%	0.832	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	41.5	178.2	-58.9	-176.7	160.8	0	0	112.8	L481 R482	L481-E485 PolarHBondContact O-N 3.21Å; R482-E485 PolarHBondContact O-N 2.76Å
486	V	95.4	Very high	93.6	Very high	33 Å²	33	90 Å²	90	20%	0.2	44%	0.438	C	S	.	.			trans	-64.7	133	-175	178.9	0	0	0	0	109.9	L481 H484 K488 L490 A491	L481-V486 HydrophobicContact CB-CB 4.48Å; L481-V486 HydrophobicContact CD2-CB 3.91Å; L481-V486 HydrophobicContact CD2-CG1 3.88Å; L481-V486 HydrophobicContact CD2-CG2 3.93Å; L481-V486 PolarHBondContact O-N 3.44Å; H484-V486 HydrophobicContact CB-CG2 4Å; H484-V486 PolarHBondContact O-N 2.92Å; H484-V486 VanDerWaalsContact O-N 3.13Å; V486-K488 PolarHBondContact O-N 3.37Å; V486-L490 HydrophobicContact CG1-CB 3.9Å; V486-L490 HydrophobicContact CG1-CD2 3.8Å; V486-L490 HydrophobicContact CG1-CG 3.85Å; V486-A491 HydrophobicContact CG1-CB 4.4Å
487	P	96	Very high	93.1	Very high	90 Å²	90	92.1 Å²	92.1	58%	0.584	44%	0.436	S	S	*	.			trans	-52.7	140.3	177.5	-27.7	34.6	0	0	0	112.3	E489 L490 A491	P487-E489 VanDerWaalsContact C-N 3.25Å; P487-E489 PolarHBondContact O-N 3.16Å; P487-E489 VanDerWaalsContact O-N 3.15Å; P487-L490 PolarHBondContact O-N 3.06Å; P487-A491 PolarHBondContact O-N 2.96Å
488	K	93.7	Very high	92.8	Very high	155 Å²	155	92 Å²	92	67%	0.674	44%	0.436	S	S	*	.	H	α-helix	trans	-52.7	-42	-173.1	-175	179.3	170.8	-174.2	0	113	V486 L490 A491 E492	V486-K488 PolarHBondContact O-N 3.37Å; K488-L490 PolarHBondContact O-N 3.36Å; K488-A491 PolarHBondContact O-N 3.42Å; K488-E492 WeakPolarHBondContact CE-OE1 3.49Å; K488-E492 HydrophobicContact CG-CG 4.48Å; K488-E492 IonicContact NZ-OE1 3.22Å; K488-E492 WeakPolarHBondContact O-CG 3.4Å; K488-E492 PolarHBondContact O-N 3.29Å
489	E	90.7	Very high	92.4	Very high	157 Å²	157	90 Å²	90	73%	0.734	43%	0.433	S	S	*	.	H	α-helix	trans	-61.4	-43.7	179.1	-62.5	178	-176.7	0	0	112.5	P487 R493	P487-E489 VanDerWaalsContact C-N 3.25Å; P487-E489 PolarHBondContact O-N 3.16Å; P487-E489 VanDerWaalsContact O-N 3.15Å; E489-R493 VanDerWaalsContact O-CG 3.31Å; E489-R493 WeakPolarHBondContact O-CG 3.41Å; E489-R493 PolarHBondContact O-N 2.96Å
490	L	90.4	Very high	91.8	Very high	84 Å²	84	87.2 Å²	87.2	44%	0.44	42%	0.42	S	S	.	.	H	α-helix	trans	-71.5	-37.9	177.2	-179.9	60.2	0	0	0	111	V486 P487 K488 R493 V494	V486-L490 HydrophobicContact CG1-CB 3.9Å; V486-L490 HydrophobicContact CG1-CD2 3.8Å; V486-L490 HydrophobicContact CG1-CG 3.85Å; P487-L490 PolarHBondContact O-N 3.06Å; K488-L490 PolarHBondContact O-N 3.36Å; L490-R493 PolarHBondContact O-N 3.48Å; L490-V494 HydrophobicContact CD1-CG2 4.35Å; L490-V494 VanDerWaalsContact O-CG2 3.29Å; L490-V494 WeakPolarHBondContact O-CG2 3.48Å; L490-V494 PolarHBondContact O-N 3.43Å
491	A	92.7	Very high	91.2	Very high	16 Å²	16	86.6 Å²	86.6	13%	0.132	42%	0.421	C	S	.	.	H	α-helix	trans	-61.4	-45.4	176.6	0	0	0	0	0	112.3	L481 V486 P487 K488 V494 I495	L481-A491 HydrophobicContact CB-CB 4.44Å; L481-A491 HydrophobicContact CD1-CB 3.98Å; L481-A491 HydrophobicContact CD2-CB 4.19Å; L481-A491 HydrophobicContact CG-CB 4.43Å; V486-A491 HydrophobicContact CG1-CB 4.4Å; P487-A491 PolarHBondContact O-N 2.96Å; K488-A491 PolarHBondContact O-N 3.42Å; A491-V494 PolarHBondContact O-N 3.26Å; A491-I495 VanDerWaalsContact O-CG1 3.32Å; A491-I495 WeakPolarHBondContact O-CG1 3.29Å; A491-I495 PolarHBondContact O-N 3.36Å
492	E	91.2	Very high	90.7	Very high	101 Å²	101	88 Å²	88	47%	0.472	43%	0.426	S	S	.	.	H	α-helix	trans	-61.1	-46.2	175.5	-75	178	175.8	0	0	111.1	K488 V494 I495 D496	K488-E492 WeakPolarHBondContact CE-OE1 3.49Å; K488-E492 HydrophobicContact CG-CG 4.48Å; K488-E492 IonicContact NZ-OE1 3.22Å; K488-E492 WeakPolarHBondContact O-CG 3.4Å; K488-E492 PolarHBondContact O-N 3.29Å; E492-V494 PolarHBondContact O-N 2.91Å; E492-I495 PolarHBondContact O-N 3.19Å; E492-I495 VanDerWaalsContact O-N 3.16Å; E492-D496 PolarHBondContact O-N 2.93Å
493	R	88	Confident	90.2	Very high	111 Å²	111	81 Å²	81	42%	0.419	41%	0.408	S	S	.	.	H	α-helix	trans	-58.3	-43.2	175.6	-72.9	178.2	67.4	167.5	8.8	113.3	E489 L490 I495 D496 Y497 G563 D564	E489-R493 VanDerWaalsContact O-CG 3.31Å; E489-R493 WeakPolarHBondContact O-CG 3.41Å; E489-R493 PolarHBondContact O-N 2.96Å; L490-R493 PolarHBondContact O-N 3.48Å; R493-I495 VanDerWaalsContact C-N 3.35Å; R493-D496 PolarHBondContact O-N 3.42Å; R493-Y497 WeakPolarHBondContact O-CB 3.26Å; R493-Y497 PolarHBondContact O-N 3.35Å; R493-G563 PolarHBondContact NH2-O 2.95Å; R493-D564 IonicContact CZ-OD1 3.89Å; R493-D564 IonicContact NE-OD1 3.7Å; R493-D564 IonicContact NH2-OD1 2.7Å; R493-D564 PolarHBondContact NH2-OD1 3.28Å
494	V	90.5	Very high	89.5	Confident	34 Å²	34	79 Å²	79	21%	0.206	40%	0.398	C	S	.	.	H	α-helix	trans	-63.8	-41.9	177.6	170.6	0	0	0	0	110.9	V477 L481 L490 A491 E492 Y497 V498	V477-V494 HydrophobicContact CG1-CG1 3.84Å; L481-V494 HydrophobicContact CD1-CB 4.46Å; L481-V494 HydrophobicContact CD1-CG1 4.35Å; L481-V494 HydrophobicContact CD2-CB 4.34Å; L481-V494 HydrophobicContact CD2-CG1 4.35Å; L481-V494 HydrophobicContact CD2-CG2 4.46Å; L490-V494 HydrophobicContact CD1-CG2 4.35Å; L490-V494 VanDerWaalsContact O-CG2 3.29Å; L490-V494 WeakPolarHBondContact O-CG2 3.48Å; L490-V494 PolarHBondContact O-N 3.43Å; A491-V494 PolarHBondContact O-N 3.26Å; E492-V494 PolarHBondContact O-N 2.91Å; V494-Y497 PolarHBondContact O-N 3.34Å; V494-V498 VanDerWaalsContact O-CG2 3.31Å; V494-V498 WeakPolarHBondContact O-CG2 3.22Å; V494-V498 PolarHBondContact O-N 3.11Å
495	I	91.9	Very high	89	Confident	44 Å²	44	75.8 Å²	75.8	23%	0.226	39%	0.387	C	S	.	.	H	α-helix	trans	-64.8	-43	178.3	-70.3	167.5	0	0	0	111	M474 K478 L481 A491 E492 R493 V498 T499	M474-I495 HydrophobicContact CE-CG2 4.28Å; M474-I495 HydrophobicContact SD-CG1 4.38Å; M474-I495 HydrophobicContact SD-CG2 4.07Å; K478-I495 HydrophobicContact CG-CD1 4.32Å; L481-I495 HydrophobicContact CD1-CD1 4.12Å; L481-I495 HydrophobicContact CD1-CG1 3.96Å; A491-I495 VanDerWaalsContact O-CG1 3.32Å; A491-I495 WeakPolarHBondContact O-CG1 3.29Å; A491-I495 PolarHBondContact O-N 3.36Å; E492-I495 PolarHBondContact O-N 3.19Å; E492-I495 VanDerWaalsContact O-N 3.16Å; R493-I495 VanDerWaalsContact C-N 3.35Å; I495-V498 PolarHBondContact O-N 2.93Å; I495-T499 WeakPolarHBondContact O-CB 3.23Å; I495-T499 PolarHBondContact O-N 3.46Å; I495-T499 PolarHBondContact O-OG1 3.33Å
496	D	87.5	Confident	88.3	Confident	97 Å²	97	74.2 Å²	74.2	52%	0.519	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-40.6	178	-73	-15	0	0	0	111.6	E492 R493 T499 S500	E492-D496 PolarHBondContact O-N 2.93Å; R493-D496 PolarHBondContact O-N 3.42Å; D496-T499 PolarHBondContact O-N 3.34Å; D496-S500 VanDerWaalsContact O-CB 3.29Å; D496-S500 WeakPolarHBondContact O-CB 3.25Å; D496-S500 PolarHBondContact O-N 3.38Å; D496-S500 PolarHBondContact O-OG 3.14Å
497	Y	85.3	Confident	87.5	Confident	110 Å²	110	73.6 Å²	73.6	43%	0.431	38%	0.377	S	S	.	.	H	α-helix	trans	-60.1	-49.6	173.2	172.6	-99.7	0	0	0	111.9	R493 V494 T499 S500 S501	R493-Y497 WeakPolarHBondContact O-CB 3.26Å; R493-Y497 PolarHBondContact O-N 3.35Å; V494-Y497 PolarHBondContact O-N 3.34Å; Y497-T499 VanDerWaalsContact C-N 3.31Å; Y497-T499 PolarHBondContact O-N 3.01Å; Y497-S500 WeakPolarHBondContact CA-OG 3.42Å; Y497-S500 PolarHBondContact O-N 3.12Å; Y497-S500 PolarHBondContact O-OG 2.79Å; Y497-S501 WeakPolarHBondContact O-CB 3.38Å; Y497-S501 PolarHBondContact O-N 2.89Å
498	V	88.3	Confident	87	Confident	21 Å²	21	73 Å²	73	13%	0.127	37%	0.371	C	S	.	.	H	α-helix	trans	-63.3	-40	179.7	172.8	0	0	0	0	111	L473 M474 V477 V494 I495 W502	L473-V498 HydrophobicContact CD2-CG1 4.05Å; L473-V498 HydrophobicContact CG-CG1 4.3Å; M474-V498 HydrophobicContact CE-CB 4.31Å; M474-V498 HydrophobicContact CE-CG1 3.93Å; V477-V498 HydrophobicContact CG2-CG2 4.3Å; V494-V498 VanDerWaalsContact O-CG2 3.31Å; V494-V498 WeakPolarHBondContact O-CG2 3.22Å; V494-V498 PolarHBondContact O-N 3.11Å; I495-V498 PolarHBondContact O-N 2.93Å; V498-W502 WeakPolarHBondContact O-CB 3.36Å; V498-W502 PolarHBondContact O-N 3.36Å
499	T	88.4	Confident	86.6	Confident	71 Å²	71	69.6 Å²	69.6	44%	0.436	36%	0.361	S	S	.	.	H	α-helix	trans	-67.5	-47.3	179.7	-57.7	0	0	0	0	111.8	M474 I495 D496 Y497 W502 S503	M474-T499 WeakPolarHBondContact CE-OG1 3.42Å; I495-T499 WeakPolarHBondContact O-CB 3.23Å; I495-T499 PolarHBondContact O-N 3.46Å; I495-T499 PolarHBondContact O-OG1 3.33Å; D496-T499 PolarHBondContact O-N 3.34Å; Y497-T499 VanDerWaalsContact C-N 3.31Å; Y497-T499 PolarHBondContact O-N 3.01Å; T499-W502 PolarHBondContact O-N 2.93Å; T499-S503 WeakPolarHBondContact O-CB 3.39Å; T499-S503 PolarHBondContact O-N 3.06Å
500	S	83.1	Confident	86.3	Confident	19 Å²	19	65.5 Å²	65.5	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-65.4	-47.2	178.3	58	0	0	0	0	111.6	D496 Y497 W502 S503 I504	D496-S500 VanDerWaalsContact O-CB 3.29Å; D496-S500 WeakPolarHBondContact O-CB 3.25Å; D496-S500 PolarHBondContact O-N 3.38Å; D496-S500 PolarHBondContact O-OG 3.14Å; Y497-S500 WeakPolarHBondContact CA-OG 3.42Å; Y497-S500 PolarHBondContact O-N 3.12Å; Y497-S500 PolarHBondContact O-OG 2.79Å; S500-W502 VanDerWaalsContact C-N 3.32Å; S500-W502 PolarHBondContact O-N 3.1Å; S500-S503 WeakPolarHBondContact O-CB 3.31Å; S500-S503 PolarHBondContact O-N 3.34Å; S500-S503 PolarHBondContact O-OG 3.42Å; S500-I504 WeakPolarHBondContact O-CG1 3.33Å; S500-I504 PolarHBondContact O-N 3.06Å; S500-I504 VanDerWaalsContact O-N 3.13Å
501	S	83.6	Confident	86	Confident	36 Å²	36	65.8 Å²	65.8	25%	0.252	35%	0.346	S	S	.	.	H	α-helix	trans	-57.4	-43.2	176.9	-177.8	0	0	0	0	112.2	Y497 S503 I504 T505	Y497-S501 WeakPolarHBondContact O-CB 3.38Å; Y497-S501 PolarHBondContact O-N 2.89Å; S501-S503 PolarHBondContact O-N 2.97Å; S501-I504 PolarHBondContact O-N 3Å; S501-T505 WeakPolarHBondContact O-CB 3.43Å; S501-T505 WeakPolarHBondContact O-CG2 3.29Å; S501-T505 PolarHBondContact O-N 3.14Å; S501-T505 PolarHBondContact O-OG1 3Å
502	W	86	Confident	85.8	Confident	44 Å²	44	68.2 Å²	68.2	17%	0.167	36%	0.359	C	S	.	.	H	α-helix	trans	-65	-38.4	174.5	-174.7	-88.3	0	0	0	112.7	T466 R469 L470 V498 T499 S500 I504 K506 G507	T466-W502 HydrophobicContact CG2-CH2 4.46Å; T466-W502 HydrophobicContact CG2-CZ2 3.75Å; T466-W502 WeakPolarHBondContact O-CZ2 3.31Å; R469-W502 HydrophobicContact CB-CH2 4.31Å; R469-W502 HydrophobicContact CG-CH2 4.23Å; L470-W502 HydrophobicContact CB-CD2 4.16Å; L470-W502 HydrophobicContact CB-CH2 4.27Å; L470-W502 HydrophobicContact CB-CZ2 3.76Å; L470-W502 HydrophobicContact CD1-CB 4.02Å; L470-W502 HydrophobicContact CD1-CD2 3.72Å; L470-W502 HydrophobicContact CD1-CE3 4.19Å; L470-W502 HydrophobicContact CD1-CG 3.61Å; L470-W502 HydrophobicContact CD2-CG 4.21Å; L470-W502 HydrophobicContact CG-CD2 4.33Å; L470-W502 HydrophobicContact CG-CG 4.34Å; V498-W502 WeakPolarHBondContact O-CB 3.36Å; V498-W502 PolarHBondContact O-N 3.36Å; T499-W502 PolarHBondContact O-N 2.93Å; S500-W502 VanDerWaalsContact C-N 3.32Å; S500-W502 PolarHBondContact O-N 3.1Å; W502-I504 VanDerWaalsContact C-N 3.25Å; W502-I504 PolarHBondContact O-N 3.32Å; W502-K506 VanDerWaalsContact O-CA 3.27Å; W502-K506 WeakPolarHBondContact O-CA 3.29Å; W502-K506 PolarHBondContact O-N 3.45Å; W502-G507 VanDerWaalsContact CZ3-CA 3.43Å
503	S	84.5	Confident	85.8	Confident	58 Å²	58	66.1 Å²	66.1	41%	0.406	35%	0.353	S	S	.	.	H	α-helix	trans	-63.3	-33	-179.9	82.7	0	0	0	0	112.7	T499 S500 S501 K506	T499-S503 WeakPolarHBondContact O-CB 3.39Å; T499-S503 PolarHBondContact O-N 3.06Å; S500-S503 WeakPolarHBondContact O-CB 3.31Å; S500-S503 PolarHBondContact O-N 3.34Å; S500-S503 PolarHBondContact O-OG 3.42Å; S501-S503 PolarHBondContact O-N 2.97Å; S503-K506 WeakPolarHBondContact O-CD 3.32Å; S503-K506 VanDerWaalsContact O-CE 3.24Å; S503-K506 WeakPolarHBondContact O-CE 3.47Å; S503-K506 PolarHBondContact O-NZ 3.13Å
504	I	81.7	Confident	85.8	Confident	85 Å²	85	61.2 Å²	61.2	44%	0.436	34%	0.335	S	S	.	.	H	α-helix	trans	-82	-52.5	179.8	-63.9	167.6	0	0	0	110.5	S500 S501 W502 K506	S500-I504 WeakPolarHBondContact O-CG1 3.33Å; S500-I504 PolarHBondContact O-N 3.06Å; S500-I504 VanDerWaalsContact O-N 3.13Å; S501-I504 PolarHBondContact O-N 3Å; W502-I504 VanDerWaalsContact C-N 3.25Å; W502-I504 PolarHBondContact O-N 3.32Å; I504-K506 VanDerWaalsContact C-N 3.3Å; I504-K506 PolarHBondContact O-N 3.28Å
505	T	84.1	Confident	85.8	Confident	48 Å²	48	64.6 Å²	64.6	29%	0.294	35%	0.352	S	S	.	.	H	α-helix	trans	-76.6	-16	-175.9	58.9	0	0	0	0	113.6	S501 G507 V508	S501-T505 WeakPolarHBondContact O-CB 3.43Å; S501-T505 WeakPolarHBondContact O-CG2 3.29Å; S501-T505 PolarHBondContact O-N 3.14Å; S501-T505 PolarHBondContact O-OG1 3Å; T505-G507 PolarHBondContact O-N 2.99Å; T505-G507 VanDerWaalsContact O-N 3.09Å; T505-G507 PolarHBondContact OG1-N 2.87Å; T505-V508 WeakPolarHBondContact O-CB 3.41Å; T505-V508 PolarHBondContact O-N 3.22Å
506	K	81.8	Confident	85.7	Confident	145 Å²	145	70.4 Å²	70.4	63%	0.63	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	25.7	-171.3	-56.4	-58.6	-173.7	-158.3	0	113.4	W502 S503 I504 V508	W502-K506 VanDerWaalsContact O-CA 3.27Å; W502-K506 WeakPolarHBondContact O-CA 3.29Å; W502-K506 PolarHBondContact O-N 3.45Å; S503-K506 WeakPolarHBondContact O-CD 3.32Å; S503-K506 VanDerWaalsContact O-CE 3.24Å; S503-K506 WeakPolarHBondContact O-CE 3.47Å; S503-K506 PolarHBondContact O-NZ 3.13Å; I504-K506 VanDerWaalsContact C-N 3.3Å; I504-K506 PolarHBondContact O-N 3.28Å; K506-V508 VanDerWaalsContact C-N 3.33Å
507	G	79.2	Confident	85.8	Confident	19 Å²	19	67.4 Å²	67.4	20%	0.196	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	13.3	-177.3	0	0	0	0	0	115	W502 T505	W502-G507 VanDerWaalsContact CZ3-CA 3.43Å; T505-G507 PolarHBondContact O-N 2.99Å; T505-G507 VanDerWaalsContact O-N 3.09Å; T505-G507 PolarHBondContact OG1-N 2.87Å
508	V	84.8	Confident	86.2	Confident	78 Å²	78	65.7 Å²	65.7	47%	0.473	37%	0.366	S	S	.	.			trans	-86.9	123	174.5	-177.1	0	0	0	0	109.5	T505 K506 T510 V513	T505-V508 WeakPolarHBondContact O-CB 3.41Å; T505-V508 PolarHBondContact O-N 3.22Å; K506-V508 VanDerWaalsContact C-N 3.33Å; V508-T510 PolarHBondContact O-N 2.94Å; V508-V513 HydrophobicContact CG1-CG2 3.74Å
509	D	84.3	Confident	86.3	Confident	83 Å²	83	73.9 Å²	73.9	44%	0.444	40%	0.4	S	S	.	.			trans	-84.4	103.2	170	177.8	-6.9	0	0	0	109.7	Q511 T512 V513	D509-Q511 PolarHBondContact O-N 3.23Å; D509-Q511 PolarHBondContact OD1-N 3.37Å; D509-T512 HydrophobicContact CB-CG2 4.04Å; D509-T512 WeakPolarHBondContact CB-OG1 3.39Å; D509-T512 PolarHBondContact O-N 2.97Å; D509-T512 PolarHBondContact O-OG1 3.45Å; D509-T512 PolarHBondContact OD1-N 3.4Å; D509-T512 WeakPolarHBondContact OD2-CG2 3.46Å; D509-V513 PolarHBondContact O-N 3.3Å
510	T	85.5	Confident	86.4	Confident	72 Å²	72	75.2 Å²	75.2	44%	0.442	41%	0.405	S	S	.	.	H	α-helix	trans	-54	-38.2	-178.3	-49.1	0	0	0	0	112.9	V508 V513 L514	V508-T510 PolarHBondContact O-N 2.94Å; T510-V513 PolarHBondContact O-N 2.96Å; T510-L514 HydrophobicContact CG2-CD1 3.98Å; T510-L514 HydrophobicContact CG2-CG 4.43Å; T510-L514 WeakPolarHBondContact O-CB 3.44Å; T510-L514 VanDerWaalsContact O-CG 3.27Å; T510-L514 WeakPolarHBondContact O-CG 3.47Å; T510-L514 PolarHBondContact O-N 2.78Å
511	Q	84.7	Confident	86.8	Confident	90 Å²	90	79.3 Å²	79.3	42%	0.421	42%	0.423	S	S	.	.	H	α-helix	trans	-70.6	-40.1	-177.9	-70.3	-64.2	-20.3	0	0	111.3	D509 V513 L514 N515	D509-Q511 PolarHBondContact O-N 3.23Å; D509-Q511 PolarHBondContact OD1-N 3.37Å; Q511-V513 VanDerWaalsContact C-N 3.34Å; Q511-V513 PolarHBondContact O-N 3.21Å; Q511-L514 PolarHBondContact O-N 3.32Å; Q511-N515 WeakPolarHBondContact O-CB 3.26Å; Q511-N515 PolarHBondContact O-N 3.03Å; Q511-N515 PolarHBondContact O-ND2 3.45Å
512	T	88	Confident	87.3	Confident	66 Å²	66	79.5 Å²	79.5	41%	0.405	42%	0.419	S	S	.	.	H	α-helix	trans	-62.2	-43	176.1	62.9	0	0	0	0	111.7	D509 N515 H516	D509-T512 HydrophobicContact CB-CG2 4.04Å; D509-T512 WeakPolarHBondContact CB-OG1 3.39Å; D509-T512 PolarHBondContact O-N 2.97Å; D509-T512 PolarHBondContact O-OG1 3.45Å; D509-T512 PolarHBondContact OD1-N 3.4Å; D509-T512 WeakPolarHBondContact OD2-CG2 3.46Å; T512-N515 PolarHBondContact O-N 3.34Å; T512-H516 PolarHBondContact O-N 3.29Å; T512-H516 PolarHBondContact O-ND1 2.97Å
513	V	89.8	Confident	87.6	Confident	57 Å²	57	77.8 Å²	77.8	35%	0.345	41%	0.414	S	S	.	.	H	α-helix	trans	-63.8	-48.1	178.9	177.7	0	0	0	0	110.7	V508 D509 T510 Q511 N515 H516	V508-V513 HydrophobicContact CG1-CG2 3.74Å; D509-V513 PolarHBondContact O-N 3.3Å; T510-V513 PolarHBondContact O-N 2.96Å; Q511-V513 VanDerWaalsContact C-N 3.34Å; Q511-V513 PolarHBondContact O-N 3.21Å; V513-N515 PolarHBondContact O-N 3.22Å; V513-H516 PolarHBondContact O-N 3.01Å; V513-H516 VanDerWaalsContact O-N 3.13Å
514	L	89.7	Confident	88.1	Confident	8 Å²	8	78.3 Å²	78.3	4%	0.042	41%	0.412	C	S	.	.	H	α-helix	trans	-62.4	-30.6	179.8	-71.5	173.9	0	0	0	112.8	T510 Q511 H516 C517 K522 L525 L529	T510-L514 HydrophobicContact CG2-CD1 3.98Å; T510-L514 HydrophobicContact CG2-CG 4.43Å; T510-L514 WeakPolarHBondContact O-CB 3.44Å; T510-L514 VanDerWaalsContact O-CG 3.27Å; T510-L514 WeakPolarHBondContact O-CG 3.47Å; T510-L514 PolarHBondContact O-N 2.78Å; Q511-L514 PolarHBondContact O-N 3.32Å; L514-H516 VanDerWaalsContact C-N 3.33Å; L514-C517 PolarHBondContact O-N 3.3Å; L514-K522 HydrophobicContact CB-CD 4.48Å; L514-K522 HydrophobicContact CB-CG 4.32Å; L514-K522 HydrophobicContact CD2-CG 4.49Å; L514-K522 WeakPolarHBondContact O-CD 3.36Å; L514-L525 HydrophobicContact CD2-CB 3.97Å; L514-L525 HydrophobicContact CD2-CD1 4.18Å; L514-L529 HydrophobicContact CD1-CD1 4.47Å
515	N	89.3	Confident	88.6	Confident	105 Å²	105	77.8 Å²	77.8	56%	0.561	41%	0.41	S	S	*	.	H	α-helix	trans	-75.6	-16.7	178.3	-71.3	-20.9	0	0	0	114.1	Q511 T512 V513 K522	Q511-N515 WeakPolarHBondContact O-CB 3.26Å; Q511-N515 PolarHBondContact O-N 3.03Å; Q511-N515 PolarHBondContact O-ND2 3.45Å; T512-N515 PolarHBondContact O-N 3.34Å; V513-N515 PolarHBondContact O-N 3.22Å; N515-K522 PolarHBondContact OD1-NZ 3.28Å
516	H	89.9	Confident	89.1	Confident	166 Å²	166	75.7 Å²	75.7	77%	0.769	40%	0.397	S	S	*	.	H	α-helix	trans	-81.5	-18.5	171	-70.8	87	0	0	0	112.7	T512 V513 L514	T512-H516 PolarHBondContact O-N 3.29Å; T512-H516 PolarHBondContact O-ND1 2.97Å; V513-H516 PolarHBondContact O-N 3.01Å; V513-H516 VanDerWaalsContact O-N 3.13Å; L514-H516 VanDerWaalsContact C-N 3.33Å
517	C	90.2	Very high	89.7	Confident	34 Å²	34	70.7 Å²	70.7	23%	0.23	38%	0.379	C	S	.	.	S	Bend	trans	-79.9	144.6	177.7	-61.7	0	0	0	0	111.3	L514 M521 K522	L514-C517 PolarHBondContact O-N 3.3Å; C517-M521 HydrophobicContact CB-CB 4.4Å; C517-K522 HydrophobicContact CB-CB 4.25Å
518	P	92.9	Very high	90.4	Very high	75 Å²	75	75.1 Å²	75.1	49%	0.487	39%	0.394	S	S	.	.			trans	-62.8	156.4	171.9	27.9	-34.2	0	0	0	110.6	D520 M521 K522	P518-D520 PolarHBondContact O-N 3.45Å; P518-M521 HydrophobicContact CG-CB 3.95Å; P518-M521 HydrophobicContact CG-CG 3.8Å; P518-M521 HydrophobicContact CG-SD 3.7Å; P518-M521 PolarHBondContact O-N 3.39Å; P518-M521 VanDerWaalsContact O-N 3.17Å; P518-K522 WeakPolarHBondContact O-CB 3.47Å; P518-K522 PolarHBondContact O-N 3.16Å
519	K	91.5	Very high	90.7	Very high	193 Å²	193	75.3 Å²	75.3	84%	0.839	39%	0.392	S	S	*	.	H	α-helix	trans	-48.5	-41.4	-175.1	-178.1	-177.9	176.1	-175.7	0	113.2	A523	K519-A523 PolarHBondContact O-N 3.43Å; K519-A523 VanDerWaalsContact O-N 3.12Å
520	D	90	Very high	91.1	Very high	99 Å²	99	71.8 Å²	71.8	53%	0.529	37%	0.373	S	S	.	.	H	α-helix	trans	-65.9	-55.9	-178.3	-166.5	58.3	0	0	0	111.8	P518 K522 A523 D524 R549	P518-D520 PolarHBondContact O-N 3.45Å; D520-K522 VanDerWaalsContact C-N 3.31Å; D520-K522 PolarHBondContact O-N 3.33Å; D520-A523 PolarHBondContact O-N 3.17Å; D520-D524 PolarHBondContact O-N 3.05Å; D520-D524 VanDerWaalsContact O-N 3.16Å; D520-R549 VanDerWaalsContact CA-NH2 3.32Å; D520-R549 PolarHBondContact O-NH2 3.31Å; D520-R549 IonicContact OD1-CZ 3.04Å; D520-R549 IonicContact OD1-NH1 2.99Å; D520-R549 IonicContact OD1-NH2 2.65Å; D520-R549 PolarHBondContact OD1-NH2 3.32Å
521	M	92.1	Very high	91.5	Very high	105 Å²	105	74.8 Å²	74.8	52%	0.517	38%	0.376	S	S	.	.	H	α-helix	trans	-63.2	-35.9	176.7	-66.3	-179.6	69	0	0	113	C517 P518 A523 D524 L525	C517-M521 HydrophobicContact CB-CB 4.4Å; P518-M521 HydrophobicContact CG-CB 3.95Å; P518-M521 HydrophobicContact CG-CG 3.8Å; P518-M521 HydrophobicContact CG-SD 3.7Å; P518-M521 PolarHBondContact O-N 3.39Å; P518-M521 VanDerWaalsContact O-N 3.17Å; M521-A523 VanDerWaalsContact C-N 3.33Å; M521-A523 PolarHBondContact O-N 3.3Å; M521-D524 PolarHBondContact O-N 2.68Å; M521-L525 WeakPolarHBondContact O-CB 3.35Å; M521-L525 WeakPolarHBondContact O-CG 3.48Å; M521-L525 PolarHBondContact O-N 3.1Å
522	K	92.7	Very high	91.7	Very high	40 Å²	40	71.7 Å²	71.7	17%	0.174	37%	0.366	C	S	.	.	H	α-helix	trans	-58.9	-47.2	175.9	178.3	177	-179.9	168.4	0	110.5	L514 N515 C517 P518 D520 D524 L525 C526	L514-K522 HydrophobicContact CB-CD 4.48Å; L514-K522 HydrophobicContact CB-CG 4.32Å; L514-K522 HydrophobicContact CD2-CG 4.49Å; L514-K522 WeakPolarHBondContact O-CD 3.36Å; N515-K522 PolarHBondContact OD1-NZ 3.28Å; C517-K522 HydrophobicContact CB-CB 4.25Å; P518-K522 WeakPolarHBondContact O-CB 3.47Å; P518-K522 PolarHBondContact O-N 3.16Å; D520-K522 VanDerWaalsContact C-N 3.31Å; D520-K522 PolarHBondContact O-N 3.33Å; K522-D524 PolarHBondContact O-N 2.94Å; K522-L525 PolarHBondContact O-N 3.23Å; K522-C526 WeakPolarHBondContact O-CB 3.46Å; K522-C526 PolarHBondContact O-N 3.01Å; K522-C526 PolarHBondContact O-SG 2.98Å
523	A	93.3	Very high	91.9	Very high	7 Å²	7	68.5 Å²	68.5	6%	0.058	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-40.9	178.7	0	0	0	0	0	111.9	K519 D520 M521 C526 V527 R549 V553	K519-A523 PolarHBondContact O-N 3.43Å; K519-A523 VanDerWaalsContact O-N 3.12Å; D520-A523 PolarHBondContact O-N 3.17Å; M521-A523 VanDerWaalsContact C-N 3.33Å; M521-A523 PolarHBondContact O-N 3.3Å; A523-C526 PolarHBondContact O-N 3.08Å; A523-V527 WeakPolarHBondContact O-CG2 3.46Å; A523-V527 PolarHBondContact O-N 3.26Å; A523-R549 HydrophobicContact CB-CB 3.98Å; A523-R549 HydrophobicContact CB-CG 4.14Å; A523-V553 HydrophobicContact CB-CG2 4.08Å
524	D	93.8	Very high	92.1	Very high	69 Å²	69	66.8 Å²	66.8	37%	0.369	33%	0.334	S	S	.	.	H	α-helix	trans	-66	-41.8	178.2	-66.8	-23.5	0	0	0	112.5	D520 M521 K522 V527 H528 R549	D520-D524 PolarHBondContact O-N 3.05Å; D520-D524 VanDerWaalsContact O-N 3.16Å; M521-D524 PolarHBondContact O-N 2.68Å; K522-D524 PolarHBondContact O-N 2.94Å; D524-V527 PolarHBondContact O-N 2.96Å; D524-H528 PolarHBondContact O-N 2.7Å; D524-R549 IonicContact OD1-CZ 3.98Å; D524-R549 IonicContact OD1-NE 3.17Å; D524-R549 IonicContact OD1-NH1 3.38Å; D524-R549 PolarHBondContact OD1-NH1 2.9Å; D524-R549 IonicContact OD1-NH2 3.69Å; D524-R549 PolarHBondContact OD1-NH2 2.87Å; D524-R549 IonicContact OD2-NH1 2.86Å; D524-R549 IonicContact OD2-NH2 3.99Å
525	L	93.8	Very high	92.2	Very high	74 Å²	74	71.1 Å²	71.1	39%	0.387	37%	0.365	S	S	.	.	H	α-helix	trans	-60.6	-44.9	172.9	-75.1	171.3	0	0	0	111.3	L514 M521 K522 H528 L529	L514-L525 HydrophobicContact CD2-CB 3.97Å; L514-L525 HydrophobicContact CD2-CD1 4.18Å; M521-L525 WeakPolarHBondContact O-CB 3.35Å; M521-L525 WeakPolarHBondContact O-CG 3.48Å; M521-L525 PolarHBondContact O-N 3.1Å; K522-L525 PolarHBondContact O-N 3.23Å; L525-H528 WeakPolarHBondContact O-CB 3.38Å; L525-H528 PolarHBondContact O-N 2.95Å; L525-L529 VanDerWaalsContact O-CG 3.3Å; L525-L529 WeakPolarHBondContact O-CG 3.47Å; L525-L529 PolarHBondContact O-N 3.04Å
526	C	94	Very high	92.2	Very high	4 Å²	4	70.7 Å²	70.7	3%	0.027	36%	0.36	C	S	.	.	H	α-helix	trans	-61.5	-44.8	175.7	-70.5	0	0	0	0	111.5	K522 A523 H528 L529 Y530 A552	K522-C526 WeakPolarHBondContact O-CB 3.46Å; K522-C526 PolarHBondContact O-N 3.01Å; K522-C526 PolarHBondContact O-SG 2.98Å; A523-C526 PolarHBondContact O-N 3.08Å; C526-H528 PolarHBondContact O-N 3.15Å; C526-L529 PolarHBondContact O-N 2.73Å; C526-L529 VanDerWaalsContact O-N 3.15Å; C526-Y530 HydrophobicContact CB-CD2 4.28Å; C526-Y530 HydrophobicContact CB-CE2 4.15Å; C526-Y530 WeakPolarHBondContact O-CD2 3.5Å; C526-Y530 PolarHBondContact O-N 3.44Å; C526-A552 HydrophobicContact CB-CB 3.64Å
527	V	94.2	Very high	92.2	Very high	40 Å²	40	63.5 Å²	63.5	24%	0.242	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-40.5	176.3	171.1	0	0	0	0	110.7	A523 D524 Y530 R531 F534 R549 A552	A523-V527 WeakPolarHBondContact O-CG2 3.46Å; A523-V527 PolarHBondContact O-N 3.26Å; D524-V527 PolarHBondContact O-N 2.96Å; V527-Y530 PolarHBondContact O-N 3.34Å; V527-R531 PolarHBondContact O-N 3.42Å; V527-R531 VanDerWaalsContact O-N 3.11Å; V527-F534 HydrophobicContact CG1-CD2 4.49Å; V527-R549 HydrophobicContact CG2-CG 4.02Å; V527-A552 HydrophobicContact CB-CB 4.44Å; V527-A552 HydrophobicContact CG2-CB 3.69Å
528	H	93.7	Very high	92.3	Very high	113 Å²	113	66.1 Å²	66.1	52%	0.523	34%	0.343	S	S	.	.	H	α-helix	trans	-67.1	-37.9	176.2	-176.1	79.4	0	0	0	113.6	D524 L525 C526 R531	D524-H528 PolarHBondContact O-N 2.7Å; L525-H528 WeakPolarHBondContact O-CB 3.38Å; L525-H528 PolarHBondContact O-N 2.95Å; C526-H528 PolarHBondContact O-N 3.15Å; H528-R531 PolarHBondContact CD2-NH1 2.99Å; H528-R531 VanDerWaalsContact CD2-NH1 3.33Å; H528-R531 PolarHBondContact CE1-NH1 3.21Å; H528-R531 PolarHBondContact NE2-NH1 3.49Å; H528-R531 VanDerWaalsContact O-CG 3.29Å; H528-R531 WeakPolarHBondContact O-CG 3.29Å; H528-R531 PolarHBondContact O-NH1 2.96Å
529	L	91.2	Very high	92.2	Very high	82 Å²	82	62.7 Å²	62.7	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-64.4	-42.6	176.4	-73.7	169.3	0	0	0	111.5	L514 L525 C526 R531	L514-L529 HydrophobicContact CD1-CD1 4.47Å; L525-L529 VanDerWaalsContact O-CG 3.3Å; L525-L529 WeakPolarHBondContact O-CG 3.47Å; L525-L529 PolarHBondContact O-N 3.04Å; C526-L529 PolarHBondContact O-N 2.73Å; C526-L529 VanDerWaalsContact O-N 3.15Å; L529-R531 VanDerWaalsContact C-N 3.35Å
530	Y	93.6	Very high	92.3	Very high	8 Å²	8	53.8 Å²	53.8	3%	0.031	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	14.9	-176.2	-54.7	-59.8	0	0	0	113.6	C526 V527 A532 V533 F534 A552 F555 V557 Q628	C526-Y530 HydrophobicContact CB-CD2 4.28Å; C526-Y530 HydrophobicContact CB-CE2 4.15Å; C526-Y530 WeakPolarHBondContact O-CD2 3.5Å; C526-Y530 PolarHBondContact O-N 3.44Å; V527-Y530 PolarHBondContact O-N 3.34Å; Y530-A532 PolarHBondContact O-N 3.34Å; Y530-A532 VanDerWaalsContact O-N 3.14Å; Y530-V533 PolarHBondContact O-N 3.28Å; Y530-V533 VanDerWaalsContact O-N 3.1Å; Y530-F534 PolarHBondContact O-N 3.41Å; Y530-F534 VanDerWaalsContact O-N 3.14Å; Y530-A552 HydrophobicContact CD2-CB 4.15Å; Y530-A552 WeakPolarHBondContact CD2-O 2.91Å; Y530-A552 WeakPolarHBondContact CE2-O 3.23Å; Y530-F555 HydrophobicContact CD1-CB 3.96Å; Y530-F555 HydrophobicContact CD1-CG 4.45Å; Y530-F555 HydrophobicContact CD2-CB 3.73Å; Y530-F555 HydrophobicContact CD2-CG 4.45Å; Y530-F555 HydrophobicContact CE1-CB 3.73Å; Y530-F555 HydrophobicContact CE2-CB 3.54Å; Y530-F555 HydrophobicContact CG-CB 3.97Å; Y530-F555 HydrophobicContact CG-CG 4.38Å; Y530-F555 PolarHBondContact OH-O 3.21Å; Y530-F555 VanDerWaalsContact OH-O 3.05Å; Y530-V557 HydrophobicContact CE1-CG2 3.59Å; Y530-Q628 HydrophobicContact CD1-CB 4.48Å; Y530-Q628 HydrophobicContact CD1-CG 4.09Å; Y530-Q628 HydrophobicContact CE1-CG 4.39Å
531	R	92.6	Very high	92.3	Very high	136 Å²	136	59.6 Å²	59.6	51%	0.513	30%	0.297	S	S	.	.	H	α-helix	trans	-57.5	-31.6	-176.6	71.1	177.1	177.5	-100.9	9.7	113.9	V527 H528 L529 F534 S535	V527-R531 PolarHBondContact O-N 3.42Å; V527-R531 VanDerWaalsContact O-N 3.11Å; H528-R531 PolarHBondContact CD2-NH1 2.99Å; H528-R531 VanDerWaalsContact CD2-NH1 3.33Å; H528-R531 PolarHBondContact CE1-NH1 3.21Å; H528-R531 PolarHBondContact NE2-NH1 3.49Å; H528-R531 VanDerWaalsContact O-CG 3.29Å; H528-R531 WeakPolarHBondContact O-CG 3.29Å; H528-R531 PolarHBondContact O-NH1 2.96Å; L529-R531 VanDerWaalsContact C-N 3.35Å; R531-F534 PolarHBondContact O-N 3.46Å; R531-S535 WeakPolarHBondContact O-CB 3.32Å; R531-S535 PolarHBondContact O-N 3.15Å; R531-S535 PolarHBondContact O-OG 3.14Å
532	A	89.4	Confident	92.3	Very high	24 Å²	24	60.6 Å²	60.6	20%	0.198	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-48.2	178.7	0	0	0	0	0	109.9	Y530 E536 V580	Y530-A532 PolarHBondContact O-N 3.34Å; Y530-A532 VanDerWaalsContact O-N 3.14Å; A532-E536 WeakPolarHBondContact O-CB 3.2Å; A532-E536 VanDerWaalsContact O-CG 3.23Å; A532-E536 WeakPolarHBondContact O-CG 3.38Å; A532-E536 PolarHBondContact O-N 2.97Å; A532-V580 HydrophobicContact CB-CG1 3.91Å
533	V	93	Very high	92.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.9	-45.6	177.6	167.6	0	0	0	0	111.7	Y530 S535 H537 F540 F555 F578 V580 Q628	Y530-V533 PolarHBondContact O-N 3.28Å; Y530-V533 VanDerWaalsContact O-N 3.1Å; V533-S535 VanDerWaalsContact C-N 3.32Å; V533-S535 PolarHBondContact O-N 3.35Å; V533-H537 WeakPolarHBondContact O-CB 3.25Å; V533-H537 PolarHBondContact O-CD2 2.94Å; V533-H537 VanDerWaalsContact O-CD2 3.32Å; V533-H537 PolarHBondContact O-N 3.13Å; V533-F540 HydrophobicContact CG1-CD2 4.09Å; V533-F540 HydrophobicContact CG1-CE2 3.47Å; V533-F540 VanDerWaalsContact CG1-CE2 3.47Å; V533-F540 HydrophobicContact CG1-CZ 4.11Å; V533-F555 HydrophobicContact CG1-CZ 4.34Å; V533-F578 HydrophobicContact CG1-CB 4.47Å; V533-F578 HydrophobicContact CG1-CD1 3.93Å; V533-F578 HydrophobicContact CG1-CD2 4.29Å; V533-F578 HydrophobicContact CG1-CE1 4.19Å; V533-F578 HydrophobicContact CG1-CG 3.98Å; V533-F578 HydrophobicContact CG2-CB 3.68Å; V533-F578 HydrophobicContact CG2-CG 4.1Å; V533-V580 HydrophobicContact CG2-CG2 3.85Å; V533-Q628 HydrophobicContact CG2-CB 3.97Å; V533-Q628 HydrophobicContact CG2-CG 4.34Å
534	F	93.6	Very high	92.3	Very high	20 Å²	20	61.9 Å²	61.9	9%	0.088	32%	0.318	C	S	.	.	H	α-helix	trans	-69.9	-27.1	-177.6	-60.6	-35.2	0	0	0	114.1	V527 Y530 R531 F540 L548 L551 A552 F555	V527-F534 HydrophobicContact CG1-CD2 4.49Å; Y530-F534 PolarHBondContact O-N 3.41Å; Y530-F534 VanDerWaalsContact O-N 3.14Å; R531-F534 PolarHBondContact O-N 3.46Å; F534-F540 HydrophobicContact CB-CB 4.48Å; F534-F540 HydrophobicContact CD1-CB 4.17Å; F534-F540 AromaticContact CD1-CD1 3.93Å; F534-F540 HydrophobicContact CD1-CD1 3.93Å; F534-F540 HydrophobicContact CD1-CD2 4.02Å; F534-F540 HydrophobicContact CD1-CE1 4.32Å; F534-F540 HydrophobicContact CD1-CE2 4.4Å; F534-F540 AromaticContact CD1-CG 3.76Å; F534-F540 HydrophobicContact CD1-CG 3.76Å; F534-F540 HydrophobicContact CE1-CD1 4.17Å; F534-F540 HydrophobicContact CE1-CE1 4.22Å; F534-F540 HydrophobicContact CE1-CG 4.44Å; F534-L548 HydrophobicContact CB-CD2 4.21Å; F534-L548 HydrophobicContact CD1-CD2 3.82Å; F534-L548 HydrophobicContact CD2-CD2 4.24Å; F534-L548 HydrophobicContact CE1-CD2 4.23Å; F534-L548 HydrophobicContact CG-CD2 3.84Å; F534-L551 HydrophobicContact CE1-CB 4.28Å; F534-L551 HydrophobicContact CZ-CB 4.17Å; F534-A552 HydrophobicContact CE2-CB 3.78Å; F534-A552 HydrophobicContact CZ-CB 3.97Å; F534-F555 HydrophobicContact CE1-CD2 4.28Å; F534-F555 AromaticContact CE1-CE2 3.75Å; F534-F555 HydrophobicContact CE1-CE2 3.75Å; F534-F555 HydrophobicContact CE1-CZ 4.41Å; F534-F555 HydrophobicContact CZ-CD2 4.04Å; F534-F555 AromaticContact CZ-CE2 3.97Å; F534-F555 HydrophobicContact CZ-CE2 3.97Å
535	S	90.8	Very high	92.3	Very high	99 Å²	99	65 Å²	65	69%	0.692	33%	0.331	S	S	*	.	H	α-helix	trans	-93.6	-38	-178.7	-49	0	0	0	0	112.9	R531 V533	R531-S535 WeakPolarHBondContact O-CB 3.32Å; R531-S535 PolarHBondContact O-N 3.15Å; R531-S535 PolarHBondContact O-OG 3.14Å; V533-S535 VanDerWaalsContact C-N 3.32Å; V533-S535 PolarHBondContact O-N 3.35Å
536	E	89.4	Confident	92.3	Very high	96 Å²	96	65 Å²	65	45%	0.449	34%	0.337	S	S	.	.	H	α-helix	trans	-79.1	-35.1	-175.9	-65.1	-178.8	172.7	0	0	111.8	A532 K598	A532-E536 WeakPolarHBondContact O-CB 3.2Å; A532-E536 VanDerWaalsContact O-CG 3.23Å; A532-E536 WeakPolarHBondContact O-CG 3.38Å; A532-E536 PolarHBondContact O-N 2.97Å; E536-K598 WeakPolarHBondContact OE1-CE 3.35Å; E536-K598 IonicContact OE1-NZ 3.97Å; E536-K598 PolarHBondContact OE1-NZ 3.32Å; E536-K598 WeakPolarHBondContact OE2-CE 3.27Å; E536-K598 IonicContact OE2-NZ 3.75Å
537	H	91.2	Very high	92.3	Very high	16 Å²	16	64.9 Å²	64.9	7%	0.074	34%	0.335	C	S	.	.			trans	-90.4	130	-176.8	-64	-74.4	0	0	0	113.1	V533 A539 F540 F578 G599	V533-H537 WeakPolarHBondContact O-CB 3.25Å; V533-H537 PolarHBondContact O-CD2 2.94Å; V533-H537 VanDerWaalsContact O-CD2 3.32Å; V533-H537 PolarHBondContact O-N 3.13Å; H537-A539 PolarHBondContact O-N 2.89Å; H537-F540 HydrophobicContact CB-CD2 4.03Å; H537-F540 HydrophobicContact CB-CE2 4.27Å; H537-F540 PolarHBondContact O-N 3.14Å; H537-F578 AromaticContact CD2-CD1 3.68Å; H537-F578 AromaticContact NE2-CD1 3.46Å; H537-F578 WeakPolarHBondContact NE2-CD1 3.42Å; H537-G599 PolarHBondContact CE1-O 2.97Å
538	P	91	Very high	92.4	Very high	89 Å²	89	64.7 Å²	64.7	58%	0.578	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-63.8	-19.6	179.8	26.6	-34.9	0	0	0	113.1	F540 R541	P538-F540 PolarHBondContact O-N 3.29Å; P538-R541 PolarHBondContact O-N 3.01Å
539	A	91.6	Very high	92.4	Very high	2 Å²	2	61.4 Å²	61.4	2%	0.017	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-63.4	-24.8	-178.5	0	0	0	0	0	114.3	H537 F645 F649 T652 L653	H537-A539 PolarHBondContact O-N 2.89Å; A539-F645 WeakPolarHBondContact O-CE2 3.34Å; A539-F649 HydrophobicContact CB-CD2 3.87Å; A539-F649 HydrophobicContact CB-CE2 3.86Å; A539-T652 WeakPolarHBondContact CA-OG1 3.23Å; A539-L653 HydrophobicContact CB-CB 4.28Å; A539-L653 HydrophobicContact CB-CD1 4.07Å
540	F	93.5	Very high	92.6	Very high	6 Å²	6	59 Å²	59	3%	0.026	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-101.8	-6.3	-177.6	-58.5	-72.2	0	0	0	113.9	V533 F534 H537 P538 L542 A543 L548 L551 F555 F578 F645 F649	V533-F540 HydrophobicContact CG1-CD2 4.09Å; V533-F540 HydrophobicContact CG1-CE2 3.47Å; V533-F540 VanDerWaalsContact CG1-CE2 3.47Å; V533-F540 HydrophobicContact CG1-CZ 4.11Å; F534-F540 HydrophobicContact CB-CB 4.48Å; F534-F540 HydrophobicContact CD1-CB 4.17Å; F534-F540 AromaticContact CD1-CD1 3.93Å; F534-F540 HydrophobicContact CD1-CD1 3.93Å; F534-F540 HydrophobicContact CD1-CD2 4.02Å; F534-F540 HydrophobicContact CD1-CE1 4.32Å; F534-F540 HydrophobicContact CD1-CE2 4.4Å; F534-F540 AromaticContact CD1-CG 3.76Å; F534-F540 HydrophobicContact CD1-CG 3.76Å; F534-F540 HydrophobicContact CE1-CD1 4.17Å; F534-F540 HydrophobicContact CE1-CE1 4.22Å; F534-F540 HydrophobicContact CE1-CG 4.44Å; H537-F540 HydrophobicContact CB-CD2 4.03Å; H537-F540 HydrophobicContact CB-CE2 4.27Å; H537-F540 PolarHBondContact O-N 3.14Å; P538-F540 PolarHBondContact O-N 3.29Å; F540-L542 PolarHBondContact O-N 2.9Å; F540-A543 WeakPolarHBondContact O-CB 3.46Å; F540-A543 PolarHBondContact O-N 2.83Å; F540-L548 HydrophobicContact CB-CD2 4.23Å; F540-L551 HydrophobicContact CD1-CD1 3.97Å; F540-L551 HydrophobicContact CE1-CD1 3.91Å; F540-F555 HydrophobicContact CZ-CZ 4.26Å; F540-F578 AromaticContact CE2-CE1 3.81Å; F540-F578 HydrophobicContact CE2-CE1 3.81Å; F540-F578 AromaticContact CE2-CZ 3.94Å; F540-F578 HydrophobicContact CE2-CZ 3.94Å; F540-F578 HydrophobicContact CZ-CE1 4.08Å; F540-F578 HydrophobicContact CZ-CE2 4.46Å; F540-F578 AromaticContact CZ-CZ 3.7Å; F540-F578 HydrophobicContact CZ-CZ 3.7Å; F540-F645 HydrophobicContact CD1-CZ 4.17Å; F540-F649 HydrophobicContact CD1-CE2 4.28Å; F540-F649 HydrophobicContact CE1-CD2 4.35Å; F540-F649 AromaticContact CE1-CE2 3.63Å; F540-F649 HydrophobicContact CE1-CE2 3.63Å; F540-F649 HydrophobicContact CE1-CZ 4.43Å; F540-F649 AromaticContact CZ-CE2 3.83Å; F540-F649 HydrophobicContact CZ-CE2 3.83Å; F540-F649 HydrophobicContact CZ-CZ 4.45Å
541	R	89.8	Confident	92.7	Very high	222 Å²	222	58.7 Å²	58.7	84%	0.838	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.1	-175.5	-173.6	176.5	177.5	178.2	0.2	113.7	P538	P538-R541 PolarHBondContact O-N 3.01Å
542	L	91.8	Very high	92.8	Very high	126 Å²	126	52.2 Å²	52.2	66%	0.66	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	5.6	178.8	-72.1	166.4	0	0	0	113.1	F540 S648	F540-L542 PolarHBondContact O-N 2.9Å; L542-S648 WeakPolarHBondContact CD1-OG 3.34Å
543	A	93	Very high	93	Very high	15 Å²	15	54.2 Å²	54.2	12%	0.124	29%	0.292	C	S	.	.			trans	-71.8	135	176.7	0	0	0	0	0	110.5	F540 C547 L548 F645	F540-A543 WeakPolarHBondContact O-CB 3.46Å; F540-A543 PolarHBondContact O-N 2.83Å; A543-C547 HydrophobicContact CB-CB 4.44Å; A543-L548 HydrophobicContact CB-CD2 3.66Å; A543-L548 HydrophobicContact CB-CG 3.72Å; A543-F645 HydrophobicContact CB-CD2 3.92Å; A543-F645 HydrophobicContact CB-CE2 3.51Å; A543-F645 HydrophobicContact CB-CZ 3.88Å
544	S	94.4	Very high	93	Very high	59 Å²	59	55.9 Å²	55.9	41%	0.413	30%	0.304	S	S	.	.			trans	-67.6	156.2	168.8	66.1	0	0	0	0	110.5	S546 C547 L548	S544-S546 PolarHBondContact O-N 3.35Å; S544-C547 WeakPolarHBondContact O-CA 3.47Å; S544-C547 WeakPolarHBondContact O-CB 3.35Å; S544-C547 PolarHBondContact O-N 2.93Å; S544-C547 WeakPolarHBondContact OG-CB 3.41Å; S544-C547 PolarHBondContact OG-N 3.33Å; S544-L548 PolarHBondContact O-N 3.41Å
545	E	92.9	Very high	93	Very high	135 Å²	135	55.1 Å²	55.1	63%	0.631	30%	0.3	S	S	*	.	H	α-helix	trans	-55.6	-41.9	178.1	-170.8	-175.4	159.1	0	0	111.9	C547 L548 R549	E545-C547 VanDerWaalsContact C-N 3.3Å; E545-C547 PolarHBondContact O-N 3.1Å; E545-L548 PolarHBondContact O-N 3.07Å; E545-R549 WeakPolarHBondContact O-CB 3.25Å; E545-R549 VanDerWaalsContact O-CG 3.23Å; E545-R549 WeakPolarHBondContact O-CG 3.49Å; E545-R549 PolarHBondContact O-N 2.92Å; E545-R549 IonicContact OE1-NH1 3.64Å
546	S	93.7	Very high	93	Very high	74 Å²	74	53 Å²	53	52%	0.517	28%	0.283	S	S	.	.	H	α-helix	trans	-62.4	-36.1	175.6	-47.1	0	0	0	0	112.8	S544 A550 Y642	S544-S546 PolarHBondContact O-N 3.35Å; S546-A550 PolarHBondContact O-N 3.35Å; S546-A550 VanDerWaalsContact O-N 3.14Å; S546-Y642 WeakPolarHBondContact CB-OH 3.29Å; S546-Y642 PolarHBondContact O-OH 3.43Å
547	C	95.1	Very high	93	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-69.4	-46	176.4	-172.4	0	0	0	0	111.3	A543 S544 E545 R549 A550 L551 Y642 F645	A543-C547 HydrophobicContact CB-CB 4.44Å; S544-C547 WeakPolarHBondContact O-CA 3.47Å; S544-C547 WeakPolarHBondContact O-CB 3.35Å; S544-C547 PolarHBondContact O-N 2.93Å; S544-C547 WeakPolarHBondContact OG-CB 3.41Å; S544-C547 PolarHBondContact OG-N 3.33Å; E545-C547 VanDerWaalsContact C-N 3.3Å; E545-C547 PolarHBondContact O-N 3.1Å; C547-R549 VanDerWaalsContact C-N 3.3Å; C547-R549 PolarHBondContact O-N 3.19Å; C547-A550 PolarHBondContact O-N 3.43Å; C547-A550 VanDerWaalsContact O-N 3.15Å; C547-L551 WeakPolarHBondContact O-CG 3.41Å; C547-L551 PolarHBondContact O-N 2.96Å; C547-Y642 HydrophobicContact CB-CD1 4.05Å; C547-Y642 HydrophobicContact CB-CD2 3.99Å; C547-Y642 HydrophobicContact CB-CE1 4.1Å; C547-Y642 HydrophobicContact CB-CE2 4.03Å; C547-Y642 HydrophobicContact CB-CG 4Å; C547-F645 WeakPolarHBondContact SG-CD1 3.23Å
548	L	95.2	Very high	92.9	Very high	36 Å²	36	53.8 Å²	53.8	19%	0.188	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-43.4	175.2	-71.5	174.9	0	0	0	111.6	F534 F540 A543 S544 E545 A550 L551 A552	F534-L548 HydrophobicContact CB-CD2 4.21Å; F534-L548 HydrophobicContact CD1-CD2 3.82Å; F534-L548 HydrophobicContact CD2-CD2 4.24Å; F534-L548 HydrophobicContact CE1-CD2 4.23Å; F534-L548 HydrophobicContact CG-CD2 3.84Å; F540-L548 HydrophobicContact CB-CD2 4.23Å; A543-L548 HydrophobicContact CB-CD2 3.66Å; A543-L548 HydrophobicContact CB-CG 3.72Å; S544-L548 PolarHBondContact O-N 3.41Å; E545-L548 PolarHBondContact O-N 3.07Å; L548-A550 PolarHBondContact O-N 2.86Å; L548-L551 PolarHBondContact O-N 2.98Å; L548-A552 WeakPolarHBondContact O-CB 3.32Å; L548-A552 PolarHBondContact O-N 3.35Å
549	R	94.8	Very high	92.8	Very high	44 Å²	44	52.4 Å²	52.4	17%	0.166	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-42.2	176.4	-71.5	172.9	76.2	117.1	14	112.4	D520 A523 D524 V527 E545 C547 V553	D520-R549 VanDerWaalsContact CA-NH2 3.32Å; D520-R549 PolarHBondContact O-NH2 3.31Å; D520-R549 IonicContact OD1-CZ 3.04Å; D520-R549 IonicContact OD1-NH1 2.99Å; D520-R549 IonicContact OD1-NH2 2.65Å; D520-R549 PolarHBondContact OD1-NH2 3.32Å; A523-R549 HydrophobicContact CB-CB 3.98Å; A523-R549 HydrophobicContact CB-CG 4.14Å; D524-R549 IonicContact OD1-CZ 3.98Å; D524-R549 IonicContact OD1-NE 3.17Å; D524-R549 IonicContact OD1-NH1 3.38Å; D524-R549 PolarHBondContact OD1-NH1 2.9Å; D524-R549 IonicContact OD1-NH2 3.69Å; D524-R549 PolarHBondContact OD1-NH2 2.87Å; D524-R549 IonicContact OD2-NH1 2.86Å; D524-R549 IonicContact OD2-NH2 3.99Å; V527-R549 HydrophobicContact CG2-CG 4.02Å; E545-R549 WeakPolarHBondContact O-CB 3.25Å; E545-R549 VanDerWaalsContact O-CG 3.23Å; E545-R549 WeakPolarHBondContact O-CG 3.49Å; E545-R549 PolarHBondContact O-N 2.92Å; E545-R549 IonicContact OE1-NH1 3.64Å; C547-R549 VanDerWaalsContact C-N 3.3Å; C547-R549 PolarHBondContact O-N 3.19Å; R549-V553 WeakPolarHBondContact O-CG2 3.39Å; R549-V553 PolarHBondContact O-N 3.37Å
550	A	94.9	Very high	92.7	Very high	33 Å²	33	52.9 Å²	52.9	27%	0.273	28%	0.28	S	S	.	.	H	α-helix	trans	-67.3	-41.6	177.4	0	0	0	0	0	112.5	S546 C547 L548 S554 I638 Y642	S546-A550 PolarHBondContact O-N 3.35Å; S546-A550 VanDerWaalsContact O-N 3.14Å; C547-A550 PolarHBondContact O-N 3.43Å; C547-A550 VanDerWaalsContact O-N 3.15Å; L548-A550 PolarHBondContact O-N 2.86Å; A550-S554 PolarHBondContact O-OG 3.34Å; A550-I638 HydrophobicContact CB-CG2 4.44Å; A550-I638 WeakPolarHBondContact O-CD1 3.33Å; A550-Y642 HydrophobicContact CB-CE2 4.08Å
551	L	95.4	Very high	92.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-52.3	174.3	-74.6	168.8	0	0	0	110.5	F534 F540 C547 L548 V553 S554 F555 I630 L635 I638 F645	F534-L551 HydrophobicContact CE1-CB 4.28Å; F534-L551 HydrophobicContact CZ-CB 4.17Å; F540-L551 HydrophobicContact CD1-CD1 3.97Å; F540-L551 HydrophobicContact CE1-CD1 3.91Å; C547-L551 WeakPolarHBondContact O-CG 3.41Å; C547-L551 PolarHBondContact O-N 2.96Å; L548-L551 PolarHBondContact O-N 2.98Å; L551-V553 VanDerWaalsContact C-N 3.3Å; L551-V553 PolarHBondContact O-N 2.92Å; L551-S554 WeakPolarHBondContact O-CA 3.49Å; L551-S554 WeakPolarHBondContact O-CB 3.29Å; L551-S554 PolarHBondContact O-N 2.86Å; L551-F555 HydrophobicContact CB-CD2 4.46Å; L551-F555 HydrophobicContact CB-CE2 4.17Å; L551-F555 VanDerWaalsContact O-CD2 3.23Å; L551-F555 WeakPolarHBondContact O-CD2 3.49Å; L551-F555 PolarHBondContact O-N 3.22Å; L551-F555 VanDerWaalsContact O-N 3.15Å; L551-I630 HydrophobicContact CD2-CD1 3.91Å; L551-L635 HydrophobicContact CD2-CD1 3.68Å; L551-I638 HydrophobicContact CD2-CB 4.48Å; L551-I638 HydrophobicContact CD2-CD1 4.02Å; L551-I638 HydrophobicContact CD2-CG2 3.91Å; L551-I638 HydrophobicContact CG-CG2 4.07Å; L551-F645 HydrophobicContact CD1-CE1 4.08Å; L551-F645 HydrophobicContact CD1-CZ 4.44Å
552	A	94.5	Very high	92.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-55.7	-41.1	-175.2	0	0	0	0	0	113	C526 V527 Y530 F534 L548 S554 F555	C526-A552 HydrophobicContact CB-CB 3.64Å; V527-A552 HydrophobicContact CB-CB 4.44Å; V527-A552 HydrophobicContact CG2-CB 3.69Å; Y530-A552 HydrophobicContact CD2-CB 4.15Å; Y530-A552 WeakPolarHBondContact CD2-O 2.91Å; Y530-A552 WeakPolarHBondContact CE2-O 3.23Å; F534-A552 HydrophobicContact CE2-CB 3.78Å; F534-A552 HydrophobicContact CZ-CB 3.97Å; L548-A552 WeakPolarHBondContact O-CB 3.32Å; L548-A552 PolarHBondContact O-N 3.35Å; A552-S554 PolarHBondContact O-N 3.47Å; A552-F555 PolarHBondContact O-N 2.89Å
553	V	93	Very high	92.1	Very high	66 Å²	66	40.9 Å²	40.9	40%	0.4	25%	0.245	S	C	.	.	H	α-helix	trans	-67.6	-22.2	178.2	174.8	0	0	0	0	112.5	A523 R549 L551	A523-V553 HydrophobicContact CB-CG2 4.08Å; R549-V553 WeakPolarHBondContact O-CG2 3.39Å; R549-V553 PolarHBondContact O-N 3.37Å; L551-V553 VanDerWaalsContact C-N 3.3Å; L551-V553 PolarHBondContact O-N 2.92Å
554	S	93.3	Very high	91.9	Very high	35 Å²	35	41.5 Å²	41.5	25%	0.245	25%	0.247	C	C	.	.	H	α-helix	trans	-95.2	-11	-179.1	-57.3	0	0	0	0	113.8	A550 L551 A552	A550-S554 PolarHBondContact O-OG 3.34Å; L551-S554 WeakPolarHBondContact O-CA 3.49Å; L551-S554 WeakPolarHBondContact O-CB 3.29Å; L551-S554 PolarHBondContact O-N 2.86Å; A552-S554 PolarHBondContact O-N 3.47Å
555	F	93.5	Very high	91.8	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	151.5	173.7	-89.8	-86.3	0	0	0	111.5	Y530 V533 F534 F540 L551 A552 F578 Q628 I630	Y530-F555 HydrophobicContact CD1-CB 3.96Å; Y530-F555 HydrophobicContact CD1-CG 4.45Å; Y530-F555 HydrophobicContact CD2-CB 3.73Å; Y530-F555 HydrophobicContact CD2-CG 4.45Å; Y530-F555 HydrophobicContact CE1-CB 3.73Å; Y530-F555 HydrophobicContact CE2-CB 3.54Å; Y530-F555 HydrophobicContact CG-CB 3.97Å; Y530-F555 HydrophobicContact CG-CG 4.38Å; Y530-F555 PolarHBondContact OH-O 3.21Å; Y530-F555 VanDerWaalsContact OH-O 3.05Å; V533-F555 HydrophobicContact CG1-CZ 4.34Å; F534-F555 HydrophobicContact CE1-CD2 4.28Å; F534-F555 AromaticContact CE1-CE2 3.75Å; F534-F555 HydrophobicContact CE1-CE2 3.75Å; F534-F555 HydrophobicContact CE1-CZ 4.41Å; F534-F555 HydrophobicContact CZ-CD2 4.04Å; F534-F555 AromaticContact CZ-CE2 3.97Å; F534-F555 HydrophobicContact CZ-CE2 3.97Å; F540-F555 HydrophobicContact CZ-CZ 4.26Å; L551-F555 HydrophobicContact CB-CD2 4.46Å; L551-F555 HydrophobicContact CB-CE2 4.17Å; L551-F555 VanDerWaalsContact O-CD2 3.23Å; L551-F555 WeakPolarHBondContact O-CD2 3.49Å; L551-F555 PolarHBondContact O-N 3.22Å; L551-F555 VanDerWaalsContact O-N 3.15Å; A552-F555 PolarHBondContact O-N 2.89Å; F555-F578 AromaticContact CE1-CD2 3.73Å; F555-F578 HydrophobicContact CE1-CD2 3.73Å; F555-F578 AromaticContact CE1-CE2 3.69Å; F555-F578 HydrophobicContact CE1-CE2 3.69Å; F555-F578 HydrophobicContact CZ-CD2 4.25Å; F555-F578 AromaticContact CZ-CE2 3.79Å; F555-F578 HydrophobicContact CZ-CE2 3.79Å; F555-F578 HydrophobicContact CZ-CZ 4.48Å; F555-Q628 HydrophobicContact CD1-CB 4.34Å; F555-I630 HydrophobicContact CD1-CB 3.95Å; F555-I630 HydrophobicContact CD2-CB 4.49Å; F555-I630 HydrophobicContact CD2-CD1 4.13Å; F555-I630 HydrophobicContact CE1-CB 3.81Å; F555-I630 HydrophobicContact CE1-CG2 3.96Å; F555-I630 HydrophobicContact CE2-CB 4.34Å; F555-I630 HydrophobicContact CE2-CD1 3.88Å; F555-I630 HydrophobicContact CG-CB 4.29Å; F555-I630 HydrophobicContact CZ-CB 4Å; F555-I630 HydrophobicContact CZ-CD1 4.26Å; F555-I630 HydrophobicContact CZ-CG2 3.98Å
556	T	92.1	Very high	91.8	Very high	55 Å²	55	36 Å²	36	34%	0.337	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	146	173.9	51.9	0	0	0	0	109.6	C629	T556-C629 PolarHBondContact N-O 3.29Å; T556-C629 PolarHBondContact O-N 3.19Å; T556-C629 PolarHBondContact OG1-O 3.3Å
557	V	89	Confident	91.9	Very high	68 Å²	68	32.5 Å²	32.5	41%	0.412	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.8	174.1	-172.8	0	0	0	0	108.7	Y530 H559 L627	Y530-V557 HydrophobicContact CE1-CG2 3.59Å; V557-H559 WeakPolarHBondContact CG1-CE1 3.25Å; V557-L627 WeakPolarHBondContact CA-O 3.43Å
558	Q	89.1	Confident	91.8	Very high	60 Å²	60	37 Å²	37	28%	0.28	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.1	172.1	-171.9	174.8	-12.5	0	0	108.5	N560 L627	Q558-N560 PolarHBondContact NE2-ND2 3.39Å; Q558-L627 HydrophobicContact CB-CB 4.2Å; Q558-L627 PolarHBondContact N-O 3.27Å; Q558-L627 PolarHBondContact O-N 3.33Å
559	H	87.9	Confident	91.8	Very high	60 Å²	60	39.7 Å²	39.7	28%	0.278	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130	173.7	-65.5	74.4	0	0	0	107.9	V557 C625 D626	V557-H559 WeakPolarHBondContact CG1-CE1 3.25Å; H559-C625 WeakPolarHBondContact CA-O 3.48Å; H559-D626 IonicContact CD2-OD1 3.56Å; H559-D626 PolarHBondContact CD2-OD1 3.36Å; H559-D626 IonicContact CG-OD1 3.76Å; H559-D626 IonicContact NE2-OD1 3.47Å
560	N	89.1	Confident	91.6	Very high	13 Å²	13	39.6 Å²	39.6	7%	0.07	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.8	-178.2	-64.6	98.9	0	0	0	110	Q558 D564 I566 A621 Y624 C625	Q558-N560 PolarHBondContact NE2-ND2 3.39Å; N560-D564 HydrophobicContact CB-CB 4.37Å; N560-I566 HydrophobicContact CB-CD1 4.46Å; N560-A621 HydrophobicContact CB-CB 4.12Å; N560-Y624 WeakPolarHBondContact O-CA 3.3Å; N560-C625 HydrophobicContact CB-CB 4.47Å; N560-C625 PolarHBondContact N-O 3.4Å; N560-C625 PolarHBondContact O-N 3.36Å
561	A	86.9	Confident	91.6	Very high	12 Å²	12	41.6 Å²	41.6	10%	0.099	24%	0.24	C	C	.	.			trans	-85.7	160.5	173.9	0	0	0	0	0	110.8	G563 D564 A621 Y624	A561-G563 PolarHBondContact O-N 3.41Å; A561-D564 WeakPolarHBondContact CB-OD2 3.3Å; A561-D564 PolarHBondContact N-OD2 2.88Å; A561-D564 VanDerWaalsContact O-CB 3.29Å; A561-D564 WeakPolarHBondContact O-CB 3.2Å; A561-D564 PolarHBondContact O-N 2.99Å; A561-D564 VanDerWaalsContact O-N 3.09Å; A561-A621 WeakPolarHBondContact O-CB 3.29Å; A561-Y624 HydrophobicContact CB-CD1 4.37Å; A561-Y624 HydrophobicContact CB-CE1 4.01Å
562	P	88.3	Confident	91.4	Very high	59 Å²	59	44.5 Å²	44.5	38%	0.383	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	132.3	171.9	-25.2	33.5	0	0	0	112	D564 L622 Y624	P562-D564 VanDerWaalsContact C-N 3.31Å; P562-L622 WeakPolarHBondContact CB-O 3.47Å; P562-Y624 HydrophobicContact CG-CD2 4.19Å; P562-Y624 HydrophobicContact CG-CE2 4.09Å; P562-Y624 HydrophobicContact CG-CG 4.49Å
563	G	87.6	Confident	91.4	Very high	31 Å²	31	44.7 Å²	44.7	32%	0.32	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-4.9	-178.2	0	0	0	0	0	115.2	R493 A561 A621	R493-G563 PolarHBondContact NH2-O 2.95Å; A561-G563 PolarHBondContact O-N 3.41Å; G563-A621 PolarHBondContact N-O 3.16Å
564	D	88.8	Confident	91.3	Very high	28 Å²	28	44.7 Å²	44.7	15%	0.15	26%	0.26	C	S	.	.			trans	-71.1	136.1	173.9	-70.7	-15.6	0	0	0	111.4	R493 N560 A561 P562 I566 R620 A621	R493-D564 IonicContact CZ-OD1 3.89Å; R493-D564 IonicContact NE-OD1 3.7Å; R493-D564 IonicContact NH2-OD1 2.7Å; R493-D564 PolarHBondContact NH2-OD1 3.28Å; N560-D564 HydrophobicContact CB-CB 4.37Å; A561-D564 WeakPolarHBondContact CB-OD2 3.3Å; A561-D564 PolarHBondContact N-OD2 2.88Å; A561-D564 VanDerWaalsContact O-CB 3.29Å; A561-D564 WeakPolarHBondContact O-CB 3.2Å; A561-D564 PolarHBondContact O-N 2.99Å; A561-D564 VanDerWaalsContact O-N 3.09Å; P562-D564 VanDerWaalsContact C-N 3.31Å; D564-I566 WeakPolarHBondContact O-CD1 3.39Å; D564-R620 CarbonylContact O-C 3.56Å; D564-R620 WeakPolarHBondContact O-CA 3.27Å; D564-A621 PolarHBondContact O-N 3.18Å
565	L	92.1	Very high	91.3	Very high	66 Å²	66	44.6 Å²	44.6	35%	0.346	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	122	173.7	-70.2	163.7	0	0	0	108.5	H568 V619 R620	L565-H568 VanDerWaalsContact CD1-CE1 3.47Å; L565-H568 WeakPolarHBondContact CD1-CE1 3.46Å; L565-V619 CarbonylContact C-O 3.47Å; L565-V619 VanDerWaalsContact CA-O 3.27Å; L565-V619 WeakPolarHBondContact CA-O 3.27Å; L565-R620 HydrophobicContact CD2-CB 3.71Å; L565-R620 HydrophobicContact CD2-CG 4.08Å
566	I	94	Very high	91.3	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.056	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-42.6	178.8	-62	71.4	0	0	0	109.7	N560 D564 L584 F602 V619 A621 L627	N560-I566 HydrophobicContact CB-CD1 4.46Å; D564-I566 WeakPolarHBondContact O-CD1 3.39Å; I566-L584 HydrophobicContact CD1-CD2 3.59Å; I566-L584 HydrophobicContact CG1-CD2 3.96Å; I566-F602 HydrophobicContact CG2-CE2 4.37Å; I566-F602 HydrophobicContact CG2-CZ 4.35Å; I566-V619 HydrophobicContact CB-CB 4.4Å; I566-V619 HydrophobicContact CB-CG1 4.45Å; I566-V619 HydrophobicContact CD1-CG1 4.41Å; I566-V619 PolarHBondContact N-O 2.93Å; I566-A621 HydrophobicContact CD1-CB 4.01Å; I566-L627 HydrophobicContact CG1-CD1 3.8Å; I566-L627 HydrophobicContact CG2-CD1 4.01Å
567	F	94.8	Very high	91.5	Very high	2 Å²	2	42 Å²	42	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	140	173.8	-76	-78.9	0	0	0	109.3	E571 Q575 F602 S618 V619 L659	F567-E571 WeakPolarHBondContact CA-OE2 3.23Å; F567-Q575 HydrophobicContact CE1-CG 4.36Å; F567-Q575 HydrophobicContact CE2-CG 4.49Å; F567-Q575 HydrophobicContact CZ-CG 3.63Å; F567-F602 HydrophobicContact CD2-CD2 4.4Å; F567-F602 AromaticContact CD2-CE2 3.82Å; F567-F602 HydrophobicContact CD2-CE2 3.82Å; F567-F602 HydrophobicContact CE2-CD2 4.3Å; F567-F602 AromaticContact CE2-CE2 3.73Å; F567-F602 HydrophobicContact CE2-CE2 3.73Å; F567-S618 CarbonylContact O-C 3.59Å; F567-S618 WeakPolarHBondContact O-CA 3.43Å; F567-V619 HydrophobicContact CB-CB 4.43Å; F567-V619 HydrophobicContact CB-CG2 4.25Å; F567-V619 HydrophobicContact CD2-CG2 4.44Å; F567-V619 PolarHBondContact O-N 3.4Å; F567-L659 HydrophobicContact CB-CD1 4.4Å; F567-L659 HydrophobicContact CD2-CD1 3.63Å; F567-L659 HydrophobicContact CE2-CD1 3.92Å; F567-L659 HydrophobicContact CG-CD1 3.95Å; F567-L659 HydrophobicContact CZ-CD1 4.47Å
568	H	94.4	Very high	91.8	Very high	95 Å²	95	38.8 Å²	38.8	44%	0.44	22%	0.22	S	C	.	.			trans	-95.5	148.7	169.7	-66.3	-87.6	0	0	0	111.3	L565 G570 E571 S615	L565-H568 VanDerWaalsContact CD1-CE1 3.47Å; L565-H568 WeakPolarHBondContact CD1-CE1 3.46Å; H568-G570 PolarHBondContact O-N 3.48Å; H568-E571 HydrophobicContact CB-CB 4.25Å; H568-E571 IonicContact CD2-OE2 3.2Å; H568-E571 PolarHBondContact N-OE2 3.48Å; H568-E571 WeakPolarHBondContact O-CB 3.4Å; H568-E571 PolarHBondContact O-N 3.01Å; H568-S615 WeakPolarHBondContact O-CB 3.29Å
569	Q	93.7	Very high	92.2	Very high	91 Å²	91	36 Å²	36	43%	0.425	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	128.5	168.7	-172.4	174.8	22	0	0	110.1	A616 S618	Q569-A616 WeakPolarHBondContact CG-O 3.23Å; Q569-A616 PolarHBondContact NE2-O 3.44Å; Q569-S618 PolarHBondContact N-OG 3.43Å
570	G	92	Very high	92.4	Very high	42 Å²	42	34.3 Å²	34.3	43%	0.433	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-9.7	-174.2	0	0	0	0	0	115.1	H568 S615	H568-G570 PolarHBondContact O-N 3.48Å; G570-S615 PolarHBondContact N-O 3.47Å
571	E	93.6	Very high	92.6	Very high	75 Å²	75	36.4 Å²	36.4	35%	0.35	22%	0.217	S	C	.	.			trans	-70.3	151.7	179.2	-169.4	171.4	-171.7	0	0	112.2	F567 H568 I573 Q614 S615	F567-E571 WeakPolarHBondContact CA-OE2 3.23Å; H568-E571 HydrophobicContact CB-CB 4.25Å; H568-E571 IonicContact CD2-OE2 3.2Å; H568-E571 PolarHBondContact N-OE2 3.48Å; H568-E571 WeakPolarHBondContact O-CB 3.4Å; H568-E571 PolarHBondContact O-N 3.01Å; E571-I573 PolarHBondContact O-N 2.97Å; E571-Q614 CarbonylContact O-C 3.57Å; E571-Q614 WeakPolarHBondContact O-CA 3.27Å; E571-S615 PolarHBondContact O-N 3.15Å
572	S	92.7	Very high	92.8	Very high	62 Å²	62	36.6 Å²	36.6	43%	0.434	22%	0.22	S	C	.	.	B	Isolated β-bridge	trans	-69.6	127.7	175.5	54.5	0	0	0	0	111.7	D574	S572-D574 PolarHBondContact O-N 2.85Å; S572-D574 VanDerWaalsContact O-N 3.13Å
573	I	92.9	Very high	93.2	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.015	22%	0.215	C	C	.	.			trans	-85.8	84	176.1	-50.7	159.2	0	0	0	109	E571 Q604 G613 L659 R660	E571-I573 PolarHBondContact O-N 2.97Å; I573-Q604 HydrophobicContact CB-CB 4.36Å; I573-Q604 HydrophobicContact CD1-CB 4.38Å; I573-Q604 HydrophobicContact CG2-CB 3.86Å; I573-G613 PolarHBondContact N-O 3.02Å; I573-L659 HydrophobicContact CD1-CB 3.57Å; I573-L659 HydrophobicContact CG1-CB 4.12Å; I573-R660 HydrophobicContact CD1-CB 4.22Å
574	D	91.3	Very high	93.7	Very high	66 Å²	66	34.2 Å²	34.2	35%	0.353	20%	0.2	S	C	.	.			trans	-98.8	-3.7	-176.2	75.5	-28	0	0	0	114.2	S572 R632	S572-D574 PolarHBondContact O-N 2.85Å; S572-D574 VanDerWaalsContact O-N 3.13Å; D574-R632 WeakPolarHBondContact O-CB 3.36Å; D574-R632 PolarHBondContact O-N 3.11Å
575	Q	93.7	Very high	94.1	Very high	33 Å²	33	33.5 Å²	33.5	15%	0.154	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	149.3	-178.6	61.8	-179.2	4.3	0	0	112.2	F567 I630	F567-Q575 HydrophobicContact CE1-CG 4.36Å; F567-Q575 HydrophobicContact CE2-CG 4.49Å; F567-Q575 HydrophobicContact CZ-CG 3.63Å; Q575-I630 WeakPolarHBondContact CA-O 3.49Å
576	L	94.1	Very high	94.3	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.4	170.7	178.3	69.2	0	0	0	108.1	F578 I601 C629 I630 L635 L653 L655	L576-F578 HydrophobicContact CD2-CE2 3.87Å; L576-F578 HydrophobicContact CD2-CZ 3.72Å; L576-F578 HydrophobicContact CG-CE2 4Å; L576-F578 HydrophobicContact CG-CZ 4.22Å; L576-I601 HydrophobicContact CD1-CG2 3.76Å; L576-I601 HydrophobicContact CG-CG2 4.24Å; L576-C629 CarbonylContact O-C 3.43Å; L576-C629 VanDerWaalsContact O-CA 3.25Å; L576-C629 WeakPolarHBondContact O-CA 3.41Å; L576-I630 HydrophobicContact CB-CG2 4.04Å; L576-I630 HydrophobicContact CD2-CG2 4.49Å; L576-I630 PolarHBondContact N-O 3.21Å; L576-I630 PolarHBondContact O-N 3.06Å; L576-L635 HydrophobicContact CD2-CD2 3.98Å; L576-L653 HydrophobicContact CD2-CD2 4.12Å; L576-L655 HydrophobicContact CD1-CD2 3.5Å; L576-L655 VanDerWaalsContact CD1-CD2 3.5Å
577	C	95.7	Very high	94.4	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.7	-175.3	-70	0	0	0	0	112	F602 C629	C577-F602 HydrophobicContact CB-CD1 4.25Å; C577-F602 HydrophobicContact CB-CE1 3.61Å; C577-F602 HydrophobicContact CB-CE2 3.99Å; C577-F602 HydrophobicContact CB-CZ 3.46Å; C577-F602 VanDerWaalsContact CB-CZ 3.46Å; C577-F602 PolarHBondContact N-O 3.47Å; C577-F602 VanDerWaalsContact N-O 3.13Å; C577-F602 PolarHBondContact O-N 3.49Å; C577-F602 VanDerWaalsContact O-N 3.11Å; C577-C629 HydrophobicContact CB-CB 4.22Å; C577-C629 WeakPolarHBondContact CB-SG 3.47Å; C577-C629 WeakPolarHBondContact SG-CB 3.44Å; C577-C629 CovalentContact SG-SG 2.07Å; C577-C629 PolarHBondContact SG-SG 3.4Å
578	F	96	Very high	94.4	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.3	178.2	-60.2	-97.4	0	0	0	108.8	V533 H537 F540 F555 L576 V580 I601 L627 Q628 I630 L653	V533-F578 HydrophobicContact CG1-CB 4.47Å; V533-F578 HydrophobicContact CG1-CD1 3.93Å; V533-F578 HydrophobicContact CG1-CD2 4.29Å; V533-F578 HydrophobicContact CG1-CE1 4.19Å; V533-F578 HydrophobicContact CG1-CG 3.98Å; V533-F578 HydrophobicContact CG2-CB 3.68Å; V533-F578 HydrophobicContact CG2-CG 4.1Å; H537-F578 AromaticContact CD2-CD1 3.68Å; H537-F578 AromaticContact NE2-CD1 3.46Å; H537-F578 WeakPolarHBondContact NE2-CD1 3.42Å; F540-F578 AromaticContact CE2-CE1 3.81Å; F540-F578 HydrophobicContact CE2-CE1 3.81Å; F540-F578 AromaticContact CE2-CZ 3.94Å; F540-F578 HydrophobicContact CE2-CZ 3.94Å; F540-F578 HydrophobicContact CZ-CE1 4.08Å; F540-F578 HydrophobicContact CZ-CE2 4.46Å; F540-F578 AromaticContact CZ-CZ 3.7Å; F540-F578 HydrophobicContact CZ-CZ 3.7Å; F555-F578 AromaticContact CE1-CD2 3.73Å; F555-F578 HydrophobicContact CE1-CD2 3.73Å; F555-F578 AromaticContact CE1-CE2 3.69Å; F555-F578 HydrophobicContact CE1-CE2 3.69Å; F555-F578 HydrophobicContact CZ-CD2 4.25Å; F555-F578 AromaticContact CZ-CE2 3.79Å; F555-F578 HydrophobicContact CZ-CE2 3.79Å; F555-F578 HydrophobicContact CZ-CZ 4.48Å; L576-F578 HydrophobicContact CD2-CE2 3.87Å; L576-F578 HydrophobicContact CD2-CZ 3.72Å; L576-F578 HydrophobicContact CG-CE2 4Å; L576-F578 HydrophobicContact CG-CZ 4.22Å; F578-V580 PolarHBondContact O-N 3.12Å; F578-I601 HydrophobicContact CD1-CB 4.46Å; F578-I601 HydrophobicContact CD1-CD1 3.95Å; F578-I601 HydrophobicContact CD1-CG1 3.75Å; F578-I601 HydrophobicContact CD1-CG2 4.03Å; F578-I601 HydrophobicContact CE1-CD1 3.7Å; F578-I601 HydrophobicContact CE1-CG1 3.99Å; F578-I601 HydrophobicContact CE1-CG2 3.95Å; F578-I601 HydrophobicContact CZ-CG2 4.4Å; F578-L627 WeakPolarHBondContact O-CA 3.27Å; F578-Q628 WeakPolarHBondContact CD2-O 3.28Å; F578-Q628 PolarHBondContact N-O 3.33Å; F578-Q628 PolarHBondContact O-N 2.65Å; F578-I630 HydrophobicContact CE2-CG2 4.23Å; F578-L653 HydrophobicContact CE1-CD1 4.38Å; F578-L653 HydrophobicContact CZ-CD1 4.49Å
579	V	95.7	Very high	94.3	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	109.5	-179.2	-175	0	0	0	0	109.1	L584 L596 S597 G599 D600 F602 L627	V579-L584 HydrophobicContact CB-CD1 4.31Å; V579-L584 HydrophobicContact CG1-CD1 3.64Å; V579-L584 HydrophobicContact CG2-CD1 3.61Å; V579-L596 HydrophobicContact CG2-CB 4.43Å; V579-S597 WeakPolarHBondContact CB-O 3.37Å; V579-S597 VanDerWaalsContact CG1-O 3.29Å; V579-S597 WeakPolarHBondContact CG1-O 3.45Å; V579-G599 PolarHBondContact O-N 2.91Å; V579-D600 HydrophobicContact CG2-CB 4.49Å; V579-D600 PolarHBondContact N-O 2.9Å; V579-F602 HydrophobicContact CG2-CD1 3.94Å; V579-F602 HydrophobicContact CG2-CE1 3.68Å; V579-L627 HydrophobicContact CG1-CD2 4.38Å; V579-L627 HydrophobicContact CG2-CD2 4.21Å
580	V	92.9	Very high	94.1	Very high	26 Å²	26	31.4 Å²	31.4	16%	0.158	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-32.8	-179	179.7	0	0	0	0	111.6	A532 V533 F578 K598 D626 Q628	A532-V580 HydrophobicContact CB-CG1 3.91Å; V533-V580 HydrophobicContact CG2-CG2 3.85Å; F578-V580 PolarHBondContact O-N 3.12Å; V580-K598 VanDerWaalsContact O-CD 3.31Å; V580-K598 WeakPolarHBondContact O-CD 3.46Å; V580-K598 VanDerWaalsContact O-CE 3.31Å; V580-K598 WeakPolarHBondContact O-CE 3.36Å; V580-K598 VanDerWaalsContact O-CG 3.25Å; V580-K598 WeakPolarHBondContact O-CG 3.38Å; V580-D626 PolarHBondContact N-O 2.97Å; V580-Q628 HydrophobicContact CG2-CB 4.24Å; V580-Q628 HydrophobicContact CG2-CG 3.66Å
581	S	92.4	Very high	94.2	Very high	56 Å²	56	33.4 Å²	33.4	39%	0.392	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	151.9	179.1	-170.7	0	0	0	0	110.6	C625 D626	S581-C625 WeakPolarHBondContact O-CA 3.5Å; S581-D626 PolarHBondContact N-O 3.28Å; S581-D626 PolarHBondContact O-N 3.37Å
582	G	92.7	Very high	94.2	Very high	17 Å²	17	34.6 Å²	34.6	18%	0.175	20%	0.197	C	C	.	.	S	Bend	trans	90.5	-167.6	179.4	0	0	0	0	0	114.1	T623	G582-T623 WeakPolarHBondContact CA-OG1 3.44Å
583	S	96.4	Very high	94.3	Very high	40 Å²	40	33.4 Å²	33.4	28%	0.28	19%	0.187	S	C	.	.			trans	-141.2	139.1	179.8	-54.7	0	0	0	0	110.7	L596 L622 T623 C625	S583-L596 CarbonylContact C-O 3.5Å; S583-L596 VanDerWaalsContact CA-O 3.31Å; S583-L596 WeakPolarHBondContact CA-O 3.47Å; S583-L622 WeakPolarHBondContact O-CB 3.34Å; S583-L622 PolarHBondContact O-N 3.04Å; S583-T623 PolarHBondContact N-OG1 2.93Å; S583-T623 PolarHBondContact O-N 3.13Å; S583-C625 PolarHBondContact N-SG 3.3Å; S583-C625 VanDerWaalsContact N-SG 3.39Å; S583-C625 PolarHBondContact O-SG 3.38Å
584	L	97.6	Very high	94.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	154.2	178.8	-53.2	91.1	0	0	0	109.3	I566 V579 I595 L596 F602 V619 R620 C625 L627	I566-L584 HydrophobicContact CD1-CD2 3.59Å; I566-L584 HydrophobicContact CG1-CD2 3.96Å; V579-L584 HydrophobicContact CB-CD1 4.31Å; V579-L584 HydrophobicContact CG1-CD1 3.64Å; V579-L584 HydrophobicContact CG2-CD1 3.61Å; L584-I595 CarbonylContact O-C 3.55Å; L584-I595 WeakPolarHBondContact O-CA 3.37Å; L584-L596 HydrophobicContact CB-CB 4.26Å; L584-L596 HydrophobicContact CD1-CB 4.4Å; L584-L596 PolarHBondContact N-O 2.91Å; L584-L596 PolarHBondContact O-N 3.49Å; L584-F602 HydrophobicContact CD2-CZ 4.34Å; L584-V619 HydrophobicContact CB-CG1 4.16Å; L584-V619 HydrophobicContact CD2-CG1 3.84Å; L584-R620 CarbonylContact C-O 3.57Å; L584-R620 VanDerWaalsContact CA-O 3.23Å; L584-R620 WeakPolarHBondContact CA-O 3.48Å; L584-R620 WeakPolarHBondContact CB-O 3.34Å; L584-C625 HydrophobicContact CD1-CB 4.42Å; L584-C625 HydrophobicContact CG-CB 4.49Å; L584-L627 HydrophobicContact CD1-CD2 4.03Å; L584-L627 HydrophobicContact CD2-CD1 4.09Å; L584-L627 HydrophobicContact CD2-CD2 4.18Å
585	E	97	Very high	94.7	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	144.7	170.4	65.2	-171.8	155.8	0	0	109.8	I587 I592 A594 V619 R620 L622	E585-I587 HydrophobicContact CG-CD1 4.15Å; E585-I587 HydrophobicContact CG-CG1 4.14Å; E585-I592 HydrophobicContact CB-CG2 4.2Å; E585-I592 VanDerWaalsContact OE2-CD1 3.29Å; E585-I592 WeakPolarHBondContact OE2-CD1 3.18Å; E585-A594 CarbonylContact C-O 3.55Å; E585-A594 WeakPolarHBondContact CA-O 3.48Å; E585-V619 CarbonylContact O-C 3.59Å; E585-V619 WeakPolarHBondContact O-CA 3.32Å; E585-R620 HydrophobicContact CG-CB 3.89Å; E585-R620 PolarHBondContact N-O 3.36Å; E585-R620 PolarHBondContact O-N 3.15Å; E585-R620 IonicContact OE1-CZ 3.72Å; E585-R620 IonicContact OE1-NE 3.61Å; E585-R620 PolarHBondContact OE1-NE 2.91Å; E585-R620 IonicContact OE1-NH2 2.77Å; E585-R620 PolarHBondContact OE1-NH2 2.85Å; E585-R620 IonicContact OE2-NH2 2.76Å; E585-L622 HydrophobicContact CB-CD1 4.24Å; E585-L622 HydrophobicContact CB-CD2 4.47Å; E585-L622 HydrophobicContact CB-CG 4.27Å; E585-L622 VanDerWaalsContact CD-CD2 3.46Å; E585-L622 HydrophobicContact CG-CD2 4.11Å; E585-L622 HydrophobicContact CG-CG 4.22Å; E585-L622 WeakPolarHBondContact OE1-CD2 3.17Å
586	V	97	Very high	94.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.3	175.7	-172.9	0	0	0	0	107.5	I592 V593 A594 L596 A617 S618 V619 Y657 L659	V586-I592 CarbonylContact O-C 3.58Å; V586-I592 WeakPolarHBondContact O-CA 3.43Å; V586-V593 HydrophobicContact CB-CG2 3.87Å; V586-V593 HydrophobicContact CG1-CG2 3.64Å; V586-V593 VanDerWaalsContact O-CG2 3.3Å; V586-V593 WeakPolarHBondContact O-CG2 3.39Å; V586-V593 PolarHBondContact O-N 3.44Å; V586-A594 HydrophobicContact CB-CB 4.11Å; V586-A594 HydrophobicContact CG2-CB 4.07Å; V586-A594 PolarHBondContact N-O 2.93Å; V586-L596 HydrophobicContact CG2-CD1 3.89Å; V586-L596 HydrophobicContact CG2-CG 4.11Å; V586-A617 HydrophobicContact CG1-CB 3.52Å; V586-S618 CarbonylContact C-O 3.54Å; V586-S618 WeakPolarHBondContact CA-O 3.21Å; V586-V619 HydrophobicContact CG1-CG2 4.42Å; V586-V619 HydrophobicContact CG2-CG2 4.28Å; V586-Y657 HydrophobicContact CG1-CD1 4.01Å; V586-Y657 HydrophobicContact CG1-CE1 3.61Å; V586-Y657 HydrophobicContact CG1-CE2 4.41Å; V586-Y657 HydrophobicContact CG2-CD1 4.35Å; V586-Y657 HydrophobicContact CG2-CG 4.36Å; V586-L659 HydrophobicContact CG1-CD2 4.46Å
587	I	96.3	Very high	94.9	Very high	25 Å²	25	37.9 Å²	37.9	13%	0.128	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.4	-172.2	-55.1	169.4	0	0	0	108.7	E585 E591 A617 S618 R620	E585-I587 HydrophobicContact CG-CD1 4.15Å; E585-I587 HydrophobicContact CG-CG1 4.14Å; I587-E591 CarbonylContact C-O 3.57Å; I587-E591 WeakPolarHBondContact CA-O 3.47Å; I587-A617 CarbonylContact O-C 3.48Å; I587-A617 WeakPolarHBondContact O-CA 3.42Å; I587-A617 WeakPolarHBondContact O-CB 3.35Å; I587-S618 PolarHBondContact N-O 3.23Å; I587-S618 PolarHBondContact O-N 2.96Å; I587-R620 HydrophobicContact CD1-CB 4.11Å; I587-R620 VanDerWaalsContact CD1-CZ 3.49Å
588	Q	94.8	Very high	94.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.5	175.1	-165	-166.3	-53.3	0	0	109.2	D590 E591 V593 A616 A617 R662 L663 F665	Q588-D590 PolarHBondContact O-N 3.42Å; Q588-E591 PolarHBondContact N-O 3.38Å; Q588-E591 PolarHBondContact O-N 3.23Å; Q588-V593 HydrophobicContact CB-CG1 3.73Å; Q588-V593 HydrophobicContact CB-CG2 4.19Å; Q588-A616 WeakPolarHBondContact CG-O 3.4Å; Q588-A617 HydrophobicContact CB-CB 3.99Å; Q588-A617 HydrophobicContact CG-CB 4.32Å; Q588-R662 VanDerWaalsContact NE2-CG 3.32Å; Q588-L663 PolarHBondContact NE2-O 2.99Å; Q588-F665 HydrophobicContact CB-CE1 4.42Å
589	D	91.3	Very high	94.7	Very high	51 Å²	51	44.8 Å²	44.8	27%	0.273	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	42.7	177.7	-44.8	-49.3	0	0	0	113.1	E591 R662 F665 K667	D589-E591 PolarHBondContact O-N 2.72Å; D589-R662 IonicContact OD1-CZ 3.87Å; D589-R662 IonicContact OD1-NH1 3.12Å; D589-R662 PolarHBondContact OD1-NH1 2.89Å; D589-R662 IonicContact OD1-NH2 3.41Å; D589-R662 PolarHBondContact OD1-NH2 3.22Å; D589-R662 IonicContact OD2-CZ 2.73Å; D589-R662 VanDerWaalsContact OD2-CZ 3.25Å; D589-R662 IonicContact OD2-NH1 2.65Å; D589-R662 PolarHBondContact OD2-NH1 3.29Å; D589-R662 IonicContact OD2-NH2 3.09Å; D589-R662 PolarHBondContact OD2-NH2 2.95Å; D589-F665 HydrophobicContact CB-CZ 4.2Å; D589-K667 VanDerWaalsContact O-CE 3.23Å; D589-K667 WeakPolarHBondContact O-CE 3.48Å; D589-K667 PolarHBondContact O-NZ 3.5Å
590	D	89.9	Confident	94.7	Very high	146 Å²	146	46.5 Å²	46.5	78%	0.781	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	12.7	-175.5	-54.4	-41.2	0	0	0	116.5	Q588	Q588-D590 PolarHBondContact O-N 3.42Å
591	E	94	Very high	94.8	Very high	84 Å²	84	45.7 Å²	45.7	39%	0.393	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	143.9	174.5	-58.5	-59.4	149.9	0	0	111.3	I587 Q588 D589 V593 F665 K667	I587-E591 CarbonylContact C-O 3.57Å; I587-E591 WeakPolarHBondContact CA-O 3.47Å; Q588-E591 PolarHBondContact N-O 3.38Å; Q588-E591 PolarHBondContact O-N 3.23Å; D589-E591 PolarHBondContact O-N 2.72Å; E591-V593 PolarHBondContact O-N 3.37Å; E591-F665 HydrophobicContact CB-CE2 4.01Å; E591-F665 HydrophobicContact CB-CZ 4.04Å; E591-F665 HydrophobicContact CG-CE2 3.76Å; E591-F665 HydrophobicContact CG-CZ 4.2Å; E591-K667 HydrophobicContact CG-CD 4.32Å; E591-K667 HydrophobicContact CG-CG 4.39Å; E591-K667 WeakPolarHBondContact OE1-CD 3.33Å; E591-K667 VanDerWaalsContact OE1-CE 3.26Å; E591-K667 WeakPolarHBondContact OE1-CE 3.31Å; E591-K667 IonicContact OE1-NZ 2.67Å; E591-K667 PolarHBondContact OE1-NZ 3.41Å
592	I	94.9	Very high	94.9	Very high	100 Å²	100	43 Å²	43	51%	0.513	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	116.5	175.3	-58.3	164.9	0	0	0	108.4	E585 V586 I595	E585-I592 HydrophobicContact CB-CG2 4.2Å; E585-I592 VanDerWaalsContact OE2-CD1 3.29Å; E585-I592 WeakPolarHBondContact OE2-CD1 3.18Å; V586-I592 CarbonylContact O-C 3.58Å; V586-I592 WeakPolarHBondContact O-CA 3.43Å; I592-I595 HydrophobicContact CG2-CG1 4.39Å
593	V	94.6	Very high	94.9	Very high	36 Å²	36	42.2 Å²	42.2	22%	0.218	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-25	-176.9	-66.6	0	0	0	0	113.4	V586 Q588 E591 Y657 L663 F665	V586-V593 HydrophobicContact CB-CG2 3.87Å; V586-V593 HydrophobicContact CG1-CG2 3.64Å; V586-V593 VanDerWaalsContact O-CG2 3.3Å; V586-V593 WeakPolarHBondContact O-CG2 3.39Å; V586-V593 PolarHBondContact O-N 3.44Å; Q588-V593 HydrophobicContact CB-CG1 3.73Å; Q588-V593 HydrophobicContact CB-CG2 4.19Å; E591-V593 PolarHBondContact O-N 3.37Å; V593-Y657 HydrophobicContact CG2-CE2 3.96Å; V593-Y657 WeakPolarHBondContact CG2-OH 3.5Å; V593-L663 HydrophobicContact CB-CD2 4.13Å; V593-L663 HydrophobicContact CG1-CD2 3.83Å; V593-F665 HydrophobicContact CG1-CE1 4.09Å
594	A	95.8	Very high	94.6	Very high	23 Å²	23	40.7 Å²	40.7	19%	0.19	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	154.4	176.8	0	0	0	0	0	111.6	E585 V586 Y657	E585-A594 CarbonylContact C-O 3.55Å; E585-A594 WeakPolarHBondContact CA-O 3.48Å; V586-A594 HydrophobicContact CB-CB 4.11Å; V586-A594 HydrophobicContact CG2-CB 4.07Å; V586-A594 PolarHBondContact N-O 2.93Å; A594-Y657 HydrophobicContact CB-CD2 3.6Å; A594-Y657 HydrophobicContact CB-CE2 3.97Å; A594-Y657 HydrophobicContact CB-CG 4.39Å
595	I	97	Very high	94	Very high	117 Å²	117	42 Å²	42	60%	0.6	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.1	167.7	-61.3	174.9	0	0	0	106.9	L584 I592	L584-I595 CarbonylContact O-C 3.55Å; L584-I595 WeakPolarHBondContact O-CA 3.37Å; I592-I595 HydrophobicContact CG2-CG1 4.39Å
596	L	96.6	Very high	93.2	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.8	178.8	-54.5	173.4	0	0	0	108.8	V579 S583 L584 V586 D600 F602	V579-L596 HydrophobicContact CG2-CB 4.43Å; S583-L596 CarbonylContact C-O 3.5Å; S583-L596 VanDerWaalsContact CA-O 3.31Å; S583-L596 WeakPolarHBondContact CA-O 3.47Å; L584-L596 HydrophobicContact CB-CB 4.26Å; L584-L596 HydrophobicContact CD1-CB 4.4Å; L584-L596 PolarHBondContact N-O 2.91Å; L584-L596 PolarHBondContact O-N 3.49Å; V586-L596 HydrophobicContact CG2-CD1 3.89Å; V586-L596 HydrophobicContact CG2-CG 4.11Å; L596-D600 HydrophobicContact CB-CB 4.17Å; L596-D600 HydrophobicContact CD2-CB 4.18Å; L596-F602 HydrophobicContact CD1-CB 3.71Å; L596-F602 HydrophobicContact CD1-CD1 3.61Å; L596-F602 HydrophobicContact CD1-CD2 4.35Å; L596-F602 HydrophobicContact CD1-CE1 4.33Å; L596-F602 HydrophobicContact CD1-CG 3.63Å
597	S	95.5	Very high	92.1	Very high	56 Å²	56	47.1 Å²	47.1	39%	0.392	25%	0.253	S	S	.	.			trans	-122.6	-176.5	-176.4	68.4	0	0	0	0	110.8	V579 G599 D600	V579-S597 WeakPolarHBondContact CB-O 3.37Å; V579-S597 VanDerWaalsContact CG1-O 3.29Å; V579-S597 WeakPolarHBondContact CG1-O 3.45Å; S597-G599 PolarHBondContact O-N 3.43Å; S597-D600 PolarHBondContact N-OD2 3.42Å; S597-D600 WeakPolarHBondContact O-CB 3.46Å; S597-D600 PolarHBondContact O-N 3.42Å; S597-D600 VanDerWaalsContact O-N 3.1Å; S597-D600 PolarHBondContact OG-OD2 3.34Å; S597-D600 VanDerWaalsContact OG-OD2 3.11Å
598	K	94.1	Very high	90.9	Very high	120 Å²	120	54.6 Å²	54.6	52%	0.522	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	128.7	177.4	176.2	175	-174	-149.6	0	111.2	E536 V580	E536-K598 WeakPolarHBondContact OE1-CE 3.35Å; E536-K598 IonicContact OE1-NZ 3.97Å; E536-K598 PolarHBondContact OE1-NZ 3.32Å; E536-K598 WeakPolarHBondContact OE2-CE 3.27Å; E536-K598 IonicContact OE2-NZ 3.75Å; V580-K598 VanDerWaalsContact O-CD 3.31Å; V580-K598 WeakPolarHBondContact O-CD 3.46Å; V580-K598 VanDerWaalsContact O-CE 3.31Å; V580-K598 WeakPolarHBondContact O-CE 3.36Å; V580-K598 VanDerWaalsContact O-CG 3.25Å; V580-K598 WeakPolarHBondContact O-CG 3.38Å
599	G	92	Very high	89.7	Confident	27 Å²	27	56.8 Å²	56.8	28%	0.278	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	1.4	179.7	0	0	0	0	0	114	H537 V579 S597	H537-G599 PolarHBondContact CE1-O 2.97Å; V579-G599 PolarHBondContact O-N 2.91Å; S597-G599 PolarHBondContact O-N 3.43Å
600	D	95.4	Very high	88.8	Confident	36 Å²	36	60.4 Å²	60.4	19%	0.193	32%	0.32	C	S	.	.			trans	-84.7	151.6	174.6	-73.8	-46.6	0	0	0	112.8	V579 L596 S597 S656	V579-D600 HydrophobicContact CG2-CB 4.49Å; V579-D600 PolarHBondContact N-O 2.9Å; L596-D600 HydrophobicContact CB-CB 4.17Å; L596-D600 HydrophobicContact CD2-CB 4.18Å; S597-D600 PolarHBondContact N-OD2 3.42Å; S597-D600 WeakPolarHBondContact O-CB 3.46Å; S597-D600 PolarHBondContact O-N 3.42Å; S597-D600 VanDerWaalsContact O-N 3.1Å; S597-D600 PolarHBondContact OG-OD2 3.34Å; S597-D600 VanDerWaalsContact OG-OD2 3.11Å; D600-S656 WeakPolarHBondContact CA-OG 3.4Å; D600-S656 WeakPolarHBondContact CB-OG 3.43Å; D600-S656 WeakPolarHBondContact OD1-CB 3.5Å; D600-S656 PolarHBondContact OD1-OG 2.89Å
601	I	95.4	Very high	88.5	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.046	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.4	-179.5	-45.2	174.2	0	0	0	108.8	L576 F578 L653 L655 S656 Y657	L576-I601 HydrophobicContact CD1-CG2 3.76Å; L576-I601 HydrophobicContact CG-CG2 4.24Å; F578-I601 HydrophobicContact CD1-CB 4.46Å; F578-I601 HydrophobicContact CD1-CD1 3.95Å; F578-I601 HydrophobicContact CD1-CG1 3.75Å; F578-I601 HydrophobicContact CD1-CG2 4.03Å; F578-I601 HydrophobicContact CE1-CD1 3.7Å; F578-I601 HydrophobicContact CE1-CG1 3.99Å; F578-I601 HydrophobicContact CE1-CG2 3.95Å; F578-I601 HydrophobicContact CZ-CG2 4.4Å; I601-L653 HydrophobicContact CD1-CD1 3.81Å; I601-L655 HydrophobicContact CB-CD2 4.3Å; I601-L655 HydrophobicContact CG2-CD2 3.68Å; I601-S656 PolarHBondContact N-OG 3.01Å; I601-S656 WeakPolarHBondContact O-CB 3.4Å; I601-S656 PolarHBondContact O-N 2.86Å; I601-Y657 PolarHBondContact O-N 2.99Å
602	F	95.1	Very high	88.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152	178.4	67.7	-79.8	0	0	0	111.9	I566 F567 C577 V579 L584 L596 V619 L627 Y657 L659	I566-F602 HydrophobicContact CG2-CE2 4.37Å; I566-F602 HydrophobicContact CG2-CZ 4.35Å; F567-F602 HydrophobicContact CD2-CD2 4.4Å; F567-F602 AromaticContact CD2-CE2 3.82Å; F567-F602 HydrophobicContact CD2-CE2 3.82Å; F567-F602 HydrophobicContact CE2-CD2 4.3Å; F567-F602 AromaticContact CE2-CE2 3.73Å; F567-F602 HydrophobicContact CE2-CE2 3.73Å; C577-F602 HydrophobicContact CB-CD1 4.25Å; C577-F602 HydrophobicContact CB-CE1 3.61Å; C577-F602 HydrophobicContact CB-CE2 3.99Å; C577-F602 HydrophobicContact CB-CZ 3.46Å; C577-F602 VanDerWaalsContact CB-CZ 3.46Å; C577-F602 PolarHBondContact N-O 3.47Å; C577-F602 VanDerWaalsContact N-O 3.13Å; C577-F602 PolarHBondContact O-N 3.49Å; C577-F602 VanDerWaalsContact O-N 3.11Å; V579-F602 HydrophobicContact CG2-CD1 3.94Å; V579-F602 HydrophobicContact CG2-CE1 3.68Å; L584-F602 HydrophobicContact CD2-CZ 4.34Å; L596-F602 HydrophobicContact CD1-CB 3.71Å; L596-F602 HydrophobicContact CD1-CD1 3.61Å; L596-F602 HydrophobicContact CD1-CD2 4.35Å; L596-F602 HydrophobicContact CD1-CE1 4.33Å; L596-F602 HydrophobicContact CD1-CG 3.63Å; F602-V619 HydrophobicContact CD2-CG2 4.4Å; F602-V619 HydrophobicContact CE2-CG1 4.19Å; F602-V619 HydrophobicContact CE2-CG2 4.43Å; F602-L627 HydrophobicContact CE1-CD1 4.35Å; F602-L627 HydrophobicContact CE1-CG 4.37Å; F602-L627 HydrophobicContact CZ-CD1 3.87Å; F602-L627 HydrophobicContact CZ-CG 4.34Å; F602-Y657 WeakPolarHBondContact CA-O 3.34Å; F602-L659 HydrophobicContact CD2-CD1 4.07Å
603	G	93.1	Very high	87.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.2	-143.5	-175	0	0	0	0	0	111.7	Y657 N658 L659	G603-Y657 PolarHBondContact N-O 3.41Å; G603-N658 PolarHBondContact O-OD1 2.9Å; G603-L659 PolarHBondContact O-N 3Å
604	Q	89.2	Confident	87.5	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.037	31%	0.313	C	S	.	.			trans	-120	141.5	175.5	-174.6	-172.8	-4.1	0	0	110.3	I573 I606 D609 D611 R660	I573-Q604 HydrophobicContact CB-CB 4.36Å; I573-Q604 HydrophobicContact CD1-CB 4.38Å; I573-Q604 HydrophobicContact CG2-CB 3.86Å; Q604-I606 PolarHBondContact O-N 3.15Å; Q604-D609 PolarHBondContact NE2-OD2 3.24Å; Q604-D611 PolarHBondContact NE2-O 3.16Å; Q604-R660 HydrophobicContact CG-CB 4.31Å
605	P	85.3	Confident	87.5	Confident	29 Å²	29	58 Å²	58	19%	0.188	31%	0.305	C	S	.	.			trans	-66.3	130.7	172.1	27.4	-34.2	0	0	0	111	L655	P605-L655 HydrophobicContact CB-CD1 4.13Å; P605-L655 HydrophobicContact CG-CD1 4.4Å
606	I	80.1	Confident	87.3	Confident	20 Å²	20	53 Å²	53	10%	0.103	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-32.5	-169.9	-60.8	170.6	0	0	0	112.7	Q604 L635 I636	Q604-I606 PolarHBondContact O-N 3.15Å; I606-L635 HydrophobicContact CD1-CB 4.25Å; I606-L635 HydrophobicContact CD1-CD2 3.12Å; I606-L635 HydrophobicContact CD1-CG 3.57Å; I606-I636 HydrophobicContact CG2-CD1 4.01Å; I606-I636 HydrophobicContact CG2-CG1 3.44Å; I606-I636 VanDerWaalsContact CG2-CG1 3.44Å
607	F	74.8	Confident	87.2	Confident	99 Å²	99	52.9 Å²	52.9	43%	0.434	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-17.6	-170.3	-63.3	-80.3	0	0	0	115	L639 A646 F649	F607-L639 HydrophobicContact CE1-CD1 4.27Å; F607-L639 HydrophobicContact CE2-CD1 4.22Å; F607-L639 HydrophobicContact CZ-CD1 3.63Å; F607-L639 HydrophobicContact CZ-CD2 4.22Å; F607-L639 HydrophobicContact CZ-CG 4.35Å; F607-A646 HydrophobicContact CE1-CB 4.06Å; F607-A646 HydrophobicContact CZ-CB 4.11Å; F607-A646 WeakPolarHBondContact CZ-O 3.47Å; F607-F649 AromaticContact CE2-CD1 3.84Å; F607-F649 HydrophobicContact CE2-CD1 3.84Å; F607-F649 HydrophobicContact CZ-CD1 4.16Å
608	K	70.9	Confident	87.3	Confident	181 Å²	181	51.2 Å²	51.2	79%	0.787	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-35.8	-176.7	-70.3	-175	177.2	-178.9	0	112.4
609	D	68.9	Low	87.4	Confident	47 Å²	47	45.5 Å²	45.5	25%	0.251	25%	0.245	S	C	.	.			trans	-121.8	121.3	-172.3	-54.5	-33	0	0	0	109.7	Q604 D611 R632 R660	Q604-D609 PolarHBondContact NE2-OD2 3.24Å; D609-D611 PolarHBondContact O-N 3.43Å; D609-R632 PolarHBondContact O-NH2 3.47Å; D609-R660 WeakPolarHBondContact OD2-CD 3.4Å; D609-R660 IonicContact OD2-CZ 2.66Å; D609-R660 IonicContact OD2-NE 2.65Å; D609-R660 PolarHBondContact OD2-NE 2.96Å; D609-R660 IonicContact OD2-NH1 3.05Å
610	T	72.8	Confident	87.6	Confident	126 Å²	126	48.7 Å²	48.7	77%	0.773	25%	0.249	S	C	*	.	S	Bend	trans	-69.3	-25.7	172.9	45.2	0	0	0	0	112.4	R632	T610-R632 PolarHBondContact O-NH2 3.32Å
611	D	83.5	Confident	87.5	Confident	104 Å²	104	47 Å²	47	56%	0.556	24%	0.24	S	C	*	.	S	Bend	trans	-96.9	147.1	-169.3	-55.8	-10.5	0	0	0	111.9	Q604 D609 G613 R660	Q604-D611 PolarHBondContact NE2-O 3.16Å; D609-D611 PolarHBondContact O-N 3.43Å; D611-G613 PolarHBondContact O-N 3.02Å; D611-R660 PolarHBondContact O-NH1 2.76Å
612	V	84.1	Confident	87.5	Confident	81 Å²	81	50.2 Å²	50.2	49%	0.491	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-67.1	117.1	172.6	-177.4	0	0	0	0	108.6
613	G	86	Confident	87.3	Confident	3 Å²	3	53 Å²	53	3%	0.031	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-79.5	160.5	178.2	0	0	0	0	0	113.3	I573 D611	I573-G613 PolarHBondContact N-O 3.02Å; D611-G613 PolarHBondContact O-N 3.02Å
614	Q	92.6	Very high	87.1	Confident	146 Å²	146	59.4 Å²	59.4	68%	0.682	30%	0.299	S	S	*	.	B	Isolated β-bridge	trans	-91.8	144.2	166.1	-66.7	178.6	-1.6	0	0	109.7	E571 A616	E571-Q614 CarbonylContact O-C 3.57Å; E571-Q614 WeakPolarHBondContact O-CA 3.27Å; Q614-A616 PolarHBondContact O-N 3.35Å
615	S	94	Very high	87.2	Confident	4 Å²	4	59 Å²	59	3%	0.028	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-71.7	121.9	175.8	-164	0	0	0	0	110.9	H568 G570 E571 A617	H568-S615 WeakPolarHBondContact O-CB 3.29Å; G570-S615 PolarHBondContact N-O 3.47Å; E571-S615 PolarHBondContact O-N 3.15Å; S615-A617 VanDerWaalsContact C-N 3.27Å; S615-A617 PolarHBondContact O-N 3.33Å; S615-A617 PolarHBondContact OG-O 3.3Å
616	A	93.8	Very high	87.5	Confident	14 Å²	14	60.3 Å²	60.3	12%	0.116	30%	0.302	C	S	.	.	S	Bend	trans	-74.8	-19.5	176.5	0	0	0	0	0	112.8	Q569 Q588 Q614 L659 R662	Q569-A616 WeakPolarHBondContact CG-O 3.23Å; Q569-A616 PolarHBondContact NE2-O 3.44Å; Q588-A616 WeakPolarHBondContact CG-O 3.4Å; Q614-A616 PolarHBondContact O-N 3.35Å; A616-L659 WeakPolarHBondContact CB-O 3.27Å; A616-L659 PolarHBondContact N-O 3.46Å; A616-R662 HydrophobicContact CB-CB 3.94Å; A616-R662 HydrophobicContact CB-CG 4.49Å
617	A	95.1	Very high	88.1	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-136.3	162.2	-176	0	0	0	0	0	111.1	V586 I587 Q588 S615 Y657	V586-A617 HydrophobicContact CG1-CB 3.52Å; I587-A617 CarbonylContact O-C 3.48Å; I587-A617 WeakPolarHBondContact O-CA 3.42Å; I587-A617 WeakPolarHBondContact O-CB 3.35Å; Q588-A617 HydrophobicContact CB-CB 3.99Å; Q588-A617 HydrophobicContact CG-CB 4.32Å; S615-A617 VanDerWaalsContact C-N 3.27Å; S615-A617 PolarHBondContact O-N 3.33Å; S615-A617 PolarHBondContact OG-O 3.3Å; A617-Y657 HydrophobicContact CB-CE1 4.49Å
618	S	96.2	Very high	89.1	Confident	22 Å²	22	55.4 Å²	55.4	15%	0.154	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	146.7	170.4	-54.9	0	0	0	0	110	F567 Q569 V586 I587	F567-S618 CarbonylContact O-C 3.59Å; F567-S618 WeakPolarHBondContact O-CA 3.43Å; Q569-S618 PolarHBondContact N-OG 3.43Å; V586-S618 CarbonylContact C-O 3.54Å; V586-S618 WeakPolarHBondContact CA-O 3.21Å; I587-S618 PolarHBondContact N-O 3.23Å; I587-S618 PolarHBondContact O-N 2.96Å
619	V	96.7	Very high	90.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.9	177.8	-176.1	0	0	0	0	108.8	L565 I566 F567 L584 E585 V586 F602 L659	L565-V619 CarbonylContact C-O 3.47Å; L565-V619 VanDerWaalsContact CA-O 3.27Å; L565-V619 WeakPolarHBondContact CA-O 3.27Å; I566-V619 HydrophobicContact CB-CB 4.4Å; I566-V619 HydrophobicContact CB-CG1 4.45Å; I566-V619 HydrophobicContact CD1-CG1 4.41Å; I566-V619 PolarHBondContact N-O 2.93Å; F567-V619 HydrophobicContact CB-CB 4.43Å; F567-V619 HydrophobicContact CB-CG2 4.25Å; F567-V619 HydrophobicContact CD2-CG2 4.44Å; F567-V619 PolarHBondContact O-N 3.4Å; L584-V619 HydrophobicContact CB-CG1 4.16Å; L584-V619 HydrophobicContact CD2-CG1 3.84Å; E585-V619 CarbonylContact O-C 3.59Å; E585-V619 WeakPolarHBondContact O-CA 3.32Å; V586-V619 HydrophobicContact CG1-CG2 4.42Å; V586-V619 HydrophobicContact CG2-CG2 4.28Å; F602-V619 HydrophobicContact CD2-CG2 4.4Å; F602-V619 HydrophobicContact CE2-CG1 4.19Å; F602-V619 HydrophobicContact CE2-CG2 4.43Å; V619-L659 HydrophobicContact CG2-CD1 4.3Å; V619-L659 HydrophobicContact CG2-CD2 3.55Å
620	R	95.6	Very high	91.5	Very high	94 Å²	94	44.6 Å²	44.6	36%	0.355	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	137.6	-177.6	-168.6	165.5	64.3	-167.2	-2.3	110.9	D564 L565 L584 E585 I587	D564-R620 CarbonylContact O-C 3.56Å; D564-R620 WeakPolarHBondContact O-CA 3.27Å; L565-R620 HydrophobicContact CD2-CB 3.71Å; L565-R620 HydrophobicContact CD2-CG 4.08Å; L584-R620 CarbonylContact C-O 3.57Å; L584-R620 VanDerWaalsContact CA-O 3.23Å; L584-R620 WeakPolarHBondContact CA-O 3.48Å; L584-R620 WeakPolarHBondContact CB-O 3.34Å; E585-R620 HydrophobicContact CG-CB 3.89Å; E585-R620 PolarHBondContact N-O 3.36Å; E585-R620 PolarHBondContact O-N 3.15Å; E585-R620 IonicContact OE1-CZ 3.72Å; E585-R620 IonicContact OE1-NE 3.61Å; E585-R620 PolarHBondContact OE1-NE 2.91Å; E585-R620 IonicContact OE1-NH2 2.77Å; E585-R620 PolarHBondContact OE1-NH2 2.85Å; E585-R620 IonicContact OE2-NH2 2.76Å; I587-R620 HydrophobicContact CD1-CB 4.11Å; I587-R620 VanDerWaalsContact CD1-CZ 3.49Å
621	A	95.2	Very high	92.5	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	131.4	172	0	0	0	0	0	110.6	N560 A561 G563 D564 I566 C625	N560-A621 HydrophobicContact CB-CB 4.12Å; A561-A621 WeakPolarHBondContact O-CB 3.29Å; G563-A621 PolarHBondContact N-O 3.16Å; D564-A621 PolarHBondContact O-N 3.18Å; I566-A621 HydrophobicContact CD1-CB 4.01Å; A621-C625 HydrophobicContact CB-CB 4.44Å
622	L	94.1	Very high	92.9	Very high	76 Å²	76	39.6 Å²	39.6	40%	0.398	19%	0.194	S	C	.	.	S	Bend	trans	-88.9	-38	173.4	-69.2	171.3	0	0	0	111.5	P562 S583 E585	P562-L622 WeakPolarHBondContact CB-O 3.47Å; S583-L622 WeakPolarHBondContact O-CB 3.34Å; S583-L622 PolarHBondContact O-N 3.04Å; E585-L622 HydrophobicContact CB-CD1 4.24Å; E585-L622 HydrophobicContact CB-CD2 4.47Å; E585-L622 HydrophobicContact CB-CG 4.27Å; E585-L622 VanDerWaalsContact CD-CD2 3.46Å; E585-L622 HydrophobicContact CG-CD2 4.11Å; E585-L622 HydrophobicContact CG-CG 4.22Å; E585-L622 WeakPolarHBondContact OE1-CD2 3.17Å
623	T	91.3	Very high	93.3	Very high	59 Å²	59	41 Å²	41	36%	0.362	20%	0.198	S	C	.	.	S	Bend	trans	-118.5	179.9	177.9	65.8	0	0	0	0	110.1	G582 S583 C625	G582-T623 WeakPolarHBondContact CA-OG1 3.44Å; S583-T623 PolarHBondContact N-OG1 2.93Å; S583-T623 PolarHBondContact O-N 3.13Å; T623-C625 PolarHBondContact O-N 3.02Å; T623-C625 VanDerWaalsContact O-N 3.16Å; T623-C625 PolarHBondContact O-SG 3.43Å
624	Y	88.4	Confident	93.6	Very high	133 Å²	133	46 Å²	46	52%	0.522	22%	0.219	S	C	.	.			trans	-59.2	121.7	159.8	-66.9	-78.8	0	0	0	108.4	N560 A561 P562	N560-Y624 WeakPolarHBondContact O-CA 3.3Å; A561-Y624 HydrophobicContact CB-CD1 4.37Å; A561-Y624 HydrophobicContact CB-CE1 4.01Å; P562-Y624 HydrophobicContact CG-CD2 4.19Å; P562-Y624 HydrophobicContact CG-CE2 4.09Å; P562-Y624 HydrophobicContact CG-CG 4.49Å
625	C	91.2	Very high	93.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.1	-174.7	-62.3	0	0	0	0	110.3	H559 N560 S581 S583 L584 A621 T623 L627	H559-C625 WeakPolarHBondContact CA-O 3.48Å; N560-C625 HydrophobicContact CB-CB 4.47Å; N560-C625 PolarHBondContact N-O 3.4Å; N560-C625 PolarHBondContact O-N 3.36Å; S581-C625 WeakPolarHBondContact O-CA 3.5Å; S583-C625 PolarHBondContact N-SG 3.3Å; S583-C625 VanDerWaalsContact N-SG 3.39Å; S583-C625 PolarHBondContact O-SG 3.38Å; L584-C625 HydrophobicContact CD1-CB 4.42Å; L584-C625 HydrophobicContact CG-CB 4.49Å; A621-C625 HydrophobicContact CB-CB 4.44Å; T623-C625 PolarHBondContact O-N 3.02Å; T623-C625 VanDerWaalsContact O-N 3.16Å; T623-C625 PolarHBondContact O-SG 3.43Å; C625-L627 HydrophobicContact CB-CD2 4.07Å
626	D	91.2	Very high	93.6	Very high	56 Å²	56	40.7 Å²	40.7	30%	0.299	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	111.3	175.2	-63.9	-14.7	0	0	0	108.4	H559 V580 S581	H559-D626 IonicContact CD2-OD1 3.56Å; H559-D626 PolarHBondContact CD2-OD1 3.36Å; H559-D626 IonicContact CG-OD1 3.76Å; H559-D626 IonicContact NE2-OD1 3.47Å; V580-D626 PolarHBondContact N-O 2.97Å; S581-D626 PolarHBondContact N-O 3.28Å; S581-D626 PolarHBondContact O-N 3.37Å
627	L	94.2	Very high	93.5	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.8	-179	-93.2	164.3	0	0	0	109.3	V557 Q558 I566 F578 V579 L584 F602 C625	V557-L627 WeakPolarHBondContact CA-O 3.43Å; Q558-L627 HydrophobicContact CB-CB 4.2Å; Q558-L627 PolarHBondContact N-O 3.27Å; Q558-L627 PolarHBondContact O-N 3.33Å; I566-L627 HydrophobicContact CG1-CD1 3.8Å; I566-L627 HydrophobicContact CG2-CD1 4.01Å; F578-L627 WeakPolarHBondContact O-CA 3.27Å; V579-L627 HydrophobicContact CG1-CD2 4.38Å; V579-L627 HydrophobicContact CG2-CD2 4.21Å; L584-L627 HydrophobicContact CD1-CD2 4.03Å; L584-L627 HydrophobicContact CD2-CD1 4.09Å; L584-L627 HydrophobicContact CD2-CD2 4.18Å; F602-L627 HydrophobicContact CE1-CD1 4.35Å; F602-L627 HydrophobicContact CE1-CG 4.37Å; F602-L627 HydrophobicContact CZ-CD1 3.87Å; F602-L627 HydrophobicContact CZ-CG 4.34Å; C625-L627 HydrophobicContact CB-CD2 4.07Å
628	Q	94.9	Very high	93.5	Very high	16 Å²	16	44.8 Å²	44.8	8%	0.075	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	113.3	167.6	-65.6	-175.6	5.6	0	0	106.9	Y530 V533 F555 F578 V580	Y530-Q628 HydrophobicContact CD1-CB 4.48Å; Y530-Q628 HydrophobicContact CD1-CG 4.09Å; Y530-Q628 HydrophobicContact CE1-CG 4.39Å; V533-Q628 HydrophobicContact CG2-CB 3.97Å; V533-Q628 HydrophobicContact CG2-CG 4.34Å; F555-Q628 HydrophobicContact CD1-CB 4.34Å; F578-Q628 WeakPolarHBondContact CD2-O 3.28Å; F578-Q628 PolarHBondContact N-O 3.33Å; F578-Q628 PolarHBondContact O-N 2.65Å; V580-Q628 HydrophobicContact CG2-CB 4.24Å; V580-Q628 HydrophobicContact CG2-CG 3.66Å
629	C	95	Very high	93.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	148.1	-175.6	-57.7	0	0	0	0	110.6	T556 L576 C577	T556-C629 PolarHBondContact N-O 3.29Å; T556-C629 PolarHBondContact O-N 3.19Å; T556-C629 PolarHBondContact OG1-O 3.3Å; L576-C629 CarbonylContact O-C 3.43Å; L576-C629 VanDerWaalsContact O-CA 3.25Å; L576-C629 WeakPolarHBondContact O-CA 3.41Å; C577-C629 HydrophobicContact CB-CB 4.22Å; C577-C629 WeakPolarHBondContact CB-SG 3.47Å; C577-C629 WeakPolarHBondContact SG-CB 3.44Å; C577-C629 CovalentContact SG-SG 2.07Å; C577-C629 PolarHBondContact SG-SG 3.4Å
630	I	95.4	Very high	93.1	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.5	173.8	-174.4	168.1	0	0	0	109.3	L551 F555 Q575 L576 F578 L635	L551-I630 HydrophobicContact CD2-CD1 3.91Å; F555-I630 HydrophobicContact CD1-CB 3.95Å; F555-I630 HydrophobicContact CD2-CB 4.49Å; F555-I630 HydrophobicContact CD2-CD1 4.13Å; F555-I630 HydrophobicContact CE1-CB 3.81Å; F555-I630 HydrophobicContact CE1-CG2 3.96Å; F555-I630 HydrophobicContact CE2-CB 4.34Å; F555-I630 HydrophobicContact CE2-CD1 3.88Å; F555-I630 HydrophobicContact CG-CB 4.29Å; F555-I630 HydrophobicContact CZ-CB 4Å; F555-I630 HydrophobicContact CZ-CD1 4.26Å; F555-I630 HydrophobicContact CZ-CG2 3.98Å; Q575-I630 WeakPolarHBondContact CA-O 3.49Å; L576-I630 HydrophobicContact CB-CG2 4.04Å; L576-I630 HydrophobicContact CD2-CG2 4.49Å; L576-I630 PolarHBondContact N-O 3.21Å; L576-I630 PolarHBondContact O-N 3.06Å; F578-I630 HydrophobicContact CE2-CG2 4.23Å; I630-L635 HydrophobicContact CD1-CB 3.98Å; I630-L635 HydrophobicContact CD1-CD1 4.08Å; I630-L635 HydrophobicContact CD1-CD2 4.46Å; I630-L635 HydrophobicContact CD1-CG 4.4Å; I630-L635 HydrophobicContact CG1-CB 4.13Å; I630-L635 HydrophobicContact CG2-CD2 3.72Å
631	K	94.1	Very high	93.1	Very high	110 Å²	110	54.4 Å²	54.4	48%	0.478	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	139.7	178.1	-66.1	-163.4	174.7	-160	0	111.2	D633 K634 L635	K631-D633 PolarHBondContact O-N 3.47Å; K631-K634 PolarHBondContact O-N 3.29Å; K631-L635 WeakPolarHBondContact O-CB 3.29Å; K631-L635 PolarHBondContact O-N 3.33Å
632	R	91.7	Very high	93.1	Very high	16 Å²	16	56.8 Å²	56.8	6%	0.06	27%	0.266	C	S	.	.	H	α-helix	trans	-53	-51.6	179.4	176.7	-176.6	169.7	102	7.8	111.8	D574 D609 T610 K634 L635 I636	D574-R632 WeakPolarHBondContact O-CB 3.36Å; D574-R632 PolarHBondContact O-N 3.11Å; D609-R632 PolarHBondContact O-NH2 3.47Å; T610-R632 PolarHBondContact O-NH2 3.32Å; R632-K634 VanDerWaalsContact C-N 3.33Å; R632-K634 PolarHBondContact O-N 2.9Å; R632-L635 PolarHBondContact O-N 3.39Å; R632-I636 HydrophobicContact CG-CD1 3.69Å; R632-I636 HydrophobicContact CG-CG1 4.4Å; R632-I636 WeakPolarHBondContact O-CG1 3.38Å; R632-I636 PolarHBondContact O-N 3.29Å
633	D	91.6	Very high	92.9	Very high	109 Å²	109	56.8 Å²	56.8	58%	0.583	27%	0.272	S	S	*	.	H	α-helix	trans	-59.1	-45.8	-175.9	-58.5	-28.2	0	0	0	111.8	K631 I636 D637	K631-D633 PolarHBondContact O-N 3.47Å; D633-I636 PolarHBondContact O-N 2.93Å; D633-D637 VanDerWaalsContact O-CG 3.26Å; D633-D637 PolarHBondContact O-N 3.5Å
634	K	93.4	Very high	92.9	Very high	109 Å²	109	62.5 Å²	62.5	47%	0.474	30%	0.295	S	S	.	.	H	α-helix	trans	-66.6	-40.5	178.8	-67.3	-59.3	-177.3	-169.1	0	112.3	K631 R632 D637 I638	K631-K634 PolarHBondContact O-N 3.29Å; R632-K634 VanDerWaalsContact C-N 3.33Å; R632-K634 PolarHBondContact O-N 2.9Å; K634-D637 PolarHBondContact O-N 3.38Å; K634-I638 WeakPolarHBondContact O-CD1 3.23Å; K634-I638 VanDerWaalsContact O-CG1 3.24Å; K634-I638 WeakPolarHBondContact O-CG1 3.43Å; K634-I638 PolarHBondContact O-N 3.45Å; K634-I638 VanDerWaalsContact O-N 3.08Å
635	L	93.6	Very high	93.2	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-42.4	176.3	-176.9	47.6	0	0	0	110.9	L551 L576 I606 I630 K631 R632 D637 I638 L639 F649	L551-L635 HydrophobicContact CD2-CD1 3.68Å; L576-L635 HydrophobicContact CD2-CD2 3.98Å; I606-L635 HydrophobicContact CD1-CB 4.25Å; I606-L635 HydrophobicContact CD1-CD2 3.12Å; I606-L635 HydrophobicContact CD1-CG 3.57Å; I630-L635 HydrophobicContact CD1-CB 3.98Å; I630-L635 HydrophobicContact CD1-CD1 4.08Å; I630-L635 HydrophobicContact CD1-CD2 4.46Å; I630-L635 HydrophobicContact CD1-CG 4.4Å; I630-L635 HydrophobicContact CG1-CB 4.13Å; I630-L635 HydrophobicContact CG2-CD2 3.72Å; K631-L635 WeakPolarHBondContact O-CB 3.29Å; K631-L635 PolarHBondContact O-N 3.33Å; R632-L635 PolarHBondContact O-N 3.39Å; L635-D637 PolarHBondContact O-N 2.86Å; L635-I638 PolarHBondContact O-N 3.47Å; L635-L639 HydrophobicContact CD1-CD1 3.73Å; L635-L639 HydrophobicContact CD1-CD2 4.38Å; L635-L639 HydrophobicContact CD1-CG 3.87Å; L635-L639 HydrophobicContact CG-CD1 3.76Å; L635-L639 HydrophobicContact CG-CG 4.38Å; L635-L639 WeakPolarHBondContact O-CB 3.45Å; L635-L639 WeakPolarHBondContact O-CD1 3.35Å; L635-L639 WeakPolarHBondContact O-CG 2.9Å; L635-L639 PolarHBondContact O-N 3.36Å; L635-F649 HydrophobicContact CD1-CE1 4.39Å; L635-F649 HydrophobicContact CD2-CE1 4.32Å; L635-F649 HydrophobicContact CD2-CZ 4.42Å
636	I	92.4	Very high	93.3	Very high	36 Å²	36	57.3 Å²	57.3	19%	0.185	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-46.3	175	-69.8	170.3	0	0	0	111.2	I606 R632 D633 I638 L639 K640	I606-I636 HydrophobicContact CG2-CD1 4.01Å; I606-I636 HydrophobicContact CG2-CG1 3.44Å; I606-I636 VanDerWaalsContact CG2-CG1 3.44Å; R632-I636 HydrophobicContact CG-CD1 3.69Å; R632-I636 HydrophobicContact CG-CG1 4.4Å; R632-I636 WeakPolarHBondContact O-CG1 3.38Å; R632-I636 PolarHBondContact O-N 3.29Å; D633-I636 PolarHBondContact O-N 2.93Å; I636-I638 VanDerWaalsContact C-N 3.31Å; I636-I638 PolarHBondContact O-N 2.94Å; I636-L639 PolarHBondContact O-N 3.42Å; I636-K640 HydrophobicContact CG2-CD 4.02Å; I636-K640 VanDerWaalsContact CG2-CE 3.5Å; I636-K640 HydrophobicContact CG2-CG 4.35Å; I636-K640 WeakPolarHBondContact O-CB 3.33Å; I636-K640 WeakPolarHBondContact O-CG 3.32Å; I636-K640 PolarHBondContact O-N 3.04Å
637	D	92.9	Very high	93.2	Very high	85 Å²	85	58.1 Å²	58.1	46%	0.455	28%	0.284	S	S	.	.	H	α-helix	trans	-58.9	-43.3	178.8	-70.7	-18.6	0	0	0	111.8	D633 K634 L635 K640 F641	D633-D637 VanDerWaalsContact O-CG 3.26Å; D633-D637 PolarHBondContact O-N 3.5Å; K634-D637 PolarHBondContact O-N 3.38Å; L635-D637 PolarHBondContact O-N 2.86Å; D637-K640 PolarHBondContact O-N 2.94Å; D637-F641 PolarHBondContact O-N 3.48Å; D637-F641 VanDerWaalsContact O-N 3.17Å
638	I	94.1	Very high	93.1	Very high	16 Å²	16	59.3 Å²	59.3	8%	0.082	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-43.3	178.4	-66.3	166.3	0	0	0	110.9	A550 L551 K634 L635 I636 K640 F641 Y642	A550-I638 HydrophobicContact CB-CG2 4.44Å; A550-I638 WeakPolarHBondContact O-CD1 3.33Å; L551-I638 HydrophobicContact CD2-CB 4.48Å; L551-I638 HydrophobicContact CD2-CD1 4.02Å; L551-I638 HydrophobicContact CD2-CG2 3.91Å; L551-I638 HydrophobicContact CG-CG2 4.07Å; K634-I638 WeakPolarHBondContact O-CD1 3.23Å; K634-I638 VanDerWaalsContact O-CG1 3.24Å; K634-I638 WeakPolarHBondContact O-CG1 3.43Å; K634-I638 PolarHBondContact O-N 3.45Å; K634-I638 VanDerWaalsContact O-N 3.08Å; L635-I638 PolarHBondContact O-N 3.47Å; I636-I638 VanDerWaalsContact C-N 3.31Å; I636-I638 PolarHBondContact O-N 2.94Å; I638-K640 VanDerWaalsContact C-N 3.33Å; I638-K640 PolarHBondContact O-N 2.78Å; I638-F641 PolarHBondContact O-N 3.38Å; I638-Y642 HydrophobicContact CG2-CD2 3.83Å; I638-Y642 HydrophobicContact CG2-CE2 4.24Å; I638-Y642 WeakPolarHBondContact O-CD2 3.32Å; I638-Y642 PolarHBondContact O-N 3.13Å
639	L	93.1	Very high	93	Very high	8 Å²	8	58.6 Å²	58.6	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-67.2	-34.2	179.6	-67.9	167.5	0	0	0	111.9	F607 L635 I636 Y642 S643 F645 A646 F649	F607-L639 HydrophobicContact CE1-CD1 4.27Å; F607-L639 HydrophobicContact CE2-CD1 4.22Å; F607-L639 HydrophobicContact CZ-CD1 3.63Å; F607-L639 HydrophobicContact CZ-CD2 4.22Å; F607-L639 HydrophobicContact CZ-CG 4.35Å; L635-L639 HydrophobicContact CD1-CD1 3.73Å; L635-L639 HydrophobicContact CD1-CD2 4.38Å; L635-L639 HydrophobicContact CD1-CG 3.87Å; L635-L639 HydrophobicContact CG-CD1 3.76Å; L635-L639 HydrophobicContact CG-CG 4.38Å; L635-L639 WeakPolarHBondContact O-CB 3.45Å; L635-L639 WeakPolarHBondContact O-CD1 3.35Å; L635-L639 WeakPolarHBondContact O-CG 2.9Å; L635-L639 PolarHBondContact O-N 3.36Å; I636-L639 PolarHBondContact O-N 3.42Å; L639-Y642 CarbonylContact O-C 3.59Å; L639-Y642 VanDerWaalsContact O-C 3.31Å; L639-S643 PolarHBondContact O-N 2.83Å; L639-F645 HydrophobicContact CD2-CD1 4.02Å; L639-F645 HydrophobicContact CD2-CE1 4.08Å; L639-A646 HydrophobicContact CB-CB 3.92Å; L639-A646 HydrophobicContact CD2-CB 3.95Å; L639-A646 WeakPolarHBondContact O-CB 3.49Å; L639-F649 HydrophobicContact CD1-CD1 4.06Å; L639-F649 HydrophobicContact CD1-CE1 4.21Å; L639-F649 HydrophobicContact CD2-CB 4.21Å; L639-F649 HydrophobicContact CD2-CD1 3.75Å; L639-F649 HydrophobicContact CD2-CE1 4.43Å; L639-F649 HydrophobicContact CD2-CG 4.12Å
640	K	92.7	Very high	92.7	Very high	152 Å²	152	61 Å²	61	66%	0.661	31%	0.306	S	S	*	.	H	α-helix	trans	-62.6	-41.8	171.5	-76.6	173.6	179.2	172	0	111.8	I636 D637 I638	I636-K640 HydrophobicContact CG2-CD 4.02Å; I636-K640 VanDerWaalsContact CG2-CE 3.5Å; I636-K640 HydrophobicContact CG2-CG 4.35Å; I636-K640 WeakPolarHBondContact O-CB 3.33Å; I636-K640 WeakPolarHBondContact O-CG 3.32Å; I636-K640 PolarHBondContact O-N 3.04Å; D637-K640 PolarHBondContact O-N 2.94Å; I638-K640 VanDerWaalsContact C-N 3.33Å; I638-K640 PolarHBondContact O-N 2.78Å
641	F	94.1	Very high	92.4	Very high	157 Å²	157	70.7 Å²	70.7	69%	0.689	34%	0.342	S	S	*	.	H	α-helix	trans	-69.5	-43	178.2	-172.3	-91.9	0	0	0	112.1	D637 I638 S643	D637-F641 PolarHBondContact O-N 3.48Å; D637-F641 VanDerWaalsContact O-N 3.17Å; I638-F641 PolarHBondContact O-N 3.38Å; F641-S643 PolarHBondContact O-N 2.93Å
642	Y	94.8	Very high	92.3	Very high	52 Å²	52	67.6 Å²	67.6	20%	0.204	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	63	178.2	-62.4	-76.9	0	0	0	111.7	S546 C547 A550 I638 L639 Q644 F645 A646	S546-Y642 WeakPolarHBondContact CB-OH 3.29Å; S546-Y642 PolarHBondContact O-OH 3.43Å; C547-Y642 HydrophobicContact CB-CD1 4.05Å; C547-Y642 HydrophobicContact CB-CD2 3.99Å; C547-Y642 HydrophobicContact CB-CE1 4.1Å; C547-Y642 HydrophobicContact CB-CE2 4.03Å; C547-Y642 HydrophobicContact CB-CG 4Å; A550-Y642 HydrophobicContact CB-CE2 4.08Å; I638-Y642 HydrophobicContact CG2-CD2 3.83Å; I638-Y642 HydrophobicContact CG2-CE2 4.24Å; I638-Y642 WeakPolarHBondContact O-CD2 3.32Å; I638-Y642 PolarHBondContact O-N 3.13Å; L639-Y642 CarbonylContact O-C 3.59Å; L639-Y642 VanDerWaalsContact O-C 3.31Å; Y642-Q644 VanDerWaalsContact C-N 3.3Å; Y642-Q644 PolarHBondContact O-N 2.87Å; Y642-F645 WeakPolarHBondContact O-CB 3.43Å; Y642-F645 PolarHBondContact O-N 3.46Å; Y642-A646 PolarHBondContact O-N 3.32Å
643	S	91.6	Very high	92.3	Very high	76 Å²	76	68 Å²	68	53%	0.531	34%	0.336	S	S	.	.	H	α-helix	trans	-55.9	-37.8	-173.6	60.9	0	0	0	0	114.5	L639 F641 A646 V647	L639-S643 PolarHBondContact O-N 2.83Å; F641-S643 PolarHBondContact O-N 2.93Å; S643-A646 WeakPolarHBondContact O-CB 3.41Å; S643-A646 PolarHBondContact O-N 3.14Å; S643-V647 PolarHBondContact O-N 3.22Å
644	Q	91.4	Very high	92.2	Very high	178 Å²	178	68.2 Å²	68.2	83%	0.832	34%	0.34	S	S	*	.	H	α-helix	trans	-63.2	-43.6	176.1	-67.3	-179.3	-8.8	0	0	112	Y642 A646	Y642-Q644 VanDerWaalsContact C-N 3.3Å; Y642-Q644 PolarHBondContact O-N 2.87Å; Q644-A646 VanDerWaalsContact C-N 3.33Å
645	F	93.7	Very high	92.2	Very high	14 Å²	14	64.6 Å²	64.6	6%	0.061	33%	0.326	C	S	.	.	H	α-helix	trans	-67.4	-36.5	175.6	174.2	-110.8	0	0	0	111.1	A539 F540 A543 C547 L551 L639 Y642 V647 S648 F649	A539-F645 WeakPolarHBondContact O-CE2 3.34Å; F540-F645 HydrophobicContact CD1-CZ 4.17Å; A543-F645 HydrophobicContact CB-CD2 3.92Å; A543-F645 HydrophobicContact CB-CE2 3.51Å; A543-F645 HydrophobicContact CB-CZ 3.88Å; C547-F645 WeakPolarHBondContact SG-CD1 3.23Å; L551-F645 HydrophobicContact CD1-CE1 4.08Å; L551-F645 HydrophobicContact CD1-CZ 4.44Å; L639-F645 HydrophobicContact CD2-CD1 4.02Å; L639-F645 HydrophobicContact CD2-CE1 4.08Å; Y642-F645 WeakPolarHBondContact O-CB 3.43Å; Y642-F645 PolarHBondContact O-N 3.46Å; F645-V647 VanDerWaalsContact C-N 3.31Å; F645-V647 PolarHBondContact O-N 3.25Å; F645-S648 WeakPolarHBondContact O-CB 3.29Å; F645-S648 PolarHBondContact O-N 3.31Å; F645-S648 VanDerWaalsContact O-N 3.1Å; F645-F649 HydrophobicContact CD1-CB 4.38Å; F645-F649 HydrophobicContact CE1-CB 3.98Å; F645-F649 AromaticContact CE1-CD2 4Å; F645-F649 HydrophobicContact CE1-CD2 4Å; F645-F649 HydrophobicContact CE1-CG 4.09Å; F645-F649 HydrophobicContact CE2-CB 4.32Å; F645-F649 HydrophobicContact CZ-CB 3.95Å; F645-F649 AromaticContact CZ-CD2 3.64Å; F645-F649 HydrophobicContact CZ-CD2 3.64Å; F645-F649 HydrophobicContact CZ-CG 4.08Å; F645-F649 WeakPolarHBondContact O-CB 3.36Å; F645-F649 PolarHBondContact O-N 3.43Å
646	A	92.3	Very high	92.2	Very high	10 Å²	10	67.2 Å²	67.2	8%	0.083	35%	0.345	C	S	.	.	H	α-helix	trans	-58.5	-40.2	-179.6	0	0	0	0	0	113.3	F607 L639 Y642 S643 Q644 F649 S650	F607-A646 HydrophobicContact CE1-CB 4.06Å; F607-A646 HydrophobicContact CZ-CB 4.11Å; F607-A646 WeakPolarHBondContact CZ-O 3.47Å; L639-A646 HydrophobicContact CB-CB 3.92Å; L639-A646 HydrophobicContact CD2-CB 3.95Å; L639-A646 WeakPolarHBondContact O-CB 3.49Å; Y642-A646 PolarHBondContact O-N 3.32Å; S643-A646 WeakPolarHBondContact O-CB 3.41Å; S643-A646 PolarHBondContact O-N 3.14Å; Q644-A646 VanDerWaalsContact C-N 3.33Å; A646-F649 PolarHBondContact O-N 2.97Å; A646-S650 WeakPolarHBondContact O-CB 3.48Å; A646-S650 PolarHBondContact O-N 2.85Å; A646-S650 PolarHBondContact O-OG 3.48Å
647	V	90.5	Very high	92.3	Very high	74 Å²	74	67 Å²	67	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-46.4	175.2	178.3	0	0	0	0	110.7	S643 F645 S650 R651	S643-V647 PolarHBondContact O-N 3.22Å; F645-V647 VanDerWaalsContact C-N 3.31Å; F645-V647 PolarHBondContact O-N 3.25Å; V647-S650 PolarHBondContact O-N 2.84Å; V647-S650 PolarHBondContact O-OG 2.94Å; V647-R651 WeakPolarHBondContact O-CG 3.46Å; V647-R651 PolarHBondContact O-N 3.46Å
648	S	91.5	Very high	92.3	Very high	24 Å²	24	64.6 Å²	64.6	17%	0.168	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-52.8	176.6	-176.3	0	0	0	0	111.3	L542 F645 S650 R651 T652	L542-S648 WeakPolarHBondContact CD1-OG 3.34Å; F645-S648 WeakPolarHBondContact O-CB 3.29Å; F645-S648 PolarHBondContact O-N 3.31Å; F645-S648 VanDerWaalsContact O-N 3.1Å; S648-S650 VanDerWaalsContact C-N 3.25Å; S648-S650 PolarHBondContact O-N 3.22Å; S648-R651 PolarHBondContact O-N 2.93Å; S648-T652 PolarHBondContact O-N 3.47Å; S648-T652 PolarHBondContact O-OG1 3.32Å
649	F	92.6	Very high	92.3	Very high	1 Å²	1	63.8 Å²	63.8	0%	0.004	33%	0.325	C	S	.	.	H	α-helix	trans	-54.2	-42.5	-180	-173.6	-107.7	0	0	0	111.3	A539 F540 F607 L635 L639 F645 A646 R651 T652 L653	A539-F649 HydrophobicContact CB-CD2 3.87Å; A539-F649 HydrophobicContact CB-CE2 3.86Å; F540-F649 HydrophobicContact CD1-CE2 4.28Å; F540-F649 HydrophobicContact CE1-CD2 4.35Å; F540-F649 AromaticContact CE1-CE2 3.63Å; F540-F649 HydrophobicContact CE1-CE2 3.63Å; F540-F649 HydrophobicContact CE1-CZ 4.43Å; F540-F649 AromaticContact CZ-CE2 3.83Å; F540-F649 HydrophobicContact CZ-CE2 3.83Å; F540-F649 HydrophobicContact CZ-CZ 4.45Å; F607-F649 AromaticContact CE2-CD1 3.84Å; F607-F649 HydrophobicContact CE2-CD1 3.84Å; F607-F649 HydrophobicContact CZ-CD1 4.16Å; L635-F649 HydrophobicContact CD1-CE1 4.39Å; L635-F649 HydrophobicContact CD2-CE1 4.32Å; L635-F649 HydrophobicContact CD2-CZ 4.42Å; L639-F649 HydrophobicContact CD1-CD1 4.06Å; L639-F649 HydrophobicContact CD1-CE1 4.21Å; L639-F649 HydrophobicContact CD2-CB 4.21Å; L639-F649 HydrophobicContact CD2-CD1 3.75Å; L639-F649 HydrophobicContact CD2-CE1 4.43Å; L639-F649 HydrophobicContact CD2-CG 4.12Å; F645-F649 HydrophobicContact CD1-CB 4.38Å; F645-F649 HydrophobicContact CE1-CB 3.98Å; F645-F649 AromaticContact CE1-CD2 4Å; F645-F649 HydrophobicContact CE1-CD2 4Å; F645-F649 HydrophobicContact CE1-CG 4.09Å; F645-F649 HydrophobicContact CE2-CB 4.32Å; F645-F649 HydrophobicContact CZ-CB 3.95Å; F645-F649 AromaticContact CZ-CD2 3.64Å; F645-F649 HydrophobicContact CZ-CD2 3.64Å; F645-F649 HydrophobicContact CZ-CG 4.08Å; F645-F649 WeakPolarHBondContact O-CB 3.36Å; F645-F649 PolarHBondContact O-N 3.43Å; A646-F649 PolarHBondContact O-N 2.97Å; F649-R651 VanDerWaalsContact C-N 3.3Å; F649-R651 PolarHBondContact O-N 3.27Å; F649-T652 PolarHBondContact O-N 3.48Å; F649-T652 PolarHBondContact O-OG1 2.94Å; F649-L653 HydrophobicContact CE1-CD2 3.76Å; F649-L653 HydrophobicContact CE2-CD1 4.08Å; F649-L653 HydrophobicContact CZ-CB 4.48Å; F649-L653 HydrophobicContact CZ-CD1 3.89Å; F649-L653 HydrophobicContact CZ-CD2 3.79Å; F649-L653 HydrophobicContact CZ-CG 4.28Å; F649-L653 WeakPolarHBondContact O-CB 3.41Å; F649-L653 PolarHBondContact O-N 3.45Å
650	S	89.6	Confident	92.2	Very high	52 Å²	52	67.7 Å²	67.7	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-30.5	177.6	78.1	0	0	0	0	114.5	A646 V647 S648	A646-S650 WeakPolarHBondContact O-CB 3.48Å; A646-S650 PolarHBondContact O-N 2.85Å; A646-S650 PolarHBondContact O-OG 3.48Å; V647-S650 PolarHBondContact O-N 2.84Å; V647-S650 PolarHBondContact O-OG 2.94Å; S648-S650 VanDerWaalsContact C-N 3.25Å; S648-S650 PolarHBondContact O-N 3.22Å
651	R	89.4	Confident	92.1	Very high	203 Å²	203	65.2 Å²	65.2	77%	0.766	33%	0.333	S	S	*	.	H	α-helix	trans	-84.6	-34.4	-179.7	-69.2	175.6	-179.5	179.9	0.2	112.2	V647 S648 F649	V647-R651 WeakPolarHBondContact O-CG 3.46Å; V647-R651 PolarHBondContact O-N 3.46Å; S648-R651 PolarHBondContact O-N 2.93Å; F649-R651 VanDerWaalsContact C-N 3.3Å; F649-R651 PolarHBondContact O-N 3.27Å
652	T	91.3	Very high	92	Very high	45 Å²	45	64.3 Å²	64.3	28%	0.276	33%	0.325	S	S	.	.	H	α-helix	trans	-94.2	-22.8	-173.7	50.3	0	0	0	0	113.8	A539 S648 F649 V654	A539-T652 WeakPolarHBondContact CA-OG1 3.23Å; S648-T652 PolarHBondContact O-N 3.47Å; S648-T652 PolarHBondContact O-OG1 3.32Å; F649-T652 PolarHBondContact O-N 3.48Å; F649-T652 PolarHBondContact O-OG1 2.94Å; T652-V654 PolarHBondContact O-N 3.27Å; T652-V654 VanDerWaalsContact O-N 3.17Å
653	L	91.1	Very high	91.8	Very high	26 Å²	26	66 Å²	66	14%	0.136	34%	0.337	C	S	.	.			trans	-77.1	101	178.9	-173.8	79.5	0	0	0	109.9	A539 L576 F578 I601 F649	A539-L653 HydrophobicContact CB-CB 4.28Å; A539-L653 HydrophobicContact CB-CD1 4.07Å; L576-L653 HydrophobicContact CD2-CD2 4.12Å; F578-L653 HydrophobicContact CE1-CD1 4.38Å; F578-L653 HydrophobicContact CZ-CD1 4.49Å; I601-L653 HydrophobicContact CD1-CD1 3.81Å; F649-L653 HydrophobicContact CE1-CD2 3.76Å; F649-L653 HydrophobicContact CE2-CD1 4.08Å; F649-L653 HydrophobicContact CZ-CB 4.48Å; F649-L653 HydrophobicContact CZ-CD1 3.89Å; F649-L653 HydrophobicContact CZ-CD2 3.79Å; F649-L653 HydrophobicContact CZ-CG 4.28Å; F649-L653 WeakPolarHBondContact O-CB 3.41Å; F649-L653 PolarHBondContact O-N 3.45Å
654	V	90.4	Very high	91.8	Very high	112 Å²	112	70.2 Å²	70.2	68%	0.679	35%	0.352	S	S	*	.			trans	-100	121.6	170.6	-177.3	0	0	0	0	108.2	T652	T652-V654 PolarHBondContact O-N 3.27Å; T652-V654 VanDerWaalsContact O-N 3.17Å
655	L	92.6	Very high	91.9	Very high	34 Å²	34	65.1 Å²	65.1	18%	0.178	33%	0.327	C	S	.	.			trans	-79.6	128.5	173.2	-64.5	172	0	0	0	109	L576 I601 P605 Y657	L576-L655 HydrophobicContact CD1-CD2 3.5Å; L576-L655 VanDerWaalsContact CD1-CD2 3.5Å; I601-L655 HydrophobicContact CB-CD2 4.3Å; I601-L655 HydrophobicContact CG2-CD2 3.68Å; P605-L655 HydrophobicContact CB-CD1 4.13Å; P605-L655 HydrophobicContact CG-CD1 4.4Å; L655-Y657 VanDerWaalsContact C-N 3.3Å
656	S	93.7	Very high	91.7	Very high	57 Å²	57	73.6 Å²	73.6	40%	0.399	36%	0.359	S	S	.	.	S	Bend	trans	-64.4	-37.5	172	-52.3	0	0	0	0	110.9	D600 I601	D600-S656 WeakPolarHBondContact CA-OG 3.4Å; D600-S656 WeakPolarHBondContact CB-OG 3.43Å; D600-S656 WeakPolarHBondContact OD1-CB 3.5Å; D600-S656 PolarHBondContact OD1-OG 2.89Å; I601-S656 PolarHBondContact N-OG 3.01Å; I601-S656 WeakPolarHBondContact O-CB 3.4Å; I601-S656 PolarHBondContact O-N 2.86Å
657	Y	94.6	Very high	91.7	Very high	30 Å²	30	75.5 Å²	75.5	12%	0.118	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	127.9	172.8	-165.1	-90.1	0	0	0	112	V586 V593 A594 I601 F602 G603 A617 L655 L659	V586-Y657 HydrophobicContact CG1-CD1 4.01Å; V586-Y657 HydrophobicContact CG1-CE1 3.61Å; V586-Y657 HydrophobicContact CG1-CE2 4.41Å; V586-Y657 HydrophobicContact CG2-CD1 4.35Å; V586-Y657 HydrophobicContact CG2-CG 4.36Å; V593-Y657 HydrophobicContact CG2-CE2 3.96Å; V593-Y657 WeakPolarHBondContact CG2-OH 3.5Å; A594-Y657 HydrophobicContact CB-CD2 3.6Å; A594-Y657 HydrophobicContact CB-CE2 3.97Å; A594-Y657 HydrophobicContact CB-CG 4.39Å; I601-Y657 PolarHBondContact O-N 2.99Å; F602-Y657 WeakPolarHBondContact CA-O 3.34Å; G603-Y657 PolarHBondContact N-O 3.41Å; A617-Y657 HydrophobicContact CB-CE1 4.49Å; L655-Y657 VanDerWaalsContact C-N 3.3Å; Y657-L659 HydrophobicContact CD1-CD2 3.83Å; Y657-L659 HydrophobicContact CD1-CG 4.42Å; Y657-L659 HydrophobicContact CE1-CD2 3.98Å
658	N	93.9	Very high	91.7	Very high	35 Å²	35	77.6 Å²	77.6	19%	0.187	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	107.8	175.9	-178.4	0.5	0	0	0	110	G603 R660 N661	G603-N658 PolarHBondContact O-OD1 2.9Å; N658-R660 PolarHBondContact O-N 3.49Å; N658-R660 WeakPolarHBondContact OD1-CB 3.45Å; N658-R660 PolarHBondContact OD1-N 3.42Å; N658-R660 VanDerWaalsContact OD1-N 3.08Å; N658-N661 PolarHBondContact ND2-ND2 3.43Å; N658-N661 PolarHBondContact ND2-OD1 3.04Å; N658-N661 PolarHBondContact O-N 2.94Å
659	L	93.1	Very high	91.6	Very high	0 Å²	0	79.5 Å²	79.5	0%	0	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.2	-177.2	-70.6	177.9	0	0	0	113.5	F567 I573 V586 F602 G603 A616 V619 Y657	F567-L659 HydrophobicContact CB-CD1 4.4Å; F567-L659 HydrophobicContact CD2-CD1 3.63Å; F567-L659 HydrophobicContact CE2-CD1 3.92Å; F567-L659 HydrophobicContact CG-CD1 3.95Å; F567-L659 HydrophobicContact CZ-CD1 4.47Å; I573-L659 HydrophobicContact CD1-CB 3.57Å; I573-L659 HydrophobicContact CG1-CB 4.12Å; V586-L659 HydrophobicContact CG1-CD2 4.46Å; F602-L659 HydrophobicContact CD2-CD1 4.07Å; G603-L659 PolarHBondContact O-N 3Å; A616-L659 WeakPolarHBondContact CB-O 3.27Å; A616-L659 PolarHBondContact N-O 3.46Å; V619-L659 HydrophobicContact CG2-CD1 4.3Å; V619-L659 HydrophobicContact CG2-CD2 3.55Å; Y657-L659 HydrophobicContact CD1-CD2 3.83Å; Y657-L659 HydrophobicContact CD1-CG 4.42Å; Y657-L659 HydrophobicContact CE1-CD2 3.98Å
660	R	91	Very high	91.5	Very high	89 Å²	89	82.5 Å²	82.5	34%	0.336	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-29.7	178.8	-174.4	175.6	-177.5	117.1	0.5	112.8	I573 Q604 D609 D611 N658	I573-R660 HydrophobicContact CD1-CB 4.22Å; Q604-R660 HydrophobicContact CG-CB 4.31Å; D609-R660 WeakPolarHBondContact OD2-CD 3.4Å; D609-R660 IonicContact OD2-CZ 2.66Å; D609-R660 IonicContact OD2-NE 2.65Å; D609-R660 PolarHBondContact OD2-NE 2.96Å; D609-R660 IonicContact OD2-NH1 3.05Å; D611-R660 PolarHBondContact O-NH1 2.76Å; N658-R660 PolarHBondContact O-N 3.49Å; N658-R660 WeakPolarHBondContact OD1-CB 3.45Å; N658-R660 PolarHBondContact OD1-N 3.42Å; N658-R660 VanDerWaalsContact OD1-N 3.08Å
661	N	90.7	Very high	91.6	Very high	100 Å²	100	82.5 Å²	82.5	54%	0.535	40%	0.4	S	S	.	.	S	Bend	trans	-84.6	120.7	-174.1	-71.9	0.9	0	0	0	109.9	N658	N658-N661 PolarHBondContact ND2-ND2 3.43Å; N658-N661 PolarHBondContact ND2-OD1 3.04Å; N658-N661 PolarHBondContact O-N 2.94Å
662	R	91.6	Very high	91.7	Very high	138 Å²	138	80 Å²	80	52%	0.521	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-79.2	124.3	172.8	-172.9	173	173	76.7	-4.6	110.1	Q588 D589 A616	Q588-R662 VanDerWaalsContact NE2-CG 3.32Å; D589-R662 IonicContact OD1-CZ 3.87Å; D589-R662 IonicContact OD1-NH1 3.12Å; D589-R662 PolarHBondContact OD1-NH1 2.89Å; D589-R662 IonicContact OD1-NH2 3.41Å; D589-R662 PolarHBondContact OD1-NH2 3.22Å; D589-R662 IonicContact OD2-CZ 2.73Å; D589-R662 VanDerWaalsContact OD2-CZ 3.25Å; D589-R662 IonicContact OD2-NH1 2.65Å; D589-R662 PolarHBondContact OD2-NH1 3.29Å; D589-R662 IonicContact OD2-NH2 3.09Å; D589-R662 PolarHBondContact OD2-NH2 2.95Å; A616-R662 HydrophobicContact CB-CB 3.94Å; A616-R662 HydrophobicContact CB-CG 4.49Å
663	L	91.9	Very high	91.6	Very high	88 Å²	88	84.2 Å²	84.2	46%	0.461	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-74.8	128.4	173.7	-170	70.1	0	0	0	109.1	Q588 V593 F665	Q588-L663 PolarHBondContact NE2-O 2.99Å; V593-L663 HydrophobicContact CB-CD2 4.13Å; V593-L663 HydrophobicContact CG1-CD2 3.83Å; L663-F665 HydrophobicContact CB-CD1 4.15Å; L663-F665 HydrophobicContact CB-CE1 4.49Å; L663-F665 HydrophobicContact CD2-CD1 3.92Å; L663-F665 HydrophobicContact CD2-CE1 4.47Å; L663-F665 HydrophobicContact CG-CD1 3.98Å; L663-F665 WeakPolarHBondContact O-CD1 3.19Å
664	I	91.6	Very high	91.5	Very high	165 Å²	165	87.8 Å²	87.8	85%	0.846	42%	0.417	S	S	*	.			trans	-95.2	112.5	175.8	-57.3	172.5	0	0	0	107.8
665	F	92.5	Very high	91.4	Very high	70 Å²	70	87.7 Å²	87.7	31%	0.307	41%	0.409	S	S	.	.			trans	-143.4	168.4	177.4	63.1	-88	0	0	0	110.5	Q588 D589 E591 V593 L663	Q588-F665 HydrophobicContact CB-CE1 4.42Å; D589-F665 HydrophobicContact CB-CZ 4.2Å; E591-F665 HydrophobicContact CB-CE2 4.01Å; E591-F665 HydrophobicContact CB-CZ 4.04Å; E591-F665 HydrophobicContact CG-CE2 3.76Å; E591-F665 HydrophobicContact CG-CZ 4.2Å; V593-F665 HydrophobicContact CG1-CE1 4.09Å; L663-F665 HydrophobicContact CB-CD1 4.15Å; L663-F665 HydrophobicContact CB-CE1 4.49Å; L663-F665 HydrophobicContact CD2-CD1 3.92Å; L663-F665 HydrophobicContact CD2-CE1 4.47Å; L663-F665 HydrophobicContact CG-CD1 3.98Å; L663-F665 WeakPolarHBondContact O-CD1 3.19Å
666	R	90.2	Very high	91.3	Very high	192 Å²	192	91.5 Å²	91.5	73%	0.725	43%	0.426	S	S	*	.			trans	-125	140.1	173.5	-65.9	-170.4	-174.6	-169.7	2.6	109.8	V671 E674	R666-V671 HydrophobicContact CB-CG2 4.16Å; R666-E674 IonicContact NH1-OE2 2.95Å
667	K	92.1	Very high	90.9	Very high	50 Å²	50	92.8 Å²	92.8	22%	0.217	43%	0.428	C	S	.	.			trans	-74.1	139.9	176.5	-58.9	-168.2	-177.6	-147.8	0	110.4	D589 E591 S669 D670 V671	D589-K667 VanDerWaalsContact O-CE 3.23Å; D589-K667 WeakPolarHBondContact O-CE 3.48Å; D589-K667 PolarHBondContact O-NZ 3.5Å; E591-K667 HydrophobicContact CG-CD 4.32Å; E591-K667 HydrophobicContact CG-CG 4.39Å; E591-K667 WeakPolarHBondContact OE1-CD 3.33Å; E591-K667 VanDerWaalsContact OE1-CE 3.26Å; E591-K667 WeakPolarHBondContact OE1-CE 3.31Å; E591-K667 IonicContact OE1-NZ 2.67Å; E591-K667 PolarHBondContact OE1-NZ 3.41Å; K667-S669 PolarHBondContact O-N 3.4Å; K667-D670 HydrophobicContact CB-CB 4.48Å; K667-D670 PolarHBondContact O-N 3.03Å; K667-D670 VanDerWaalsContact O-N 3.12Å; K667-V671 WeakPolarHBondContact O-CG2 3.27Å; K667-V671 PolarHBondContact O-N 3.43Å; K667-V671 VanDerWaalsContact O-N 3.12Å
668	I	91.1	Very high	90.6	Very high	118 Å²	118	95.1 Å²	95.1	61%	0.605	44%	0.443	S	S	*	.	H	α-helix	trans	-60.5	-36.6	179.6	-62.9	172.8	0	0	0	111	D670 V671 R672	I668-D670 VanDerWaalsContact C-N 3.34Å; I668-D670 PolarHBondContact O-N 2.98Å; I668-V671 PolarHBondContact O-N 3.41Å; I668-R672 HydrophobicContact CG2-CG 4.4Å; I668-R672 WeakPolarHBondContact O-CG 3.45Å; I668-R672 PolarHBondContact O-N 3.5Å
669	S	89.7	Confident	90.1	Very high	64 Å²	64	99.5 Å²	99.5	45%	0.448	46%	0.462	S	S	.	.	H	α-helix	trans	-60.7	-40.4	175.7	48.5	0	0	0	0	112.8	K667 R672 R673	K667-S669 PolarHBondContact O-N 3.4Å; S669-R672 PolarHBondContact O-N 3.47Å; S669-R673 WeakPolarHBondContact O-CB 3.48Å; S669-R673 PolarHBondContact O-N 3.35Å
670	D	89.5	Confident	89.4	Confident	65 Å²	65	104.5 Å²	104.5	35%	0.348	49%	0.488	S	S	.	.	H	α-helix	trans	-70.4	-39.9	178.2	-64.1	-27.9	0	0	0	111.1	K667 I668 R673 E674	K667-D670 HydrophobicContact CB-CB 4.48Å; K667-D670 PolarHBondContact O-N 3.03Å; K667-D670 VanDerWaalsContact O-N 3.12Å; I668-D670 VanDerWaalsContact C-N 3.34Å; I668-D670 PolarHBondContact O-N 2.98Å; D670-R673 PolarHBondContact O-N 3.18Å; D670-R673 IonicContact OD1-CZ 3.51Å; D670-R673 IonicContact OD1-NH1 3.4Å; D670-R673 PolarHBondContact OD1-NH1 3.02Å; D670-E674 WeakPolarHBondContact O-CG 3.45Å; D670-E674 PolarHBondContact O-N 3.3Å
671	V	91.6	Very high	88.6	Confident	51 Å²	51	108.6 Å²	108.6	31%	0.309	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-43.1	173.9	177.7	0	0	0	0	111.3	R666 K667 I668 E674 Q675	R666-V671 HydrophobicContact CB-CG2 4.16Å; K667-V671 WeakPolarHBondContact O-CG2 3.27Å; K667-V671 PolarHBondContact O-N 3.43Å; K667-V671 VanDerWaalsContact O-N 3.12Å; I668-V671 PolarHBondContact O-N 3.41Å; V671-E674 PolarHBondContact O-N 2.99Å; V671-Q675 WeakPolarHBondContact O-CG 3.42Å; V671-Q675 PolarHBondContact O-N 2.93Å
672	R	91.4	Very high	87.7	Confident	152 Å²	152	114.1 Å²	114.1	57%	0.574	52%	0.517	S	S	*	.	H	α-helix	trans	-64.4	-43.3	175.7	-75.8	-178	-171.2	161.5	3.3	112.1	I668 S669 E674 Q675 E676	I668-R672 HydrophobicContact CG2-CG 4.4Å; I668-R672 WeakPolarHBondContact O-CG 3.45Å; I668-R672 PolarHBondContact O-N 3.5Å; S669-R672 PolarHBondContact O-N 3.47Å; R672-E674 VanDerWaalsContact C-N 3.31Å; R672-E674 PolarHBondContact O-N 2.94Å; R672-Q675 WeakPolarHBondContact O-CB 3.35Å; R672-Q675 PolarHBondContact O-N 2.99Å; R672-Q675 VanDerWaalsContact O-N 3.09Å; R672-E676 WeakPolarHBondContact O-CG 3.42Å; R672-E676 PolarHBondContact O-N 3.41Å
673	R	90.3	Very high	86.5	Confident	133 Å²	133	111.7 Å²	111.7	50%	0.502	52%	0.521	S	S	.	.	H	α-helix	trans	-61.5	-39.7	177.1	-168.3	-174.9	-62.7	118.6	0.4	111.8	S669 D670 L677	S669-R673 WeakPolarHBondContact O-CB 3.48Å; S669-R673 PolarHBondContact O-N 3.35Å; D670-R673 PolarHBondContact O-N 3.18Å; D670-R673 IonicContact OD1-CZ 3.51Å; D670-R673 IonicContact OD1-NH1 3.4Å; D670-R673 PolarHBondContact OD1-NH1 3.02Å; R673-L677 HydrophobicContact CG-CD1 4.26Å; R673-L677 WeakPolarHBondContact O-CB 3.39Å; R673-L677 VanDerWaalsContact O-CG 3.26Å; R673-L677 WeakPolarHBondContact O-CG 3.47Å; R673-L677 PolarHBondContact O-N 2.97Å
674	E	88	Confident	84.8	Confident	101 Å²	101	114.4 Å²	114.4	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-63.9	-39.6	173.2	-76.2	-179.7	178.1	0	0	112.1	R666 D670 V671 R672 N678	R666-E674 IonicContact NH1-OE2 2.95Å; D670-E674 WeakPolarHBondContact O-CG 3.45Å; D670-E674 PolarHBondContact O-N 3.3Å; V671-E674 PolarHBondContact O-N 2.99Å; R672-E674 VanDerWaalsContact C-N 3.31Å; R672-E674 PolarHBondContact O-N 2.94Å; E674-N678 WeakPolarHBondContact O-CB 3.31Å; E674-N678 PolarHBondContact O-N 3.41Å; E674-N678 PolarHBondContact O-ND2 3.08Å
675	Q	89.3	Confident	83.2	Confident	109 Å²	109	111.8 Å²	111.8	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-48.2	175.1	-73	172	-17.4	0	0	111.6	V671 R672 L677 N678 E679	V671-Q675 WeakPolarHBondContact O-CG 3.42Å; V671-Q675 PolarHBondContact O-N 2.93Å; R672-Q675 WeakPolarHBondContact O-CB 3.35Å; R672-Q675 PolarHBondContact O-N 2.99Å; R672-Q675 VanDerWaalsContact O-N 3.09Å; Q675-L677 PolarHBondContact O-N 2.9Å; Q675-N678 CarbonylContact O-C 3.55Å; Q675-N678 WeakPolarHBondContact O-CB 3.13Å; Q675-N678 PolarHBondContact O-N 2.99Å; Q675-N678 VanDerWaalsContact O-N 3.12Å; Q675-E679 WeakPolarHBondContact O-CG 3.44Å; Q675-E679 PolarHBondContact O-N 3.45Å
676	E	88.5	Confident	81.5	Confident	115 Å²	115	112.6 Å²	112.6	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-43.4	177.1	-71.8	170.9	-173.4	0	0	112.1	R672 N678 E679 L680	R672-E676 WeakPolarHBondContact O-CG 3.42Å; R672-E676 PolarHBondContact O-N 3.41Å; E676-N678 VanDerWaalsContact C-N 3.29Å; E676-N678 PolarHBondContact O-N 3.47Å; E676-E679 PolarHBondContact O-N 3.22Å; E676-L680 WeakPolarHBondContact O-CG 3.45Å; E676-L680 PolarHBondContact O-N 3.05Å
677	L	87.1	Confident	79.9	Confident	83 Å²	83	109.9 Å²	109.9	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-35.3	175.2	-75.2	168.8	0	0	0	112	R673 Q675 R681	R673-L677 HydrophobicContact CG-CD1 4.26Å; R673-L677 WeakPolarHBondContact O-CB 3.39Å; R673-L677 VanDerWaalsContact O-CG 3.26Å; R673-L677 WeakPolarHBondContact O-CG 3.47Å; R673-L677 PolarHBondContact O-N 2.97Å; Q675-L677 PolarHBondContact O-N 2.9Å; L677-R681 WeakPolarHBondContact O-CB 3.37Å; L677-R681 VanDerWaalsContact O-CG 3.25Å; L677-R681 WeakPolarHBondContact O-CG 3.29Å; L677-R681 PolarHBondContact O-N 3.38Å
678	N	86.5	Confident	78.2	Confident	80 Å²	80	112 Å²	112	43%	0.428	56%	0.557	S	S	.	*	H	α-helix	trans	-71.4	-33.7	174.8	-76	-21.7	0	0	0	112.1	E674 Q675 E676 R681 R682	E674-N678 WeakPolarHBondContact O-CB 3.31Å; E674-N678 PolarHBondContact O-N 3.41Å; E674-N678 PolarHBondContact O-ND2 3.08Å; Q675-N678 CarbonylContact O-C 3.55Å; Q675-N678 WeakPolarHBondContact O-CB 3.13Å; Q675-N678 PolarHBondContact O-N 2.99Å; Q675-N678 VanDerWaalsContact O-N 3.12Å; E676-N678 VanDerWaalsContact C-N 3.29Å; E676-N678 PolarHBondContact O-N 3.47Å; N678-R681 PolarHBondContact OD1-NH1 3.27Å; N678-R682 WeakPolarHBondContact O-CG 3.14Å; N678-R682 PolarHBondContact O-N 2.98Å; N678-R682 VanDerWaalsContact O-N 3.1Å
679	E	84.1	Confident	76.5	Confident	126 Å²	126	111.1 Å²	111.1	59%	0.589	56%	0.561	S	S	*	*	H	α-helix	trans	-68.5	-43.4	172.3	-73	177.3	-177.9	0	0	111.7	Q675 E676 R681 R682 S683	Q675-E679 WeakPolarHBondContact O-CG 3.44Å; Q675-E679 PolarHBondContact O-N 3.45Å; E676-E679 PolarHBondContact O-N 3.22Å; E679-R681 VanDerWaalsContact C-N 3.33Å; E679-R681 PolarHBondContact O-N 3.33Å; E679-R682 CarbonylContact O-C 3.53Å; E679-R682 WeakPolarHBondContact O-CA 3.45Å; E679-R682 WeakPolarHBondContact O-CB 3.5Å; E679-R682 PolarHBondContact O-N 3.46Å; E679-S683 PolarHBondContact O-N 2.94Å; E679-S683 PolarHBondContact O-OG 2.82Å
680	L	79.6	Confident	74.8	Confident	105 Å²	105	111.3 Å²	111.3	55%	0.55	56%	0.557	S	S	.	*	H	α-helix	trans	-61.8	-39.4	174.9	-75.6	167.5	0	0	0	112.5	E676 R682 S683 Q684	E676-L680 WeakPolarHBondContact O-CG 3.45Å; E676-L680 PolarHBondContact O-N 3.05Å; L680-R682 VanDerWaalsContact C-N 3.27Å; L680-R682 PolarHBondContact O-N 3.41Å; L680-S683 WeakPolarHBondContact CA-OG 3.45Å; L680-S683 PolarHBondContact O-N 3.26Å; L680-S683 PolarHBondContact O-OG 3.38Å; L680-Q684 PolarHBondContact O-N 3.42Å
681	R	72.6	Confident	73.3	Confident	175 Å²	175	111.4 Å²	111.4	66%	0.66	57%	0.567	S	S	*	*	H	α-helix	trans	-64.8	-31.4	172.4	-76.5	173.6	-175.7	152.1	-0.8	112.3	L677 N678 E679	L677-R681 WeakPolarHBondContact O-CB 3.37Å; L677-R681 VanDerWaalsContact O-CG 3.25Å; L677-R681 WeakPolarHBondContact O-CG 3.29Å; L677-R681 PolarHBondContact O-N 3.38Å; N678-R681 PolarHBondContact OD1-NH1 3.27Å; E679-R681 VanDerWaalsContact C-N 3.33Å; E679-R681 PolarHBondContact O-N 3.33Å
682	R	72.3	Confident	71.8	Confident	217 Å²	217	113.5 Å²	113.5	82%	0.819	58%	0.581	S	S	*	*	H	α-helix	trans	-75.2	-30	174.2	-76.6	175.1	176.9	-179.1	-0.2	112.7	N678 E679 L680	N678-R682 WeakPolarHBondContact O-CG 3.14Å; N678-R682 PolarHBondContact O-N 2.98Å; N678-R682 VanDerWaalsContact O-N 3.1Å; E679-R682 CarbonylContact O-C 3.53Å; E679-R682 WeakPolarHBondContact O-CA 3.45Å; E679-R682 WeakPolarHBondContact O-CB 3.5Å; E679-R682 PolarHBondContact O-N 3.46Å; L680-R682 VanDerWaalsContact C-N 3.27Å; L680-R682 PolarHBondContact O-N 3.41Å
683	S	66.2	Low	70.2	Confident	86 Å²	86	112.1 Å²	112.1	60%	0.601	59%	0.585	S	S	*	*	H	α-helix	trans	-84	-12.6	-178.5	61.5	0	0	0	0	115.2	E679 L680	E679-S683 PolarHBondContact O-N 2.94Å; E679-S683 PolarHBondContact O-OG 2.82Å; L680-S683 WeakPolarHBondContact CA-OG 3.45Å; L680-S683 PolarHBondContact O-N 3.26Å; L680-S683 PolarHBondContact O-OG 3.38Å
684	Q	57	Low	69	Low	146 Å²	146	108.9 Å²	108.9	68%	0.682	58%	0.576	S	S	*	*	S	Bend	trans	-81.1	131.4	172.2	-76.5	-177.3	-2.8	0	0	110.8	L680	L680-Q684 PolarHBondContact O-N 3.42Å
685	P	57.9	Low	68.2	Low	110 Å²	110	108.5 Å²	108.5	71%	0.714	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-64.6	136.6	179	25.7	-32	0	0	0	110.2
686	P	57.1	Low	67.1	Low	86 Å²	86	106.8 Å²	106.8	56%	0.558	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-68.4	139.1	-172.6	28.1	-35.2	0	0	0	111.4	S688 S689	P686-S688 WeakPolarHBondContact CB-OG 3.15Å; P686-S688 PolarHBondContact O-N 2.87Å; P686-S689 PolarHBondContact O-N 2.94Å
687	I	55.1	Low	65.9	Low	135 Å²	135	108.2 Å²	108.2	69%	0.692	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-56	-6.4	176.1	-63.4	163.5	0	0	0	112.6
688	S	58.4	Low	64.8	Low	95 Å²	95	111.5 Å²	111.5	66%	0.664	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-79.6	-4.9	178.7	57.1	0	0	0	0	115.8	P686	P686-S688 WeakPolarHBondContact CB-OG 3.15Å; P686-S688 PolarHBondContact O-N 2.87Å
689	S	55	Low	64.1	Low	100 Å²	100	112.7 Å²	112.7	70%	0.699	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-85.5	-4.5	175.1	64.4	0	0	0	0	114.3	P686	P686-S689 PolarHBondContact O-N 2.94Å
690	L	53.8	Low	63.4	Low	68 Å²	68	111 Å²	111	36%	0.356	59%	0.585	S	S	.	*	S	Bend	trans	-83.2	130.2	-178.6	-76	77.5	0	0	0	111.1	H694	L690-H694 HydrophobicContact CB-CB 4.25Å; L690-H694 VanDerWaalsContact CD2-CE1 3.45Å; L690-H694 WeakPolarHBondContact CD2-CE1 3.38Å
691	A	57.9	Low	62.8	Low	66 Å²	66	109.2 Å²	109.2	55%	0.545	58%	0.582	S	S	.	*			trans	-53.6	153	-176.1	0	0	0	0	0	113.4	D693 H694	A691-D693 PolarHBondContact O-N 3.25Å; A691-H694 WeakPolarHBondContact O-CB 3.43Å; A691-H694 PolarHBondContact O-N 3.02Å
692	P	58.9	Low	62.6	Low	95 Å²	95	109.6 Å²	109.6	62%	0.617	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-21.7	-170.2	-22.3	31.6	0	0	0	115.4
693	D	58.7	Low	62.6	Low	123 Å²	123	106 Å²	106	66%	0.658	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	4.5	-176.8	-58.3	-41.2	0	0	0	114	A691	A691-D693 PolarHBondContact O-N 3.25Å
694	H	65.4	Low	62.8	Low	66 Å²	66	105.6 Å²	105.6	31%	0.306	57%	0.57	S	S	.	*			trans	-66.9	130.6	-176.8	-164.4	-95.3	0	0	0	112.1	L690 A691 V696 R697 R698	L690-H694 HydrophobicContact CB-CB 4.25Å; L690-H694 VanDerWaalsContact CD2-CE1 3.45Å; L690-H694 WeakPolarHBondContact CD2-CE1 3.38Å; A691-H694 WeakPolarHBondContact O-CB 3.43Å; A691-H694 PolarHBondContact O-N 3.02Å; H694-V696 VanDerWaalsContact CE1-CG2 3.45Å; H694-V696 WeakPolarHBondContact CE1-CG2 3.37Å; H694-V696 WeakPolarHBondContact ND1-CB 3.3Å; H694-V696 PolarHBondContact ND1-N 3.46Å; H694-V696 PolarHBondContact O-N 2.93Å; H694-V696 VanDerWaalsContact O-N 3.09Å; H694-R697 PolarHBondContact O-N 3.11Å; H694-R698 PolarHBondContact O-N 2.94Å
695	P	71.6	Confident	63.2	Low	93 Å²	93	102 Å²	102	60%	0.604	56%	0.561	S	S	*	*	H	α-helix	trans	-56.4	-32.8	-174.7	19.3	-32.3	0	0	0	113.6	R698 L699	P695-R698 PolarHBondContact O-N 3.33Å; P695-L699 PolarHBondContact O-N 2.98Å
696	V	65.5	Low	63.6	Low	72 Å²	72	98.7 Å²	98.7	44%	0.436	54%	0.543	S	S	.	.	H	α-helix	trans	-67.7	-35.7	178.5	-179.7	0	0	0	0	112.2	H694 L699 I700	H694-V696 VanDerWaalsContact CE1-CG2 3.45Å; H694-V696 WeakPolarHBondContact CE1-CG2 3.37Å; H694-V696 WeakPolarHBondContact ND1-CB 3.3Å; H694-V696 PolarHBondContact ND1-N 3.46Å; H694-V696 PolarHBondContact O-N 2.93Å; H694-V696 VanDerWaalsContact O-N 3.09Å; V696-L699 WeakPolarHBondContact O-CB 3.46Å; V696-L699 PolarHBondContact O-N 3.11Å; V696-I700 HydrophobicContact CG1-CD1 3.87Å; V696-I700 VanDerWaalsContact O-CG1 3.29Å; V696-I700 WeakPolarHBondContact O-CG1 3.38Å; V696-I700 PolarHBondContact O-N 3Å
697	R	62.6	Low	64	Low	146 Å²	146	97.4 Å²	97.4	55%	0.551	54%	0.54	S	S	*	.	H	α-helix	trans	-73	-36.3	178.7	-168.2	176.1	-179.9	166.8	-1.8	111.6	H694 L699 S701	H694-R697 PolarHBondContact O-N 3.11Å; R697-L699 VanDerWaalsContact C-N 3.33Å; R697-S701 WeakPolarHBondContact O-CB 3.44Å; R697-S701 PolarHBondContact O-N 3.28Å; R697-S701 PolarHBondContact O-OG 2.94Å
698	R	63.9	Low	64.3	Low	152 Å²	152	95.7 Å²	95.7	57%	0.574	54%	0.536	S	S	*	.	H	α-helix	trans	-65.7	-33.3	170.1	-84.4	-174	176	175.2	1.6	112.7	H694 P695 S701 R702	H694-R698 PolarHBondContact O-N 2.94Å; P695-R698 PolarHBondContact O-N 3.33Å; R698-S701 PolarHBondContact O-OG 3.41Å; R698-R702 WeakPolarHBondContact O-CB 3.46Å; R698-R702 VanDerWaalsContact O-CG 3.27Å; R698-R702 WeakPolarHBondContact O-CG 3.41Å; R698-R702 PolarHBondContact O-N 2.71Å; R698-R702 VanDerWaalsContact O-N 3.16Å
699	L	73	Confident	64.3	Low	105 Å²	105	94.1 Å²	94.1	55%	0.55	53%	0.525	S	S	.	.	H	α-helix	trans	-68	-49.9	175.5	-149.4	98.1	0	0	0	110.5	P695 V696 R697 S701 R702 F703	P695-L699 PolarHBondContact O-N 2.98Å; V696-L699 WeakPolarHBondContact O-CB 3.46Å; V696-L699 PolarHBondContact O-N 3.11Å; R697-L699 VanDerWaalsContact C-N 3.33Å; L699-S701 PolarHBondContact O-N 3.49Å; L699-R702 PolarHBondContact O-N 3.29Å; L699-F703 HydrophobicContact CD2-CD2 4.17Å; L699-F703 HydrophobicContact CD2-CE2 3.89Å; L699-F703 HydrophobicContact CG-CD2 4.11Å; L699-F703 HydrophobicContact CG-CE2 4.03Å; L699-F703 VanDerWaalsContact O-CD2 3.3Å; L699-F703 WeakPolarHBondContact O-CD2 3.34Å; L699-F703 PolarHBondContact O-N 3.13Å
700	I	68.2	Low	64.3	Low	89 Å²	89	94.5 Å²	94.5	46%	0.456	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-39.2	-179.5	-65.1	165.1	0	0	0	111.4	V696 F703 C704	V696-I700 HydrophobicContact CG1-CD1 3.87Å; V696-I700 VanDerWaalsContact O-CG1 3.29Å; V696-I700 WeakPolarHBondContact O-CG1 3.38Å; V696-I700 PolarHBondContact O-N 3Å; I700-F703 PolarHBondContact O-N 2.93Å; I700-C704 WeakPolarHBondContact O-CB 3.34Å; I700-C704 PolarHBondContact O-N 3.36Å; I700-C704 PolarHBondContact O-SG 3.03Å
701	S	67.3	Low	64.2	Low	68 Å²	68	97.9 Å²	97.9	48%	0.476	54%	0.537	S	S	.	.	H	α-helix	trans	-66.7	-40.8	176.5	74.2	0	0	0	0	112.2	R697 R698 L699 C704 S705	R697-S701 WeakPolarHBondContact O-CB 3.44Å; R697-S701 PolarHBondContact O-N 3.28Å; R697-S701 PolarHBondContact O-OG 2.94Å; R698-S701 PolarHBondContact O-OG 3.41Å; L699-S701 PolarHBondContact O-N 3.49Å; S701-C704 PolarHBondContact O-N 3.47Å; S701-S705 PolarHBondContact O-N 2.98Å; S701-S705 PolarHBondContact O-OG 3.35Å; S701-S705 VanDerWaalsContact O-OG 3.04Å
702	R	68.4	Low	63.8	Low	184 Å²	184	98.6 Å²	98.6	69%	0.694	54%	0.538	S	S	*	.	H	α-helix	trans	-63	-41.6	173.6	-78.4	179.4	176.1	179.4	-0.9	112.1	R698 L699 S705 A706	R698-R702 WeakPolarHBondContact O-CB 3.46Å; R698-R702 VanDerWaalsContact O-CG 3.27Å; R698-R702 WeakPolarHBondContact O-CG 3.41Å; R698-R702 PolarHBondContact O-N 2.71Å; R698-R702 VanDerWaalsContact O-N 3.16Å; L699-R702 PolarHBondContact O-N 3.29Å; R702-S705 WeakPolarHBondContact CA-OG 3.44Å; R702-S705 PolarHBondContact O-OG 2.98Å; R702-A706 VanDerWaalsContact O-CB 3.25Å; R702-A706 WeakPolarHBondContact O-CB 3.28Å; R702-A706 PolarHBondContact O-N 3.39Å
703	F	73.3	Confident	63.2	Low	141 Å²	141	103.7 Å²	103.7	62%	0.618	55%	0.545	S	S	*	.	H	α-helix	trans	-66.4	-40	176.1	-91.2	-76.9	0	0	0	112.6	L699 I700 A706 A707	L699-F703 HydrophobicContact CD2-CD2 4.17Å; L699-F703 HydrophobicContact CD2-CE2 3.89Å; L699-F703 HydrophobicContact CG-CD2 4.11Å; L699-F703 HydrophobicContact CG-CE2 4.03Å; L699-F703 VanDerWaalsContact O-CD2 3.3Å; L699-F703 WeakPolarHBondContact O-CD2 3.34Å; L699-F703 PolarHBondContact O-N 3.13Å; I700-F703 PolarHBondContact O-N 2.93Å; F703-A706 PolarHBondContact O-N 3.41Å; F703-A707 VanDerWaalsContact O-CB 3.31Å; F703-A707 WeakPolarHBondContact O-CB 3.18Å; F703-A707 PolarHBondContact O-N 3.37Å
704	C	70.3	Confident	62.6	Low	78 Å²	78	102.3 Å²	102.3	53%	0.527	54%	0.544	S	S	.	.	H	α-helix	trans	-69.2	-38.9	177.3	-68.3	0	0	0	0	112.6	I700 S701 A706 A707 T708	I700-C704 WeakPolarHBondContact O-CB 3.34Å; I700-C704 PolarHBondContact O-N 3.36Å; I700-C704 PolarHBondContact O-SG 3.03Å; S701-C704 PolarHBondContact O-N 3.47Å; C704-A706 VanDerWaalsContact C-N 3.35Å; C704-A707 PolarHBondContact O-N 3.23Å; C704-T708 PolarHBondContact O-N 3.3Å; C704-T708 PolarHBondContact O-OG1 3.06Å
705	S	64	Low	61.5	Low	70 Å²	70	104.1 Å²	104.1	49%	0.49	57%	0.565	S	S	.	*	H	α-helix	trans	-68.9	-32.3	174.2	56.6	0	0	0	0	112.9	S701 R702 T708 S709	S701-S705 PolarHBondContact O-N 2.98Å; S701-S705 PolarHBondContact O-OG 3.35Å; S701-S705 VanDerWaalsContact O-OG 3.04Å; R702-S705 WeakPolarHBondContact CA-OG 3.44Å; R702-S705 PolarHBondContact O-OG 2.98Å; S705-T708 PolarHBondContact O-OG1 2.87Å; S705-S709 PolarHBondContact O-N 3.26Å; S705-S709 PolarHBondContact O-OG 2.82Å
706	A	67.5	Low	59.9	Low	41 Å²	41	103.3 Å²	103.3	34%	0.339	56%	0.561	S	S	.	*	H	α-helix	trans	-75.2	-34.8	175.1	0	0	0	0	0	112.3	R702 F703 C704 S709 N710	R702-A706 VanDerWaalsContact O-CB 3.25Å; R702-A706 WeakPolarHBondContact O-CB 3.28Å; R702-A706 PolarHBondContact O-N 3.39Å; F703-A706 PolarHBondContact O-N 3.41Å; C704-A706 VanDerWaalsContact C-N 3.35Å; A706-S709 PolarHBondContact O-OG 3.4Å; A706-N710 WeakPolarHBondContact O-CB 3.47Å; A706-N710 VanDerWaalsContact O-CG 3.26Å; A706-N710 PolarHBondContact O-N 3.4Å; A706-N710 VanDerWaalsContact O-N 3.16Å; A706-N710 PolarHBondContact O-ND2 2.93Å
707	A	65.9	Low	58.3	Low	58 Å²	58	108.2 Å²	108.2	48%	0.479	58%	0.577	S	S	.	*	H	α-helix	trans	-68.4	-33.7	176.2	0	0	0	0	0	112.4	F703 C704 L711	F703-A707 VanDerWaalsContact O-CB 3.31Å; F703-A707 WeakPolarHBondContact O-CB 3.18Å; F703-A707 PolarHBondContact O-N 3.37Å; C704-A707 PolarHBondContact O-N 3.23Å; A707-L711 PolarHBondContact O-N 3.04Å
708	T	61.5	Low	56.6	Low	99 Å²	99	106.8 Å²	106.8	61%	0.607	59%	0.589	S	S	*	*	H	α-helix	trans	-80.6	-34	178.3	34.1	0	0	0	0	113.3	C704 S705 N710 L711	C704-T708 PolarHBondContact O-N 3.3Å; C704-T708 PolarHBondContact O-OG1 3.06Å; S705-T708 PolarHBondContact O-OG1 2.87Å; T708-N710 VanDerWaalsContact C-N 3.34Å; T708-L711 PolarHBondContact O-N 3Å
709	S	56.7	Low	55.1	Low	63 Å²	63	102.5 Å²	102.5	44%	0.441	58%	0.583	S	S	.	*	H	α-helix	trans	-72.8	-25.2	173.4	66.1	0	0	0	0	113.4	S705 A706 S712	S705-S709 PolarHBondContact O-N 3.26Å; S705-S709 PolarHBondContact O-OG 2.82Å; A706-S709 PolarHBondContact O-OG 3.4Å; S709-S712 PolarHBondContact O-OG 2.87Å
710	N	55.2	Low	53.2	Low	107 Å²	107	104.4 Å²	104.4	57%	0.572	59%	0.594	S	S	*	*	H	α-helix	trans	-81.2	-20	174.4	-75.9	-18	0	0	0	113.8	A706 T708 S714	A706-N710 WeakPolarHBondContact O-CB 3.47Å; A706-N710 VanDerWaalsContact O-CG 3.26Å; A706-N710 PolarHBondContact O-N 3.4Å; A706-N710 VanDerWaalsContact O-N 3.16Å; A706-N710 PolarHBondContact O-ND2 2.93Å; T708-N710 VanDerWaalsContact C-N 3.34Å; N710-S714 PolarHBondContact O-OG 3.37Å
711	L	52.9	Low	51.5	Low	139 Å²	139	108.7 Å²	108.7	73%	0.728	61%	0.612	S	S	*	*	H	α-helix	trans	-81.6	-25.9	178.3	-135.5	73.8	0	0	0	113.1	A707 T708 S714	A707-L711 PolarHBondContact O-N 3.04Å; T708-L711 PolarHBondContact O-N 3Å; L711-S714 PolarHBondContact O-OG 3.17Å
712	S	50	Low	49.8	Very low	82 Å²	82	110.1 Å²	110.1	57%	0.573	62%	0.62	S	S	*	*	H	α-helix	trans	-84	-27.1	174.1	56.8	0	0	0	0	112.9	S709 S715	S709-S712 PolarHBondContact O-OG 2.87Å; S712-S715 PolarHBondContact O-OG 3.01Å; S712-S715 VanDerWaalsContact O-OG 3.06Å
713	R	45.1	Very low	48	Very low	202 Å²	202	112 Å²	112	76%	0.762	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-9.3	-177.7	-136.2	172.9	-168.6	177.9	2	115
714	S	45.4	Very low	46	Very low	93 Å²	93	113.2 Å²	113.2	65%	0.65	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	1.2	178.4	40.1	0	0	0	0	114	N710 L711	N710-S714 PolarHBondContact O-OG 3.37Å; L711-S714 PolarHBondContact O-OG 3.17Å
715	S	43.8	Very low	44.4	Very low	104 Å²	104	115.5 Å²	115.5	73%	0.727	65%	0.651	S	S	*	*	S	Bend	trans	-100.8	4.3	179	65.1	0	0	0	0	114.5	S712	S712-S715 PolarHBondContact O-OG 3.01Å; S712-S715 VanDerWaalsContact O-OG 3.06Å
716	S	37	Very low	42.9	Very low	77 Å²	77	115.5 Å²	115.5	54%	0.538	66%	0.662	S	S	.	*	S	Bend	trans	-142.3	134.5	179.5	59.4	0	0	0	0	110.1
717	F	32.5	Very low	41.4	Very low	174 Å²	174	123.2 Å²	123.2	76%	0.763	69%	0.688	S	S	*	*			trans	91.8	95.7	162.2	-118.9	-113.6	0	0	0	118.2	S719	F717-S719 WeakPolarHBondContact CD1-OG 3.38Å; F717-S719 WeakPolarHBondContact CE1-OG 3.38Å; F717-S719 WeakPolarHBondContact CZ-OG 3.48Å
718	S	26.7	Very low	39.9	Very low	116 Å²	116	126.2 Å²	126.2	81%	0.811	70%	0.701	S	S	*	*				-67.4	121.9	124.8	145.7	0	0	0	0	108.3
719	S	32	Very low	38.6	Very low	63 Å²	63	127 Å²	127	44%	0.441	71%	0.71	S	S	.	*				166.8	137.4	124.9	50.3	0	0	0	0	113.5	F717	F717-S719 WeakPolarHBondContact CD1-OG 3.38Å; F717-S719 WeakPolarHBondContact CE1-OG 3.38Å; F717-S719 WeakPolarHBondContact CZ-OG 3.48Å
720	N	33	Very low	37.5	Very low	145 Å²	145	127.1 Å²	127.1	78%	0.775	72%	0.722	S	S	*	*			trans	98.7	91.2	158.6	-60.2	-9.3	0	0	0	121.4
721	E	32.6	Very low	36.4	Very low	179 Å²	179	132 Å²	132	84%	0.836	74%	0.738	S	S	*	*				61.5	163.5	122.3	-79.1	-154.7	154.1	0	0	122.5
722	P	33.2	Very low	35.3	Very low	98 Å²	98	130.1 Å²	130.1	64%	0.636	74%	0.736	S	S	*	*			cis	-136.6	164.9	2.8	27	-3.3	0	0	0	117.1
723	R	30.5	Very low	34.4	Very low	223 Å²	223	133.3 Å²	133.3	84%	0.842	75%	0.747	S	S	*	*			trans	52.6	136.8	146	-67.9	175.3	178.1	166.6	-1.9	119.5
724	E	30.8	Very low	33.7	Very low	166 Å²	166	131.8 Å²	131.8	78%	0.776	75%	0.754	S	S	*	*			cis	-172.3	153.2	32.1	-128.6	167.1	-147.9	0	0	111.7
725	S	36.4	Very low	33.1	Very low	127 Å²	127	133.3 Å²	133.3	89%	0.888	76%	0.759	S	S	*	*			trans	72.1	131	167.5	79.3	0	0	0	0	119.2
726	G	32.9	Very low	32.4	Very low	70 Å²	70	132.7 Å²	132.7	72%	0.722	76%	0.755	S	S	*	*			cis	177.9	134.5	-6.5	0	0	0	0	0	110.9
727	K	35	Very low	32.1	Very low	203 Å²	203	136.8 Å²	136.8	88%	0.883	77%	0.77	S	S	*	*			trans	62.9	135.3	152.4	-62.4	-175.3	178.9	175.7	0	119.1
728	T	34.1	Very low	32	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	77%	0.769	S	S	*	*			cis	-171.1	141	9	15.1	0	0	0	0	111.2
729	S	34.5	Very low	32.1	Very low	114 Å²	114	132.2 Å²	132.2	80%	0.797	77%	0.765	S	S	*	*			trans	63	124.1	133.2	-168.6	0	0	0	0	119.4
730	G	33.8	Very low	32.2	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	78%	0.784	S	S	*	*			cis	110.1	143.6	35.9	0	0	0	0	0	108.5
731	K	32.6	Very low	32.2	Very low	209 Å²	209	136 Å²	136	91%	0.909	79%	0.786	S	S	*	*			cis	-167.3	155.4	11.7	-107.7	174.8	175.6	177.1	0	108.7
732	S	29.2	Very low	32.5	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	78%	0.777	S	S	*	*			trans	-70.7	161	170.1	50.8	0	0	0	0	114.7
733	N	32.5	Very low	32.5	Very low	150 Å²	150	135 Å²	135	80%	0.802	78%	0.784	S	S	*	*				-177	120.7	123.4	-92	-0.9	0	0	0	111.2
734	D	29.6	Very low	32.8	Very low	170 Å²	170	129.2 Å²	129.2	91%	0.909	78%	0.776	S	S	*	*			trans	-89.3	138.9	163.6	-81.1	-35.5	0	0	0	110
735	T	32.9	Very low	32.8	Very low	124 Å²	124	129.3 Å²	129.3	76%	0.761	78%	0.776	S	S	*	*			trans	-150.5	120.9	165.8	-5.6	0	0	0	0	111.6
736	S	29.5	Very low	32.4	Very low	92 Å²	92	128.6 Å²	128.6	64%	0.643	77%	0.766	S	S	*	*			trans	68.3	125.4	132.2	68.5	0	0	0	0	124.4
737	L	30.4	Very low	32.1	Very low	163 Å²	163	131.1 Å²	131.1	85%	0.853	77%	0.768	S	S	*	*				83.3	119.9	122.9	-75.8	161	0	0	0	123.1
738	S	29.2	Very low	32	Very low	107 Å²	107	127.3 Å²	127.3	75%	0.748	77%	0.767	S	S	*	*				85.7	118.9	130	89.1	0	0	0	0	123.1
739	A	30.6	Very low	31.8	Very low	87 Å²	87	126.7 Å²	126.7	72%	0.719	77%	0.767	S	S	*	*				86.3	130.5	122.4	0	0	0	0	0	123.1
740	T	33.6	Very low	31.8	Very low	136 Å²	136	126.3 Å²	126.3	83%	0.834	76%	0.762	S	S	*	*			trans	84.7	100.8	141.8	28	0	0	0	0	122.6
741	N	32.1	Very low	31.4	Very low	152 Å²	152	131.8 Å²	131.8	81%	0.813	77%	0.77	S	S	*	*				5	168	125.8	-81.8	-1.8	0	0	0	121
742	P	39.3	Very low	31.1	Very low	100 Å²	100	125.7 Å²	125.7	65%	0.649	76%	0.759	S	S	*	*			cis	-145.9	-177.6	-34.5	38.9	-17.3	0	0	0	116.5
743	I	33.9	Very low	31	Very low	154 Å²	154	130 Å²	130	79%	0.79	77%	0.765	S	S	*	*			trans	72.8	165.4	156.4	-8.7	179.4	0	0	0	120.9
744	P	35.8	Very low	30.7	Very low	103 Å²	103	128.7 Å²	128.7	67%	0.669	76%	0.763	S	S	*	*				-126.2	-163.6	-96.8	43	-24.4	0	0	0	114.9
745	E	30.2	Very low	30.7	Very low	168 Å²	168	125.9 Å²	125.9	79%	0.785	76%	0.756	S	S	*	*			trans	112	115.7	148.8	-89.6	175	-160.1	0	0	121
746	T	28.6	Very low	30.5	Very low	111 Å²	111	124.9 Å²	124.9	68%	0.681	75%	0.754	S	S	*	*			trans	77.1	125.1	135.2	44.9	0	0	0	0	124.4
747	T	27.9	Very low	30.4	Very low	124 Å²	124	126.2 Å²	126.2	76%	0.761	76%	0.759	S	S	*	*			trans	68.4	114.8	135.8	51.2	0	0	0	0	120.9
748	S	32.5	Very low	30.4	Very low	123 Å²	123	127.7 Å²	127.7	86%	0.86	76%	0.758	S	S	*	*				154.5	140.2	101.5	51.9	0	0	0	0	112.8
749	S	28.9	Very low	30.3	Very low	107 Å²	107	128.1 Å²	128.1	75%	0.748	76%	0.759	S	S	*	*			trans	-68.3	-172.3	173.4	52.1	0	0	0	0	114.2
750	P	34.1	Very low	30.2	Very low	106 Å²	106	133.7 Å²	133.7	69%	0.688	77%	0.767	S	S	*	*			cis	-130.3	-168.9	-46.9	32.9	-12.5	0	0	0	111.8
751	E	26.3	Very low	29.9	Very low	182 Å²	182	135.4 Å²	135.4	85%	0.85	77%	0.77	S	S	*	*			trans	88.8	110.8	157.3	-67.6	-176.8	-179.6	0	0	121.7
752	A	25.7	Very low	29.7	Very low	82 Å²	82	131.6 Å²	131.6	68%	0.678	76%	0.755	S	S	*	*				84.5	129.8	122.6	0	0	0	0	0	122.3
753	F	27.6	Very low	29.5	Very low	189 Å²	189	135.7 Å²	135.7	83%	0.829	76%	0.758	S	S	*	*			trans	99.9	118.6	148.2	-82.9	-72.3	0	0	0	122
754	T	26.8	Very low	29.5	Very low	123 Å²	123	132.1 Å²	132.1	76%	0.755	75%	0.747	S	S	*	*			trans	76.7	115.8	146.6	62.7	0	0	0	0	120.7
755	S	29.2	Very low	29.3	Very low	110 Å²	110	136.7 Å²	136.7	77%	0.769	75%	0.75	S	S	*	*				175.7	137	96.9	52.7	0	0	0	0	113.1
756	S	27.4	Very low	29.5	Very low	103 Å²	103	133.2 Å²	133.2	72%	0.72	74%	0.737	S	S	*	*			trans	50.6	135.9	146.5	105.4	0	0	0	0	118.8
757	T	28.5	Very low	29.9	Very low	120 Å²	120	133.5 Å²	133.5	74%	0.736	73%	0.734	S	S	*	*			cis	178.3	154.8	40.2	11.9	0	0	0	0	109.8
758	K	30.4	Very low	30.2	Very low	194 Å²	194	133.4 Å²	133.4	84%	0.843	73%	0.729	S	S	*	*			trans	88.6	112.7	162.8	-63.6	175.7	-175.6	-178.3	0	119.4
759	P	26.3	Very low	30.3	Very low	117 Å²	117	132.6 Å²	132.6	76%	0.76	72%	0.718	S	S	*	*			trans	-86.4	126.7	176.3	34.1	-28.6	0	0	0	111.3
760	K	29.2	Very low	30.4	Very low	203 Å²	203	132.4 Å²	132.4	88%	0.883	71%	0.714	S	S	*	*			trans	-82.1	119.5	162.3	-77.8	-177.6	174.3	-178.7	0	108.3	S762	K760-S762 PolarHBondContact O-N 2.8Å
761	L	26.7	Very low	30.1	Very low	173 Å²	173	137.3 Å²	137.3	91%	0.906	73%	0.725	S	S	*	*			trans	-63.1	115.6	170.8	-83.7	93.9	0	0	0	109.2
762	S	28.5	Very low	30.4	Very low	72 Å²	72	134.4 Å²	134.4	50%	0.503	72%	0.72	S	S	.	*			trans	-112.8	130.8	164.8	78.1	0	0	0	0	109.8	K760 S764 R765	K760-S762 PolarHBondContact O-N 2.8Å; S762-S764 PolarHBondContact O-N 3.35Å; S762-S764 PolarHBondContact OG-OG 2.97Å; S762-R765 PolarHBondContact O-N 3.25Å
763	W	35.1	Very low	30.4	Very low	186 Å²	186	137.5 Å²	137.5	71%	0.705	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-59.5	-7.4	-177.7	-80.1	87.7	0	0	0	114.9	F480 R765 L766	F480-W763 HydrophobicContact CE1-CH2 4.01Å; F480-W763 HydrophobicContact CE1-CZ3 4Å; F480-W763 HydrophobicContact CZ-CH2 4.37Å; F480-W763 HydrophobicContact CZ-CZ3 4.39Å; W763-R765 VanDerWaalsContact C-N 3.26Å; W763-R765 PolarHBondContact O-N 3.07Å; W763-L766 HydrophobicContact CE3-CD1 4.04Å; W763-L766 HydrophobicContact CZ3-CD1 4.06Å
764	S	33.5	Very low	30.4	Very low	79 Å²	79	133.1 Å²	133.1	55%	0.552	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-68.9	-14.9	176.9	51.5	0	0	0	0	114.8	S762	S762-S764 PolarHBondContact O-N 3.35Å; S762-S764 PolarHBondContact OG-OG 2.97Å
765	R	31.9	Very low	30.3	Very low	198 Å²	198	133.1 Å²	133.1	75%	0.747	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-84.7	-14.9	-179.3	-96.4	-176	-171.9	167.5	3.6	115.8	S762 W763 L767 D768	S762-R765 PolarHBondContact O-N 3.25Å; W763-R765 VanDerWaalsContact C-N 3.26Å; W763-R765 PolarHBondContact O-N 3.07Å; R765-L767 PolarHBondContact O-N 3.21Å; R765-D768 PolarHBondContact O-N 3.45Å
766	L	35.2	Very low	30.2	Very low	95 Å²	95	133 Å²	133	50%	0.497	72%	0.723	S	S	.	*	G	3₁₀ helix	trans	-74.5	-9.6	179.7	-95.3	154.6	0	0	0	113.5	F480 W763	F480-L766 HydrophobicContact CD2-CD1 4.09Å; F480-L766 HydrophobicContact CD2-CD2 3.56Å; F480-L766 HydrophobicContact CD2-CG 4.47Å; F480-L766 HydrophobicContact CE1-CD1 4.11Å; F480-L766 HydrophobicContact CE2-CD1 3.6Å; F480-L766 HydrophobicContact CE2-CD2 3.84Å; F480-L766 HydrophobicContact CE2-CG 4.31Å; F480-L766 HydrophobicContact CG-CD2 4.14Å; F480-L766 HydrophobicContact CZ-CD1 3.62Å; W763-L766 HydrophobicContact CE3-CD1 4.04Å; W763-L766 HydrophobicContact CZ3-CD1 4.06Å
767	L	36.7	Very low	30.1	Very low	117 Å²	117	138.1 Å²	138.1	61%	0.613	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-97.5	-4	174.8	-68.2	170.4	0	0	0	113.4	L473 R765 V769	L473-L767 HydrophobicContact CD1-CD2 3.35Å; L473-L767 HydrophobicContact CD2-CD2 4.3Å; L473-L767 HydrophobicContact CG-CD2 4.48Å; R765-L767 PolarHBondContact O-N 3.21Å; L767-V769 PolarHBondContact O-N 3.08Å; L767-V769 VanDerWaalsContact O-N 3.17Å
768	D	33.7	Very low	30.1	Very low	123 Å²	123	137.8 Å²	137.8	66%	0.658	73%	0.733	S	S	*	*			trans	-85	86.2	176.9	-78.2	-32.6	0	0	0	110.1	R765	R765-D768 PolarHBondContact O-N 3.45Å
769	V	34.7	Very low	30	Very low	105 Å²	105	134 Å²	134	64%	0.636	73%	0.727	S	S	*	*			trans	-65.5	134.5	166.3	178.5	0	0	0	0	108.7	L767 K771	L767-V769 PolarHBondContact O-N 3.08Å; L767-V769 VanDerWaalsContact O-N 3.17Å; V769-K771 PolarHBondContact O-N 3.25Å
770	P	30.1	Very low	30.1	Very low	103 Å²	103	134.7 Å²	134.7	67%	0.669	73%	0.728	S	S	*	*			trans	-62.3	129.7	-176.9	-14.1	26.6	0	0	0	110.6	T772	P770-T772 VanDerWaalsContact C-N 3.32Å; P770-T772 PolarHBondContact O-N 3.5Å
771	K	29.3	Very low	30	Very low	210 Å²	210	131.3 Å²	131.3	91%	0.913	71%	0.714	S	S	*	*			trans	-66.8	91.3	166.2	-71	180	-179.8	176.6	0	108.4	V769 T773	V769-K771 PolarHBondContact O-N 3.25Å; K771-T773 PolarHBondContact O-N 3.04Å
772	T	32	Very low	30.2	Very low	121 Å²	121	129.1 Å²	129.1	74%	0.742	70%	0.702	S	S	*	*			trans	-72.1	119.9	165.5	44.9	0	0	0	0	108.9	P770 S774	P770-T772 VanDerWaalsContact C-N 3.32Å; P770-T772 PolarHBondContact O-N 3.5Å; T772-S774 PolarHBondContact O-N 2.99Å; T772-S774 VanDerWaalsContact O-N 3.17Å
773	T	25	Very low	30.3	Very low	146 Å²	146	131.7 Å²	131.7	90%	0.896	72%	0.715	S	S	*	*			trans	-54.5	109.1	171.4	37.1	0	0	0	0	110.8	K771	K771-T773 PolarHBondContact O-N 3.04Å
774	S	28.7	Very low	30.1	Very low	97 Å²	97	128.1 Å²	128.1	68%	0.678	71%	0.714	S	S	*	*			trans	-138.9	112.8	152.9	53.1	0	0	0	0	108.3	T772 T776	T772-S774 PolarHBondContact O-N 2.99Å; T772-S774 VanDerWaalsContact O-N 3.17Å; S774-T776 PolarHBondContact O-N 3.34Å
775	S	24.5	Very low	29.9	Very low	123 Å²	123	128.3 Å²	128.3	86%	0.86	71%	0.712	S	S	*	*			trans	-62.3	98.8	167.2	50.4	0	0	0	0	108.7
776	T	27.6	Very low	29.9	Very low	108 Å²	108	124.5 Å²	124.5	66%	0.663	71%	0.711	S	S	*	*			trans	-156.2	112.9	159.1	-1.9	0	0	0	0	107.5	S774 T778	S774-T776 PolarHBondContact O-N 3.34Å; T776-T778 PolarHBondContact O-N 3.41Å; T776-T778 PolarHBondContact O-OG1 3.28Å
777	Q	25.1	Very low	29.9	Very low	210 Å²	210	125 Å²	125	98%	0.981	72%	0.718	S	S	*	*			trans	-51.9	97.1	174.9	-73.5	174.3	-15.5	0	0	109.7
778	T	27.7	Very low	29.6	Very low	113 Å²	113	127.3 Å²	127.3	69%	0.693	73%	0.728	S	S	*	*			trans	-125.5	102.6	171.8	-37.1	0	0	0	0	107.2	T776 V780	T776-T778 PolarHBondContact O-N 3.41Å; T776-T778 PolarHBondContact O-OG1 3.28Å; T778-V780 PolarHBondContact O-N 2.88Å
779	T	28.1	Very low	29.4	Very low	115 Å²	115	125 Å²	125	71%	0.706	73%	0.726	S	S	*	*			trans	-62.7	103.2	175.9	33.3	0	0	0	0	109.5	K781	T779-K781 VanDerWaalsContact C-N 3.34Å; T779-K781 PolarHBondContact O-N 3.46Å
780	V	28.1	Very low	29.3	Very low	131 Å²	131	122 Å²	122	79%	0.794	71%	0.712	S	S	*	*			trans	-70.9	94	170	179.3	0	0	0	0	107.8	T778 L782	T778-V780 PolarHBondContact O-N 2.88Å; V780-L782 PolarHBondContact O-N 3.33Å
781	K	28.6	Very low	29.4	Very low	133 Å²	133	121 Å²	121	58%	0.578	70%	0.704	S	S	*	*			trans	-64.2	107.3	172.2	-73.8	178.6	176.8	178.4	0	109.1	T779 T783	T779-K781 VanDerWaalsContact C-N 3.34Å; T779-K781 PolarHBondContact O-N 3.46Å; K781-T783 PolarHBondContact O-N 2.82Å
782	L	30.4	Very low	29.5	Very low	126 Å²	126	116.1 Å²	116.1	66%	0.66	69%	0.692	S	S	*	*			trans	-73.7	116.8	167.1	-127.7	91.8	0	0	0	109.1	V780 T784	V780-L782 PolarHBondContact O-N 3.33Å; L782-T784 VanDerWaalsContact C-N 3.29Å; L782-T784 PolarHBondContact O-N 3.09Å; L782-T784 PolarHBondContact O-OG1 3Å
783	T	30.2	Very low	29.5	Very low	126 Å²	126	116.1 Å²	116.1	77%	0.773	69%	0.686	S	S	*	*			trans	-64.7	83.1	175.8	-17.1	0	0	0	0	110.2	K781	K781-T783 PolarHBondContact O-N 2.82Å
784	T	30.9	Very low	30	Very low	112 Å²	112	112.2 Å²	112.2	69%	0.687	66%	0.662	S	S	*	*			trans	-106.8	77.3	165.9	23.9	0	0	0	0	107.7	L782	L782-T784 VanDerWaalsContact C-N 3.29Å; L782-T784 PolarHBondContact O-N 3.09Å; L782-T784 PolarHBondContact O-OG1 3Å
785	T	29.3	Very low	30.3	Very low	83 Å²	83	111.2 Å²	111.2	51%	0.509	65%	0.653	S	S	.	*			trans	-154.1	57.2	174.2	10.7	0	0	0	0	110.3	Y339	Y339-T785 HydrophobicContact CE1-CG2 4.22Å
786	T	32.1	Very low	30.9	Very low	117 Å²	117	110.7 Å²	110.7	72%	0.718	64%	0.64	S	S	*	*	S	Bend	trans	-136.2	24.3	167.2	-22.1	0	0	0	0	112.7
787	T	35.5	Very low	31.3	Very low	107 Å²	107	108.8 Å²	108.8	66%	0.656	63%	0.628	S	S	*	*	S	Bend	trans	-114.9	-10.4	-175.3	43	0	0	0	0	115.6	T791	T787-T791 PolarHBondContact O-OG1 3.5Å
788	M	30.3	Very low	31.9	Very low	164 Å²	164	105.2 Å²	105.2	81%	0.808	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-22.2	176.8	-76.7	-164.5	160.4	0	0	115.1
789	A	29.3	Very low	32.3	Very low	75 Å²	75	106.5 Å²	106.5	62%	0.62	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-23.3	169	0	0	0	0	0	112.3
790	A	31.7	Very low	32.6	Very low	42 Å²	42	103.9 Å²	103.9	35%	0.347	60%	0.596	S	S	.	*	H	α-helix	trans	-69.3	-35.5	175.8	0	0	0	0	0	112	V792 L793 T794	A790-V792 VanDerWaalsContact C-N 3.35Å; A790-V792 PolarHBondContact O-N 2.95Å; A790-L793 PolarHBondContact O-N 3.33Å; A790-T794 WeakPolarHBondContact O-CB 3.4Å; A790-T794 WeakPolarHBondContact O-CG2 3.47Å; A790-T794 PolarHBondContact O-N 2.81Å; A790-T794 PolarHBondContact O-OG1 3.47Å
791	T	33.1	Very low	33.2	Very low	83 Å²	83	102.1 Å²	102.1	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-69.1	-27.5	-173.1	-32.2	0	0	0	0	114.2	T787 T794	T787-T791 PolarHBondContact O-OG1 3.5Å; T791-T794 WeakPolarHBondContact CA-OG1 3.3Å; T791-T794 PolarHBondContact O-OG1 3.38Å
792	V	32	Very low	33.7	Very low	107 Å²	107	103.2 Å²	103.2	65%	0.648	59%	0.586	S	S	*	*	H	α-helix	trans	-88.3	-24.2	178	-178.7	0	0	0	0	111.8	A790 T795	A790-V792 VanDerWaalsContact C-N 3.35Å; A790-V792 PolarHBondContact O-N 2.95Å; V792-T795 PolarHBondContact O-OG1 2.83Å
793	L	30.8	Very low	34.1	Very low	120 Å²	120	101.2 Å²	101.2	63%	0.628	58%	0.579	S	S	*	*	H	α-helix	trans	-85	-30.1	173.8	-87.9	148.1	0	0	0	112.4	A790 T797	A790-L793 PolarHBondContact O-N 3.33Å; L793-T797 PolarHBondContact O-N 3.41Å; L793-T797 PolarHBondContact O-OG1 3.14Å
794	T	36	Very low	34.6	Very low	64 Å²	64	99.5 Å²	99.5	39%	0.393	57%	0.565	S	S	.	*	H	α-helix	trans	-71.4	-27.2	178.3	48.7	0	0	0	0	113.9	A790 T791 T797 Q798	A790-T794 WeakPolarHBondContact O-CB 3.4Å; A790-T794 WeakPolarHBondContact O-CG2 3.47Å; A790-T794 PolarHBondContact O-N 2.81Å; A790-T794 PolarHBondContact O-OG1 3.47Å; T791-T794 WeakPolarHBondContact CA-OG1 3.3Å; T791-T794 PolarHBondContact O-OG1 3.38Å; T794-T797 WeakPolarHBondContact CA-OG1 3.42Å; T794-Q798 WeakPolarHBondContact O-CB 3.12Å; T794-Q798 WeakPolarHBondContact O-CG 3.32Å; T794-Q798 PolarHBondContact O-N 3.47Å
795	T	35.6	Very low	35	Very low	77 Å²	77	98.6 Å²	98.6	47%	0.472	56%	0.556	S	S	.	*	H	α-helix	trans	-73.6	-35.6	176.5	47.2	0	0	0	0	112	V792	V792-T795 PolarHBondContact O-OG1 2.83Å
796	N	35.9	Very low	35.5	Very low	112 Å²	112	100.8 Å²	100.8	60%	0.599	56%	0.561	S	S	*	*	H	α-helix	trans	-82.4	-28.7	176.8	-74.8	-3.7	0	0	0	113	S800	N796-S800 PolarHBondContact O-N 2.88Å
797	T	37.7	Very low	36	Very low	68 Å²	68	98.8 Å²	98.8	42%	0.417	55%	0.549	S	S	.	.	H	α-helix	trans	-76.4	-29.8	172.3	33.9	0	0	0	0	113	L793 T794 Q799 S800 I801	L793-T797 PolarHBondContact O-N 3.41Å; L793-T797 PolarHBondContact O-OG1 3.14Å; T794-T797 WeakPolarHBondContact CA-OG1 3.42Å; T797-Q799 VanDerWaalsContact C-N 3.32Å; T797-Q799 PolarHBondContact O-N 3.24Å; T797-S800 PolarHBondContact O-N 3.04Å; T797-I801 WeakPolarHBondContact O-CB 3.31Å; T797-I801 WeakPolarHBondContact O-CD1 3.24Å; T797-I801 WeakPolarHBondContact O-CG1 3.14Å; T797-I801 PolarHBondContact O-N 3.23Å
798	Q	36.8	Very low	36.3	Very low	134 Å²	134	97.8 Å²	97.8	63%	0.626	54%	0.538	S	S	*	.	H	α-helix	trans	-68.6	-27.1	173.8	-82.6	-178.4	-19.8	0	0	113.8	T794 K802	T794-Q798 WeakPolarHBondContact O-CB 3.12Å; T794-Q798 WeakPolarHBondContact O-CG 3.32Å; T794-Q798 PolarHBondContact O-N 3.47Å; Q798-K802 PolarHBondContact O-N 3.38Å
799	Q	35.9	Very low	36.8	Very low	141 Å²	141	97 Å²	97	66%	0.659	53%	0.533	S	S	*	.	H	α-helix	trans	-75.5	-38.7	170.6	-88.1	178.8	-28.5	0	0	112.2	T797 K802 T803	T797-Q799 VanDerWaalsContact C-N 3.32Å; T797-Q799 PolarHBondContact O-N 3.24Å; Q799-K802 PolarHBondContact O-N 2.87Å; Q799-T803 PolarHBondContact O-N 3.15Å; Q799-T803 PolarHBondContact O-OG1 3.3Å; Q799-T803 VanDerWaalsContact O-OG1 3.07Å
800	S	35.4	Very low	37.3	Very low	60 Å²	60	100.8 Å²	100.8	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-71.8	-27.7	176.3	177.4	0	0	0	0	113.9	N796 T797 T803 N804	N796-S800 PolarHBondContact O-N 2.88Å; T797-S800 PolarHBondContact O-N 3.04Å; S800-T803 PolarHBondContact O-OG1 2.73Å; S800-N804 PolarHBondContact O-N 2.99Å
801	I	39.4	Very low	37.7	Very low	94 Å²	94	103 Å²	103	48%	0.482	55%	0.547	S	S	.	.	H	α-helix	trans	-78.7	-25.7	176.9	-68.4	164.5	0	0	0	111.3	T797 N805	T797-I801 WeakPolarHBondContact O-CB 3.31Å; T797-I801 WeakPolarHBondContact O-CD1 3.24Å; T797-I801 WeakPolarHBondContact O-CG1 3.14Å; T797-I801 PolarHBondContact O-N 3.23Å; I801-N805 WeakPolarHBondContact O-CB 3.49Å; I801-N805 PolarHBondContact O-N 3.41Å
802	K	39.2	Very low	38	Very low	156 Å²	156	106.8 Å²	106.8	68%	0.678	56%	0.556	S	S	*	*	H	α-helix	trans	-71.4	-42.9	172.3	-82.8	-174.8	173.8	-173.4	0	112.4	Q798 Q799 E806	Q798-K802 PolarHBondContact O-N 3.38Å; Q799-K802 PolarHBondContact O-N 2.87Å; K802-E806 PolarHBondContact O-N 3.45Å
803	T	39.4	Very low	38.3	Very low	84 Å²	84	110.2 Å²	110.2	52%	0.515	57%	0.565	S	S	.	*	H	α-helix	trans	-68.8	-35.3	176.6	27.4	0	0	0	0	113.3	Q799 S800 T807	Q799-T803 PolarHBondContact O-N 3.15Å; Q799-T803 PolarHBondContact O-OG1 3.3Å; Q799-T803 VanDerWaalsContact O-OG1 3.07Å; S800-T803 PolarHBondContact O-OG1 2.73Å; T803-T807 PolarHBondContact O-N 2.96Å; T803-T807 PolarHBondContact O-OG1 3.41Å; T803-T807 VanDerWaalsContact O-OG1 3.14Å
804	N	40.6	Very low	38.7	Very low	89 Å²	89	112.6 Å²	112.6	48%	0.476	57%	0.573	S	S	.	*	H	α-helix	trans	-73.8	-29.9	177.7	-80	-10	0	0	0	113.6	S800 T807 I808	S800-N804 PolarHBondContact O-N 2.99Å; N804-T807 WeakPolarHBondContact CA-OG1 3.36Å; N804-T807 PolarHBondContact O-OG1 3.3Å; N804-I808 WeakPolarHBondContact O-CD1 3.37Å; N804-I808 VanDerWaalsContact O-CG1 3.23Å; N804-I808 WeakPolarHBondContact O-CG1 3.15Å; N804-I808 PolarHBondContact O-N 3.23Å
805	N	39.1	Very low	38.9	Very low	94 Å²	94	116.2 Å²	116.2	50%	0.503	59%	0.59	S	S	.	*	H	α-helix	trans	-74.6	-24.7	177.2	-82.2	-13.1	0	0	0	113.3	I801 Q809	I801-N805 WeakPolarHBondContact O-CB 3.49Å; I801-N805 PolarHBondContact O-N 3.41Å; N805-Q809 PolarHBondContact O-N 2.98Å
806	E	40.7	Very low	38.9	Very low	129 Å²	129	120.4 Å²	120.4	60%	0.603	61%	0.609	S	S	*	*	H	α-helix	trans	-72.9	-40.5	173.4	-71.7	171.2	176.6	0	0	111	K802 I808 Q809 E810	K802-E806 PolarHBondContact O-N 3.45Å; E806-I808 PolarHBondContact O-N 2.83Å; E806-Q809 PolarHBondContact O-N 3.25Å; E806-E810 PolarHBondContact O-N 2.81Å
807	T	41.4	Very low	38.8	Very low	75 Å²	75	124.1 Å²	124.1	46%	0.46	62%	0.62	S	S	.	*	H	α-helix	trans	-69.9	-24	173.6	33.2	0	0	0	0	115	T803 N804 T811	T803-T807 PolarHBondContact O-N 2.96Å; T803-T807 PolarHBondContact O-OG1 3.41Å; T803-T807 VanDerWaalsContact O-OG1 3.14Å; N804-T807 WeakPolarHBondContact CA-OG1 3.36Å; N804-T807 PolarHBondContact O-OG1 3.3Å; T807-T811 PolarHBondContact O-N 3.15Å; T807-T811 PolarHBondContact O-OG1 3.49Å
808	I	42.4	Very low	38.7	Very low	85 Å²	85	129.2 Å²	129.2	44%	0.436	64%	0.643	S	S	.	*	H	α-helix	trans	-85.1	-20	178.4	-68.3	167.7	0	0	0	111.8	N804 E806 T811	N804-I808 WeakPolarHBondContact O-CD1 3.37Å; N804-I808 VanDerWaalsContact O-CG1 3.23Å; N804-I808 WeakPolarHBondContact O-CG1 3.15Å; N804-I808 PolarHBondContact O-N 3.23Å; E806-I808 PolarHBondContact O-N 2.83Å; I808-T811 WeakPolarHBondContact CA-OG1 3.36Å
809	Q	39.8	Very low	38.4	Very low	149 Å²	149	130.9 Å²	130.9	70%	0.696	65%	0.651	S	S	*	*	H	α-helix	trans	-80.4	-30.6	170.9	-82.1	-177.4	-28.5	0	0	112.6	N805 E806	N805-Q809 PolarHBondContact O-N 2.98Å; E806-Q809 PolarHBondContact O-N 3.25Å
810	E	39.9	Very low	38	Very low	153 Å²	153	132.6 Å²	132.6	72%	0.715	66%	0.656	S	S	*	*	H	α-helix	trans	-76.3	-26.2	175.5	-70.6	-176.9	160.6	0	0	113.5	E806	E806-E810 PolarHBondContact O-N 2.81Å
811	T	41.2	Very low	37.8	Very low	89 Å²	89	136.8 Å²	136.8	55%	0.546	67%	0.674	S	S	.	*	H	α-helix	trans	-85	-15.8	177	34.2	0	0	0	0	114.2	T807 I808	T807-T811 PolarHBondContact O-N 3.15Å; T807-T811 PolarHBondContact O-OG1 3.49Å; I808-T811 WeakPolarHBondContact CA-OG1 3.36Å
812	K	38.8	Very low	37.3	Very low	163 Å²	163	136.9 Å²	136.9	71%	0.709	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-1.8	176.7	-81.1	-174.2	174.3	-175.6	0	115
813	Q	38.6	Very low	36.9	Very low	178 Å²	178	134.2 Å²	134.2	83%	0.832	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	0.5	175.4	-105	179.6	-9.5	0	0	114
814	H	39.7	Very low	36.5	Very low	171 Å²	171	137.9 Å²	137.9	79%	0.792	70%	0.7	S	S	*	*	S	Bend	trans	-112.6	-7.2	-173.3	-135.9	25	0	0	0	116.4
815	D	39.3	Very low	36.1	Very low	140 Å²	140	139 Å²	139	75%	0.749	71%	0.712	S	S	*	*			trans	-110.7	5	-170.3	-76	-19.9	0	0	0	116.4	K817	D815-K817 VanDerWaalsContact C-N 3.29Å; D815-K817 PolarHBondContact O-N 3.3Å
816	D	35.7	Very low	35.6	Very low	165 Å²	165	142.6 Å²	142.6	88%	0.882	73%	0.731	S	S	*	*			trans	-87.9	26.9	-178.9	-83.1	-18.1	0	0	0	115
817	K	34.4	Very low	35.1	Very low	189 Å²	189	144.4 Å²	144.4	82%	0.822	74%	0.741	S	S	*	*			trans	-120.2	92.7	168.2	-90.2	-177.3	176.3	177.2	0	109.4	D815	D815-K817 VanDerWaalsContact C-N 3.29Å; D815-K817 PolarHBondContact O-N 3.3Å
818	I	34.4	Very low	34.5	Very low	176 Å²	176	146.8 Å²	146.8	90%	0.903	75%	0.751	S	S	*	*			trans	-174.6	115.9	139	-88.4	144.2	0	0	0	108.4
819	Q	31.8	Very low	34	Very low	169 Å²	169	152 Å²	152	79%	0.79	77%	0.77	S	S	*	*			trans	-75.5	150.3	177.7	-86.7	176	-57.8	0	0	113.1
820	F	27.8	Very low	33.7	Very low	177 Å²	177	154.2 Å²	154.2	78%	0.776	78%	0.778	S	S	*	*			trans	41.4	118.1	139.8	-80.6	-99.8	0	0	0	119.7
821	N	30.5	Very low	33.4	Very low	148 Å²	148	152.3 Å²	152.3	79%	0.791	77%	0.773	S	S	*	*				-178	148.2	99.6	-102.8	-21.4	0	0	0	115.2
822	S	29.2	Very low	33.5	Very low	96 Å²	96	154.2 Å²	154.2	67%	0.671	78%	0.78	S	S	*	*			trans	-22.2	151.3	169.7	58.3	0	0	0	0	122.5
823	S	30	Very low	33.6	Very low	99 Å²	99	153 Å²	153	69%	0.692	77%	0.774	S	S	*	*			trans	73.5	102.5	136.7	57.9	0	0	0	0	120.3
824	N	30.8	Very low	33.8	Very low	162 Å²	162	149.1 Å²	149.1	87%	0.866	76%	0.76	S	S	*	*				-172.1	129	124.1	-99.9	-22.6	0	0	0	111.9
825	P	32.3	Very low	34.3	Very low	111 Å²	111	145.5 Å²	145.5	72%	0.721	75%	0.749	S	S	*	*			trans	-89.7	155.7	166.3	35.6	-28	0	0	0	110.4
826	L	29.2	Very low	35	Very low	170 Å²	170	143.4 Å²	143.4	89%	0.89	74%	0.737	S	S	*	*			trans	103.8	96.4	172.5	-59	161.8	0	0	0	116.3
827	M	30.3	Very low	36	Very low	168 Å²	168	140.9 Å²	140.9	83%	0.828	72%	0.72	S	S	*	*			trans	160.2	98.1	136.2	-91.8	-102	-178.2	0	0	107.8
828	N	28.6	Very low	37.6	Very low	124 Å²	124	133.6 Å²	133.6	66%	0.663	70%	0.698	S	S	*	*				76.4	113.8	97.1	-92.7	-21.6	0	0	0	114.4
829	K	30.9	Very low	39	Very low	194 Å²	194	131.9 Å²	131.9	84%	0.843	69%	0.687	S	S	*	*			trans	49.6	84.1	148.3	-71.4	177.4	172.8	175.6	0	116.8
830	F	33.7	Very low	40.6	Very low	197 Å²	197	130.2 Å²	130.2	86%	0.864	68%	0.679	S	S	*	*			trans	-104.6	109.8	145.8	-88.2	-84.4	0	0	0	108.5
831	N	34.3	Very low	42.7	Very low	112 Å²	112	127.2 Å²	127.2	60%	0.599	67%	0.667	S	S	*	*			trans	-65.3	131.1	-178.2	-107.7	-18.4	0	0	0	109.8	K833 D834	N831-K833 HydrophobicContact CB-CB 4.35Å; N831-K833 PolarHBondContact O-N 3.42Å; N831-D834 PolarHBondContact O-N 3.04Å
832	N	42.5	Very low	44.7	Very low	129 Å²	129	129.7 Å²	129.7	69%	0.69	67%	0.665	S	S	*	*	H	α-helix	trans	-54.9	-7.7	167.8	-101.9	-15.4	0	0	0	114.2	I836	N832-I836 VanDerWaalsContact O-CD1 3.27Å; N832-I836 WeakPolarHBondContact O-CD1 3.39Å; N832-I836 WeakPolarHBondContact O-CG1 3.43Å; N832-I836 PolarHBondContact O-N 3.5Å
833	K	41.1	Very low	46.8	Very low	138 Å²	138	131.9 Å²	131.9	60%	0.6	66%	0.663	S	S	*	*	H	α-helix	trans	-68.8	-41.3	173.6	-100	-174.9	169.8	-170.4	0	113	N831 V835 I836 E837	N831-K833 HydrophobicContact CB-CB 4.35Å; N831-K833 PolarHBondContact O-N 3.42Å; K833-V835 VanDerWaalsContact C-N 3.31Å; K833-V835 PolarHBondContact O-N 2.86Å; K833-I836 PolarHBondContact O-N 2.87Å; K833-E837 WeakPolarHBondContact O-CB 3.46Å; K833-E837 WeakPolarHBondContact O-CG 3.49Å; K833-E837 PolarHBondContact O-N 3.41Å
834	D	44.4	Very low	48.9	Very low	97 Å²	97	132.5 Å²	132.5	52%	0.519	66%	0.655	S	S	.	*	H	α-helix	trans	-72	-30.1	-173.5	-57.3	-16.1	0	0	0	111.3	N831 G838	N831-D834 PolarHBondContact O-N 3.04Å; D834-G838 PolarHBondContact O-N 3.09Å
835	V	50.2	Low	51.3	Low	94 Å²	94	130.9 Å²	130.9	57%	0.57	64%	0.64	S	S	*	*	H	α-helix	trans	-72.3	-40.6	174.3	-178.6	0	0	0	0	111.2	K833 E839	K833-V835 VanDerWaalsContact C-N 3.31Å; K833-V835 PolarHBondContact O-N 2.86Å; V835-E839 PolarHBondContact O-N 2.91Å; V835-E839 VanDerWaalsContact O-N 3.08Å
836	I	52.7	Low	53.6	Low	96 Å²	96	129.1 Å²	129.1	49%	0.492	63%	0.628	S	S	.	*	H	α-helix	trans	-70.9	-38.7	177.9	-65.7	169	0	0	0	111.1	N832 K833 E839 Q840	N832-I836 VanDerWaalsContact O-CD1 3.27Å; N832-I836 WeakPolarHBondContact O-CD1 3.39Å; N832-I836 WeakPolarHBondContact O-CG1 3.43Å; N832-I836 PolarHBondContact O-N 3.5Å; K833-I836 PolarHBondContact O-N 2.87Å; I836-E839 PolarHBondContact O-N 2.92Å; I836-Q840 WeakPolarHBondContact O-CB 3.31Å; I836-Q840 WeakPolarHBondContact O-CG 3.48Å; I836-Q840 PolarHBondContact O-N 3.42Å
837	E	56.4	Low	55.9	Low	113 Å²	113	124.5 Å²	124.5	53%	0.528	60%	0.603	S	S	.	*	H	α-helix	trans	-66.4	-40.5	175.4	-77.8	179.3	-175.2	0	0	111.4	K833 Q840 E841	K833-E837 WeakPolarHBondContact O-CB 3.46Å; K833-E837 WeakPolarHBondContact O-CG 3.49Å; K833-E837 PolarHBondContact O-N 3.41Å; E837-Q840 PolarHBondContact O-N 3.15Å; E837-E841 PolarHBondContact O-N 2.95Å
838	G	68.9	Low	58.3	Low	36 Å²	36	120.9 Å²	120.9	37%	0.371	59%	0.585	S	S	.	*	H	α-helix	trans	-64.3	-37.8	174.4	0	0	0	0	0	114.2	D834 R842	D834-G838 PolarHBondContact O-N 3.09Å; G838-R842 PolarHBondContact O-N 3.46Å
839	E	63.5	Low	60.8	Low	140 Å²	140	121.6 Å²	121.6	65%	0.654	59%	0.585	S	S	*	*	H	α-helix	trans	-71.6	-38.1	174.7	-77.4	-161.3	155.6	0	0	112.7	V835 I836 E841 R842 F843	V835-E839 PolarHBondContact O-N 2.91Å; V835-E839 VanDerWaalsContact O-N 3.08Å; I836-E839 PolarHBondContact O-N 2.92Å; E839-E841 VanDerWaalsContact C-N 3.34Å; E839-R842 PolarHBondContact O-N 3.14Å; E839-F843 WeakPolarHBondContact O-CB 3.39Å; E839-F843 PolarHBondContact O-N 3.42Å
840	Q	65.2	Low	63	Low	134 Å²	134	118.3 Å²	118.3	63%	0.626	57%	0.572	S	S	*	*	H	α-helix	trans	-63.3	-39.8	173.9	-79.8	-169.6	-22.1	0	0	112	I836 E837 F843 H844	I836-Q840 WeakPolarHBondContact O-CB 3.31Å; I836-Q840 WeakPolarHBondContact O-CG 3.48Å; I836-Q840 PolarHBondContact O-N 3.42Å; E837-Q840 PolarHBondContact O-N 3.15Å; Q840-F843 PolarHBondContact O-N 3.34Å; Q840-H844 WeakPolarHBondContact O-CB 3.32Å; Q840-H844 PolarHBondContact O-N 3.26Å
841	E	72.2	Confident	65.3	Low	114 Å²	114	113.2 Å²	113.2	53%	0.533	55%	0.553	S	S	.	*	H	α-helix	trans	-67.6	-38.7	178.3	-149.3	-166.1	151	0	0	111.9	E837 E839 H844 K845	E837-E841 PolarHBondContact O-N 2.95Å; E839-E841 VanDerWaalsContact C-N 3.34Å; E841-H844 PolarHBondContact O-N 3.37Å; E841-K845 PolarHBondContact O-N 3.4Å; E841-K845 IonicContact OE1-NZ 2.81Å; E841-K845 PolarHBondContact OE1-NZ 2.7Å
842	R	72.6	Confident	67.5	Low	199 Å²	199	111.3 Å²	111.3	75%	0.751	54%	0.542	S	S	*	.	H	α-helix	trans	-63.4	-44.3	171.5	-91.8	-173.2	-175	-177.2	2.4	112.4	G838 E839 H844 K845 T846	G838-R842 PolarHBondContact O-N 3.46Å; E839-R842 PolarHBondContact O-N 3.14Å; R842-H844 VanDerWaalsContact C-N 3.34Å; R842-H844 PolarHBondContact O-N 2.89Å; R842-K845 PolarHBondContact O-N 3.48Å; R842-T846 PolarHBondContact O-N 3.11Å; R842-T846 PolarHBondContact O-OG1 3.2Å
843	F	72.9	Confident	69.5	Low	142 Å²	142	110.2 Å²	110.2	62%	0.623	54%	0.536	S	S	*	.	H	α-helix	trans	-62.9	-42.3	178.1	-173	-105.9	0	0	0	111.2	E839 Q840 T846 I847	E839-F843 WeakPolarHBondContact O-CB 3.39Å; E839-F843 PolarHBondContact O-N 3.42Å; Q840-F843 PolarHBondContact O-N 3.34Å; F843-T846 PolarHBondContact O-N 2.94Å; F843-I847 HydrophobicContact CD1-CD1 3.75Å; F843-I847 HydrophobicContact CE1-CD1 3.26Å; F843-I847 HydrophobicContact CE1-CG1 4.29Å; F843-I847 HydrophobicContact CE2-CD1 4.46Å; F843-I847 HydrophobicContact CZ-CD1 3.67Å; F843-I847 HydrophobicContact CZ-CG1 4.41Å; F843-I847 WeakPolarHBondContact O-CG1 3.3Å; F843-I847 PolarHBondContact O-N 3.37Å
844	H	75.2	Confident	71.3	Confident	113 Å²	113	109.1 Å²	109.1	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-63.6	-44.5	176.4	-166	77.8	0	0	0	112.6	Q840 E841 R842 T846 I847 M848	Q840-H844 WeakPolarHBondContact O-CB 3.32Å; Q840-H844 PolarHBondContact O-N 3.26Å; E841-H844 PolarHBondContact O-N 3.37Å; R842-H844 VanDerWaalsContact C-N 3.34Å; R842-H844 PolarHBondContact O-N 2.89Å; H844-T846 VanDerWaalsContact C-N 3.31Å; H844-T846 PolarHBondContact O-N 2.97Å; H844-I847 PolarHBondContact O-N 3.08Å; H844-M848 WeakPolarHBondContact O-CG 3.48Å; H844-M848 PolarHBondContact O-N 3.4Å
845	K	81.4	Confident	73.2	Confident	127 Å²	127	111.4 Å²	111.4	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-60.5	-38.9	174.6	-79.3	178.2	-178.6	162.7	0	112.4	E841 R842 M848 Q849	E841-K845 PolarHBondContact O-N 3.4Å; E841-K845 IonicContact OE1-NZ 2.81Å; E841-K845 PolarHBondContact OE1-NZ 2.7Å; R842-K845 PolarHBondContact O-N 3.48Å; K845-M848 PolarHBondContact O-N 2.6Å; K845-Q849 WeakPolarHBondContact O-CG 3.35Å; K845-Q849 PolarHBondContact O-N 3.08Å
846	T	80.3	Confident	74.8	Confident	75 Å²	75	111.1 Å²	111.1	46%	0.46	53%	0.533	S	S	.	.	H	α-helix	trans	-67.7	-40.6	178.9	-49.9	0	0	0	0	111.9	R842 F843 H844 Q849 H850	R842-T846 PolarHBondContact O-N 3.11Å; R842-T846 PolarHBondContact O-OG1 3.2Å; F843-T846 PolarHBondContact O-N 2.94Å; H844-T846 VanDerWaalsContact C-N 3.31Å; H844-T846 PolarHBondContact O-N 2.97Å; T846-Q849 PolarHBondContact O-N 2.92Å; T846-H850 PolarHBondContact O-N 3.48Å; T846-H850 VanDerWaalsContact O-N 3.15Å
847	I	77.7	Confident	76.3	Confident	72 Å²	72	110.9 Å²	110.9	37%	0.369	53%	0.532	S	S	.	.	H	α-helix	trans	-63.9	-45.7	174.4	-72.6	178.2	0	0	0	110.8	F843 H844 Q849 H850 I851	F843-I847 HydrophobicContact CD1-CD1 3.75Å; F843-I847 HydrophobicContact CE1-CD1 3.26Å; F843-I847 HydrophobicContact CE1-CG1 4.29Å; F843-I847 HydrophobicContact CE2-CD1 4.46Å; F843-I847 HydrophobicContact CZ-CD1 3.67Å; F843-I847 HydrophobicContact CZ-CG1 4.41Å; F843-I847 WeakPolarHBondContact O-CG1 3.3Å; F843-I847 PolarHBondContact O-N 3.37Å; H844-I847 PolarHBondContact O-N 3.08Å; I847-Q849 VanDerWaalsContact C-N 3.34Å; I847-Q849 PolarHBondContact O-N 3.14Å; I847-H850 PolarHBondContact O-N 3.38Å; I847-H850 VanDerWaalsContact O-N 3.16Å; I847-I851 HydrophobicContact CG2-CD1 3.79Å; I847-I851 HydrophobicContact CG2-CG1 4.38Å; I847-I851 WeakPolarHBondContact O-CG1 3.31Å; I847-I851 PolarHBondContact O-N 3.38Å
848	M	79.9	Confident	77.4	Confident	93 Å²	93	112.1 Å²	112.1	46%	0.458	54%	0.536	S	S	.	.	H	α-helix	trans	-60.8	-41.7	178.8	-75.5	-63.4	-157	0	0	112.1	H844 K845 H850 I851 D852	H844-M848 WeakPolarHBondContact O-CG 3.48Å; H844-M848 PolarHBondContact O-N 3.4Å; K845-M848 PolarHBondContact O-N 2.6Å; M848-H850 PolarHBondContact O-N 3.09Å; M848-I851 PolarHBondContact O-N 2.76Å; M848-D852 PolarHBondContact O-N 2.87Å
849	Q	81.5	Confident	78.1	Confident	139 Å²	139	113.9 Å²	113.9	65%	0.65	54%	0.537	S	S	*	.	H	α-helix	trans	-61.3	-39.8	174.1	-77.8	-179.7	-20.1	0	0	113	K845 T846 I847 D852 L853	K845-Q849 WeakPolarHBondContact O-CG 3.35Å; K845-Q849 PolarHBondContact O-N 3.08Å; T846-Q849 PolarHBondContact O-N 2.92Å; I847-Q849 VanDerWaalsContact C-N 3.34Å; I847-Q849 PolarHBondContact O-N 3.14Å; Q849-D852 PolarHBondContact O-N 3.14Å; Q849-L853 WeakPolarHBondContact O-CB 3.4Å; Q849-L853 PolarHBondContact O-N 3.48Å
850	H	77.4	Confident	79.2	Confident	125 Å²	125	110.5 Å²	110.5	58%	0.579	53%	0.526	S	S	*	.	H	α-helix	trans	-66.4	-39.3	175.4	-99.5	72.4	0	0	0	112.5	T846 I847 M848 L853 L854	T846-H850 PolarHBondContact O-N 3.48Å; T846-H850 VanDerWaalsContact O-N 3.15Å; I847-H850 PolarHBondContact O-N 3.38Å; I847-H850 VanDerWaalsContact O-N 3.16Å; M848-H850 PolarHBondContact O-N 3.09Å; H850-L853 PolarHBondContact O-N 3.45Å; H850-L854 WeakPolarHBondContact O-CB 3.47Å; H850-L854 WeakPolarHBondContact O-CG 3.33Å; H850-L854 PolarHBondContact O-N 3.31Å
851	I	80.8	Confident	80	Confident	89 Å²	89	109.1 Å²	109.1	46%	0.456	52%	0.523	S	S	.	.	H	α-helix	trans	-63.8	-44.2	176	-69.1	171.2	0	0	0	110.4	I847 M848 L853 L854 R855	I847-I851 HydrophobicContact CG2-CD1 3.79Å; I847-I851 HydrophobicContact CG2-CG1 4.38Å; I847-I851 WeakPolarHBondContact O-CG1 3.31Å; I847-I851 PolarHBondContact O-N 3.38Å; M848-I851 PolarHBondContact O-N 2.76Å; I851-L853 PolarHBondContact O-N 2.99Å; I851-L854 PolarHBondContact O-N 2.98Å; I851-R855 WeakPolarHBondContact O-CB 3.3Å; I851-R855 PolarHBondContact O-N 3.47Å
852	D	81.7	Confident	80.5	Confident	72 Å²	72	107.7 Å²	107.7	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-65.9	-36.7	177.4	-83	-29.9	0	0	0	112.5	M848 Q849 R855 N856	M848-D852 PolarHBondContact O-N 2.87Å; Q849-D852 PolarHBondContact O-N 3.14Å; D852-R855 PolarHBondContact O-N 2.89Å; D852-R855 IonicContact OD1-NH1 3.3Å; D852-R855 PolarHBondContact OD1-NH1 3.3Å; D852-N856 WeakPolarHBondContact O-CB 3.46Å; D852-N856 VanDerWaalsContact O-CG 3.27Å; D852-N856 PolarHBondContact O-N 3.1Å; D852-N856 PolarHBondContact O-ND2 2.96Å
853	L	83.4	Confident	81.1	Confident	106 Å²	106	107.2 Å²	107.2	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-64.8	-43.6	174.5	-162.4	111.4	0	0	0	111.8	Q849 H850 I851 N856 N857	Q849-L853 WeakPolarHBondContact O-CB 3.4Å; Q849-L853 PolarHBondContact O-N 3.48Å; H850-L853 PolarHBondContact O-N 3.45Å; I851-L853 PolarHBondContact O-N 2.99Å; L853-N856 PolarHBondContact O-N 3.14Å; L853-N857 WeakPolarHBondContact O-CB 3.12Å; L853-N857 PolarHBondContact O-N 2.97Å
854	L	79.5	Confident	81.7	Confident	115 Å²	115	104.4 Å²	104.4	60%	0.602	51%	0.507	S	S	*	.	H	α-helix	trans	-62.9	-43.9	175.3	-76.7	168.8	0	0	0	111.6	H850 I851 N857 F858	H850-L854 WeakPolarHBondContact O-CB 3.47Å; H850-L854 WeakPolarHBondContact O-CG 3.33Å; H850-L854 PolarHBondContact O-N 3.31Å; I851-L854 PolarHBondContact O-N 2.98Å; L854-N857 PolarHBondContact O-N 2.87Å; L854-F858 WeakPolarHBondContact O-CB 3.17Å; L854-F858 PolarHBondContact O-N 3.47Å
855	R	83.1	Confident	82	Confident	146 Å²	146	104.4 Å²	104.4	55%	0.551	51%	0.51	S	S	*	.	H	α-helix	trans	-60.5	-46.1	176	177.6	-177.8	142	-153.3	1.1	111.6	I851 D852 F858 L859	I851-R855 WeakPolarHBondContact O-CB 3.3Å; I851-R855 PolarHBondContact O-N 3.47Å; D852-R855 PolarHBondContact O-N 2.89Å; D852-R855 IonicContact OD1-NH1 3.3Å; D852-R855 PolarHBondContact OD1-NH1 3.3Å; R855-F858 PolarHBondContact O-N 3.25Å; R855-L859 HydrophobicContact CG-CD1 4.05Å; R855-L859 WeakPolarHBondContact O-CB 3.22Å; R855-L859 WeakPolarHBondContact O-CG 3.34Å; R855-L859 PolarHBondContact O-N 3.16Å
856	N	85.1	Confident	82.2	Confident	88 Å²	88	101.1 Å²	101.1	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-66.5	-40.1	179.5	-73.9	-24.8	0	0	0	112.3	D852 L853 L859 T860	D852-N856 WeakPolarHBondContact O-CB 3.46Å; D852-N856 VanDerWaalsContact O-CG 3.27Å; D852-N856 PolarHBondContact O-N 3.1Å; D852-N856 PolarHBondContact O-ND2 2.96Å; L853-N856 PolarHBondContact O-N 3.14Å; N856-L859 PolarHBondContact O-N 3.02Å; N856-T860 WeakPolarHBondContact O-CB 3.49Å; N856-T860 PolarHBondContact O-N 3.4Å; N856-T860 PolarHBondContact O-OG1 3.07Å
857	N	82.8	Confident	82.4	Confident	90 Å²	90	100.9 Å²	100.9	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-63.6	-42.3	173.2	-82.8	-22.7	0	0	0	111.9	L853 L854 T860 N861	L853-N857 WeakPolarHBondContact O-CB 3.12Å; L853-N857 PolarHBondContact O-N 2.97Å; L854-N857 PolarHBondContact O-N 2.87Å; N857-T860 PolarHBondContact O-N 3.5Å; N857-N861 WeakPolarHBondContact O-CB 3.45Å; N857-N861 PolarHBondContact O-N 3.07Å; N857-N861 PolarHBondContact O-ND2 3.04Å
858	F	80.2	Confident	82.8	Confident	139 Å²	139	105.5 Å²	105.5	61%	0.61	52%	0.517	S	S	*	.	H	α-helix	trans	-63.6	-46.1	177.3	-169.6	-103.1	0	0	0	111.9	L854 R855 T860 N861 I862	L854-F858 WeakPolarHBondContact O-CB 3.17Å; L854-F858 PolarHBondContact O-N 3.47Å; R855-F858 PolarHBondContact O-N 3.25Å; F858-T860 VanDerWaalsContact C-N 3.33Å; F858-T860 PolarHBondContact O-N 3.44Å; F858-N861 PolarHBondContact O-N 3.3Å; F858-I862 HydrophobicContact CD1-CD1 3.71Å; F858-I862 HydrophobicContact CD1-CG1 4.49Å; F858-I862 HydrophobicContact CE1-CD1 3.32Å; F858-I862 HydrophobicContact CE1-CG1 4.28Å; F858-I862 HydrophobicContact CZ-CD1 3.95Å; F858-I862 WeakPolarHBondContact O-CG1 3.32Å; F858-I862 PolarHBondContact O-N 2.94Å
859	L	84.5	Confident	83	Confident	74 Å²	74	105.8 Å²	105.8	39%	0.387	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-37.3	175.9	-73.1	170.6	0	0	0	112.5	R855 N856 I862 R863	R855-L859 HydrophobicContact CG-CD1 4.05Å; R855-L859 WeakPolarHBondContact O-CB 3.22Å; R855-L859 WeakPolarHBondContact O-CG 3.34Å; R855-L859 PolarHBondContact O-N 3.16Å; N856-L859 PolarHBondContact O-N 3.02Å; L859-I862 PolarHBondContact O-N 2.77Å; L859-R863 PolarHBondContact O-N 3.18Å
860	T	86.3	Confident	83.2	Confident	69 Å²	69	103.6 Å²	103.6	42%	0.423	51%	0.513	S	S	.	.	H	α-helix	trans	-66	-43.6	176.1	-55.4	0	0	0	0	111.1	N856 N857 F858 I862 R863 I864	N856-T860 WeakPolarHBondContact O-CB 3.49Å; N856-T860 PolarHBondContact O-N 3.4Å; N856-T860 PolarHBondContact O-OG1 3.07Å; N857-T860 PolarHBondContact O-N 3.5Å; F858-T860 VanDerWaalsContact C-N 3.33Å; F858-T860 PolarHBondContact O-N 3.44Å; T860-I862 VanDerWaalsContact C-N 3.34Å; T860-I862 PolarHBondContact O-N 3.44Å; T860-R863 PolarHBondContact O-N 2.95Å; T860-I864 HydrophobicContact CG2-CD1 4.16Å; T860-I864 WeakPolarHBondContact O-CG1 3.21Å; T860-I864 PolarHBondContact O-N 2.92Å
861	N	82	Confident	83.6	Confident	104 Å²	104	102.2 Å²	102.2	56%	0.556	51%	0.509	S	S	*	.	H	α-helix	trans	-62.9	-39.1	175.3	-73.6	-27	0	0	0	112.3	N857 F858 I864 L865	N857-N861 WeakPolarHBondContact O-CB 3.45Å; N857-N861 PolarHBondContact O-N 3.07Å; N857-N861 PolarHBondContact O-ND2 3.04Å; F858-N861 PolarHBondContact O-N 3.3Å; N861-I864 PolarHBondContact O-N 2.75Å; N861-L865 WeakPolarHBondContact O-CB 3.36Å; N861-L865 PolarHBondContact O-N 3.04Å
862	I	82.5	Confident	83.8	Confident	84 Å²	84	102.7 Å²	102.7	43%	0.431	51%	0.511	S	S	.	.	H	α-helix	trans	-62.6	-44.1	173.6	-73.1	176.9	0	0	0	111.1	F858 L859 T860 I864 L865 S866	F858-I862 HydrophobicContact CD1-CD1 3.71Å; F858-I862 HydrophobicContact CD1-CG1 4.49Å; F858-I862 HydrophobicContact CE1-CD1 3.32Å; F858-I862 HydrophobicContact CE1-CG1 4.28Å; F858-I862 HydrophobicContact CZ-CD1 3.95Å; F858-I862 WeakPolarHBondContact O-CG1 3.32Å; F858-I862 PolarHBondContact O-N 2.94Å; L859-I862 PolarHBondContact O-N 2.77Å; T860-I862 VanDerWaalsContact C-N 3.34Å; T860-I862 PolarHBondContact O-N 3.44Å; I862-I864 VanDerWaalsContact C-N 3.35Å; I862-I864 PolarHBondContact O-N 3.45Å; I862-L865 PolarHBondContact O-N 2.74Å; I862-S866 WeakPolarHBondContact O-CB 3.23Å; I862-S866 PolarHBondContact O-N 2.99Å
863	R	85	Confident	83.9	Confident	189 Å²	189	103.9 Å²	103.9	71%	0.713	52%	0.518	S	S	*	.	H	α-helix	trans	-62.4	-39.6	176.5	-75.9	-178.4	-175.4	155.8	0.7	112.6	L859 T860 S866 S867	L859-R863 PolarHBondContact O-N 3.18Å; T860-R863 PolarHBondContact O-N 2.95Å; R863-S866 PolarHBondContact O-N 3.04Å; R863-S867 PolarHBondContact O-N 3.38Å
864	I	85.1	Confident	84	Confident	84 Å²	84	104.2 Å²	104.2	43%	0.431	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-40	175.6	-67	166.8	0	0	0	110.9	T860 N861 I862 S867 R868	T860-I864 HydrophobicContact CG2-CD1 4.16Å; T860-I864 WeakPolarHBondContact O-CG1 3.21Å; T860-I864 PolarHBondContact O-N 2.92Å; N861-I864 PolarHBondContact O-N 2.75Å; I862-I864 VanDerWaalsContact C-N 3.35Å; I862-I864 PolarHBondContact O-N 3.45Å; I864-S867 PolarHBondContact O-OG 3.29Å; I864-R868 WeakPolarHBondContact O-CG 3.32Å; I864-R868 PolarHBondContact O-N 3.49Å; I864-R868 VanDerWaalsContact O-N 3.14Å
865	L	82	Confident	84.3	Confident	112 Å²	112	106.7 Å²	106.7	59%	0.586	52%	0.518	S	S	*	.	H	α-helix	trans	-66	-42.7	176.7	-165.8	72.2	0	0	0	111.1	N861 I862 R868 I869	N861-L865 WeakPolarHBondContact O-CB 3.36Å; N861-L865 PolarHBondContact O-N 3.04Å; I862-L865 PolarHBondContact O-N 2.74Å; L865-R868 PolarHBondContact O-N 3.22Å; L865-I869 HydrophobicContact CG-CD1 4.31Å; L865-I869 WeakPolarHBondContact O-CG1 3.44Å; L865-I869 PolarHBondContact O-N 3.38Å
866	S	84.9	Confident	84.3	Confident	59 Å²	59	104.5 Å²	104.5	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-58.8	-48.1	175.4	-167.6	0	0	0	0	111.7	I862 R863 R868 I869 D870	I862-S866 WeakPolarHBondContact O-CB 3.23Å; I862-S866 PolarHBondContact O-N 2.99Å; R863-S866 PolarHBondContact O-N 3.04Å; S866-R868 VanDerWaalsContact C-N 3.27Å; S866-R868 PolarHBondContact O-N 3.38Å; S866-I869 PolarHBondContact O-N 3.06Å; S866-I869 VanDerWaalsContact O-N 3.13Å; S866-D870 PolarHBondContact O-N 2.85Å
867	S	85.8	Confident	84.3	Confident	70 Å²	70	103.4 Å²	103.4	49%	0.49	51%	0.513	S	S	.	.	H	α-helix	trans	-66.2	-30.3	-180	80	0	0	0	0	112.9	R863 I864 L871	R863-S867 PolarHBondContact O-N 3.38Å; I864-S867 PolarHBondContact O-OG 3.29Å; S867-L871 WeakPolarHBondContact O-CB 3.05Å; S867-L871 PolarHBondContact O-N 3.45Å
868	R	85.3	Confident	84.2	Confident	169 Å²	169	107 Å²	107	64%	0.638	52%	0.519	S	S	*	.	H	α-helix	trans	-69.9	-37.8	172.9	-78.1	-176.1	165.9	-164.4	-3	112.3	I864 L865 S866 L871 I872	I864-R868 WeakPolarHBondContact O-CG 3.32Å; I864-R868 PolarHBondContact O-N 3.49Å; I864-R868 VanDerWaalsContact O-N 3.14Å; L865-R868 PolarHBondContact O-N 3.22Å; S866-R868 VanDerWaalsContact C-N 3.27Å; S866-R868 PolarHBondContact O-N 3.38Å; R868-L871 PolarHBondContact O-N 3.27Å; R868-I872 VanDerWaalsContact O-CG1 3.28Å; R868-I872 WeakPolarHBondContact O-CG1 3.3Å; R868-I872 PolarHBondContact O-N 3.5Å
869	I	84.1	Confident	84.2	Confident	99 Å²	99	105.3 Å²	105.3	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-46.3	174.7	-69	166.5	0	0	0	109.8	L865 S866 L871 I872 D873	L865-I869 HydrophobicContact CG-CD1 4.31Å; L865-I869 WeakPolarHBondContact O-CG1 3.44Å; L865-I869 PolarHBondContact O-N 3.38Å; S866-I869 PolarHBondContact O-N 3.06Å; S866-I869 VanDerWaalsContact O-N 3.13Å; I869-L871 VanDerWaalsContact C-N 3.3Å; I869-L871 PolarHBondContact O-N 3.19Å; I869-I872 WeakPolarHBondContact O-CB 3.24Å; I869-I872 PolarHBondContact O-N 2.98Å; I869-I872 VanDerWaalsContact O-N 3.1Å; I869-D873 PolarHBondContact O-N 3.14Å
870	D	85.8	Confident	84	Confident	93 Å²	93	104.4 Å²	104.4	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-38	176.7	-66.4	-22.5	0	0	0	112.3	S866 D873 Q874	S866-D870 PolarHBondContact O-N 2.85Å; D870-D873 PolarHBondContact O-N 3.42Å; D870-Q874 WeakPolarHBondContact O-CG 3.28Å; D870-Q874 PolarHBondContact O-N 3.2Å
871	L	85.5	Confident	83.6	Confident	96 Å²	96	107.3 Å²	107.3	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-36.8	176.2	-161.6	91.8	0	0	0	112.2	S867 R868 I869 R875	S867-L871 WeakPolarHBondContact O-CB 3.05Å; S867-L871 PolarHBondContact O-N 3.45Å; R868-L871 PolarHBondContact O-N 3.27Å; I869-L871 VanDerWaalsContact C-N 3.3Å; I869-L871 PolarHBondContact O-N 3.19Å; L871-R875 WeakPolarHBondContact O-CG 3.45Å; L871-R875 PolarHBondContact O-N 3.37Å; L871-R875 VanDerWaalsContact O-N 3.14Å
872	I	84.5	Confident	83.4	Confident	99 Å²	99	108.6 Å²	108.6	51%	0.508	53%	0.529	S	S	.	.	H	α-helix	trans	-67.3	-43.6	175.4	-70.4	165.9	0	0	0	109.5	R868 I869 Q874 R875 I876	R868-I872 VanDerWaalsContact O-CG1 3.28Å; R868-I872 WeakPolarHBondContact O-CG1 3.3Å; R868-I872 PolarHBondContact O-N 3.5Å; I869-I872 WeakPolarHBondContact O-CB 3.24Å; I869-I872 PolarHBondContact O-N 2.98Å; I869-I872 VanDerWaalsContact O-N 3.1Å; I872-Q874 PolarHBondContact O-N 3.18Å; I872-R875 WeakPolarHBondContact O-CB 3.44Å; I872-R875 PolarHBondContact O-N 3.14Å; I872-R875 VanDerWaalsContact O-N 3.12Å; I872-I876 HydrophobicContact CG2-CD1 3.78Å; I872-I876 HydrophobicContact CG2-CG1 4.33Å; I872-I876 WeakPolarHBondContact O-CG1 3.3Å; I872-I876 PolarHBondContact O-N 3.4Å
873	D	84.9	Confident	83.1	Confident	97 Å²	97	109 Å²	109	52%	0.519	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-41.9	179.4	-162.4	47.3	0	0	0	112.1	I869 D870 R875 I876 T877	I869-D873 PolarHBondContact O-N 3.14Å; D870-D873 PolarHBondContact O-N 3.42Å; D873-R875 VanDerWaalsContact C-N 3.32Å; D873-R875 PolarHBondContact O-N 3.31Å; D873-I876 PolarHBondContact O-N 3.46Å; D873-T877 WeakPolarHBondContact O-CB 3.43Å; D873-T877 PolarHBondContact O-N 3.23Å; D873-T877 PolarHBondContact O-OG1 3.49Å
874	Q	85.1	Confident	82.6	Confident	112 Å²	112	106 Å²	106	52%	0.523	53%	0.529	S	S	.	.	H	α-helix	trans	-61.2	-37.6	171.7	-76	-174	6.3	0	0	112.9	D870 I872 R878	D870-Q874 WeakPolarHBondContact O-CG 3.28Å; D870-Q874 PolarHBondContact O-N 3.2Å; I872-Q874 PolarHBondContact O-N 3.18Å; Q874-R878 WeakPolarHBondContact O-CG 3.33Å; Q874-R878 PolarHBondContact O-N 3.23Å
875	R	84.9	Confident	81.8	Confident	167 Å²	167	109.4 Å²	109.4	63%	0.63	54%	0.542	S	S	*	.	H	α-helix	trans	-69.3	-43.6	176.5	-82.7	-176.5	172.4	-165.7	-2	111.8	L871 I872 D873 T877 R878 I879	L871-R875 WeakPolarHBondContact O-CG 3.45Å; L871-R875 PolarHBondContact O-N 3.37Å; L871-R875 VanDerWaalsContact O-N 3.14Å; I872-R875 WeakPolarHBondContact O-CB 3.44Å; I872-R875 PolarHBondContact O-N 3.14Å; I872-R875 VanDerWaalsContact O-N 3.12Å; D873-R875 VanDerWaalsContact C-N 3.32Å; D873-R875 PolarHBondContact O-N 3.31Å; R875-T877 VanDerWaalsContact C-N 3.29Å; R875-T877 PolarHBondContact O-N 3.37Å; R875-R878 PolarHBondContact O-N 3.17Å; R875-I879 VanDerWaalsContact O-CG1 3.29Å; R875-I879 WeakPolarHBondContact O-CG1 3.1Å; R875-I879 PolarHBondContact O-N 2.86Å
876	I	83.4	Confident	80.8	Confident	101 Å²	101	109.4 Å²	109.4	52%	0.518	54%	0.539	S	S	.	.	H	α-helix	trans	-60.1	-44.3	175.7	-68.5	170.8	0	0	0	109.7	I872 D873 R878 I879 A880	I872-I876 HydrophobicContact CG2-CD1 3.78Å; I872-I876 HydrophobicContact CG2-CG1 4.33Å; I872-I876 WeakPolarHBondContact O-CG1 3.3Å; I872-I876 PolarHBondContact O-N 3.4Å; D873-I876 PolarHBondContact O-N 3.46Å; I876-R878 PolarHBondContact O-N 3.28Å; I876-I879 PolarHBondContact O-N 3.19Å; I876-A880 WeakPolarHBondContact O-CB 3.42Å; I876-A880 PolarHBondContact O-N 3.32Å
877	T	85.1	Confident	79.4	Confident	65 Å²	65	112.9 Å²	112.9	40%	0.399	55%	0.553	S	S	.	*	H	α-helix	trans	-62.6	-41.7	177.8	-51.3	0	0	0	0	112.3	D873 R875 A880 Q881	D873-T877 WeakPolarHBondContact O-CB 3.43Å; D873-T877 PolarHBondContact O-N 3.23Å; D873-T877 PolarHBondContact O-OG1 3.49Å; R875-T877 VanDerWaalsContact C-N 3.29Å; R875-T877 PolarHBondContact O-N 3.37Å; T877-A880 PolarHBondContact O-N 3.01Å; T877-Q881 WeakPolarHBondContact O-CG 3.45Å; T877-Q881 PolarHBondContact O-N 3.45Å
878	R	81.3	Confident	77.9	Confident	165 Å²	165	116.6 Å²	116.6	62%	0.623	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-39.3	174.2	-76.6	-170.9	-152.1	169.1	7.1	112.9	Q874 R875 I876 A880 Q881 F882	Q874-R878 WeakPolarHBondContact O-CG 3.33Å; Q874-R878 PolarHBondContact O-N 3.23Å; R875-R878 PolarHBondContact O-N 3.17Å; I876-R878 PolarHBondContact O-N 3.28Å; R878-A880 VanDerWaalsContact C-N 3.33Å; R878-Q881 PolarHBondContact O-N 2.74Å; R878-F882 VanDerWaalsContact O-CB 3.31Å; R878-F882 WeakPolarHBondContact O-CB 3.43Å; R878-F882 PolarHBondContact O-N 2.84Å
879	I	80.7	Confident	76.2	Confident	103 Å²	103	116.9 Å²	116.9	53%	0.528	57%	0.574	S	S	.	*	H	α-helix	trans	-64.2	-43	176.2	-69	166.3	0	0	0	109.6	R875 I876 Q881 F882 I883	R875-I879 VanDerWaalsContact O-CG1 3.29Å; R875-I879 WeakPolarHBondContact O-CG1 3.1Å; R875-I879 PolarHBondContact O-N 2.86Å; I876-I879 PolarHBondContact O-N 3.19Å; I879-Q881 PolarHBondContact O-N 2.81Å; I879-F882 PolarHBondContact O-N 3.28Å; I879-I883 HydrophobicContact CG2-CD1 3.73Å; I879-I883 HydrophobicContact CG2-CG1 4.36Å; I879-I883 VanDerWaalsContact O-CG1 3.26Å; I879-I883 WeakPolarHBondContact O-CG1 3.39Å; I879-I883 PolarHBondContact O-N 3.34Å
880	A	78.9	Confident	74.1	Confident	56 Å²	56	121.7 Å²	121.7	46%	0.463	59%	0.594	S	S	.	*	H	α-helix	trans	-61.4	-43.4	175.1	0	0	0	0	0	112.2	I876 T877 R878 I883 N884	I876-A880 WeakPolarHBondContact O-CB 3.42Å; I876-A880 PolarHBondContact O-N 3.32Å; T877-A880 PolarHBondContact O-N 3.01Å; R878-A880 VanDerWaalsContact C-N 3.33Å; A880-I883 PolarHBondContact O-N 3.06Å; A880-N884 PolarHBondContact O-N 3.28Å
881	Q	79.3	Confident	72.1	Confident	129 Å²	129	125.9 Å²	125.9	60%	0.603	61%	0.61	S	S	*	*	H	α-helix	trans	-63.9	-39.5	174.3	-74.6	177	-15.1	0	0	112.4	T877 R878 I879 N884 H885	T877-Q881 WeakPolarHBondContact O-CG 3.45Å; T877-Q881 PolarHBondContact O-N 3.45Å; R878-Q881 PolarHBondContact O-N 2.74Å; I879-Q881 PolarHBondContact O-N 2.81Å; Q881-N884 PolarHBondContact O-N 2.9Å; Q881-H885 WeakPolarHBondContact O-CB 3.5Å; Q881-H885 PolarHBondContact O-N 3.17Å
882	F	76.6	Confident	70	Confident	132 Å²	132	129.9 Å²	129.9	58%	0.579	63%	0.629	S	S	*	*	H	α-helix	trans	-66.4	-43.5	177.9	-167.9	-92.9	0	0	0	111.6	R878 I879 N884 H885 H886	R878-F882 VanDerWaalsContact O-CB 3.31Å; R878-F882 WeakPolarHBondContact O-CB 3.43Å; R878-F882 PolarHBondContact O-N 2.84Å; I879-F882 PolarHBondContact O-N 3.28Å; F882-N884 VanDerWaalsContact C-N 3.34Å; F882-N884 PolarHBondContact O-N 3.37Å; F882-H885 PolarHBondContact O-N 3.01Å; F882-H886 AromaticContact CE1-CD2 3.47Å; F882-H886 VanDerWaalsContact CE1-CD2 3.47Å; F882-H886 WeakPolarHBondContact CE1-CD2 3.48Å; F882-H886 AromaticContact CE2-CD2 3.65Å; F882-H886 AromaticContact CE2-NE2 3.85Å; F882-H886 AromaticContact CZ-CD2 3.26Å; F882-H886 WeakPolarHBondContact CZ-CD2 3.34Å; F882-H886 AromaticContact CZ-NE2 3.45Å; F882-H886 WeakPolarHBondContact CZ-NE2 3.34Å; F882-H886 WeakPolarHBondContact O-CB 3.2Å; F882-H886 PolarHBondContact O-N 2.86Å
883	I	77	Confident	67.7	Low	91 Å²	91	135.4 Å²	135.4	47%	0.467	65%	0.649	S	S	.	*	H	α-helix	trans	-62.1	-42.4	175.3	-67.8	167.7	0	0	0	110.4	I879 A880 N887	I879-I883 HydrophobicContact CG2-CD1 3.73Å; I879-I883 HydrophobicContact CG2-CG1 4.36Å; I879-I883 VanDerWaalsContact O-CG1 3.26Å; I879-I883 WeakPolarHBondContact O-CG1 3.39Å; I879-I883 PolarHBondContact O-N 3.34Å; A880-I883 PolarHBondContact O-N 3.06Å; I883-N887 WeakPolarHBondContact O-CB 3.08Å; I883-N887 PolarHBondContact O-N 3.33Å; I883-N887 VanDerWaalsContact O-N 3.11Å
884	N	74.4	Confident	65.6	Low	128 Å²	128	134 Å²	134	68%	0.684	66%	0.658	S	S	*	*	H	α-helix	trans	-67.4	-35.5	177.4	-113.5	0.9	0	0	0	112.9	A880 Q881 F882	A880-N884 PolarHBondContact O-N 3.28Å; Q881-N884 PolarHBondContact O-N 2.9Å; F882-N884 VanDerWaalsContact C-N 3.34Å; F882-N884 PolarHBondContact O-N 3.37Å
885	H	67.9	Low	63.2	Low	154 Å²	154	140.6 Å²	140.6	71%	0.713	70%	0.695	S	S	*	*	H	α-helix	trans	-76.9	-31.4	179.6	-156.8	-38.2	0	0	0	112.5	Q881 F882	Q881-H885 WeakPolarHBondContact O-CB 3.5Å; Q881-H885 PolarHBondContact O-N 3.17Å; F882-H885 PolarHBondContact O-N 3.01Å
886	H	61.3	Low	62.1	Low	113 Å²	113	139.3 Å²	139.3	52%	0.523	70%	0.698	S	S	.	*	H	α-helix	trans	-86.4	-20.4	-179.5	-98	-76.2	0	0	0	114.8	F882 N888 K889	F882-H886 AromaticContact CE1-CD2 3.47Å; F882-H886 VanDerWaalsContact CE1-CD2 3.47Å; F882-H886 WeakPolarHBondContact CE1-CD2 3.48Å; F882-H886 AromaticContact CE2-CD2 3.65Å; F882-H886 AromaticContact CE2-NE2 3.85Å; F882-H886 AromaticContact CZ-CD2 3.26Å; F882-H886 WeakPolarHBondContact CZ-CD2 3.34Å; F882-H886 AromaticContact CZ-NE2 3.45Å; F882-H886 WeakPolarHBondContact CZ-NE2 3.34Å; F882-H886 WeakPolarHBondContact O-CB 3.2Å; F882-H886 PolarHBondContact O-N 2.86Å; H886-N888 PolarHBondContact O-N 3.29Å; H886-K889 PolarHBondContact O-N 3.16Å
887	N	56.2	Low	61	Low	131 Å²	131	141.3 Å²	141.3	70%	0.701	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-8.6	174.4	-87.6	-11	0	0	0	114.4	I883	I883-N887 WeakPolarHBondContact O-CB 3.08Å; I883-N887 PolarHBondContact O-N 3.33Å; I883-N887 VanDerWaalsContact O-N 3.11Å
888	N	54.6	Low	59.7	Low	148 Å²	148	145.6 Å²	145.6	79%	0.791	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	4.6	179.4	-94.1	-12.7	0	0	0	115.5	H886	H886-N888 PolarHBondContact O-N 3.29Å
889	K	48.8	Very low	58.4	Low	176 Å²	176	144.4 Å²	144.4	77%	0.765	73%	0.731	S	S	*	*			trans	-135.5	105.5	172.1	-78.9	-173.2	175.4	-177.6	0	111.5	H886 E891	H886-K889 PolarHBondContact O-N 3.16Å; K889-E891 PolarHBondContact O-N 3.28Å
890	Q	41.1	Very low	57	Low	199 Å²	199	147 Å²	147	93%	0.93	74%	0.744	S	S	*	*			trans	-57.4	102.8	156.4	-82	179.1	-37.1	0	0	108.6
891	E	42.6	Very low	55.5	Low	182 Å²	182	153.1 Å²	153.1	85%	0.85	76%	0.762	S	S	*	*			trans	173.5	100.3	149.1	-101.3	174.9	-174	0	0	109.1	K889	K889-E891 PolarHBondContact O-N 3.28Å
892	M	40.7	Very low	53.8	Low	179 Å²	179	154.8 Å²	154.8	88%	0.882	77%	0.774	S	S	*	*				169.4	113.3	114.6	-90.1	-146	-93.1	0	0	110.9
893	K	36.5	Very low	52.1	Low	216 Å²	216	156.5 Å²	156.5	94%	0.939	79%	0.789	S	S	*	*			trans	-62.8	126.5	147.1	-73.7	173.4	171.1	176.9	0	107.5
894	G	41.5	Very low	50	Low	68 Å²	68	162 Å²	162	70%	0.701	82%	0.816	S	S	*	*			trans	138.7	52.5	163.6	0	0	0	0	0	117.7
895	L	34.9	Very low	47.8	Very low	250 Å²	250	165.1 Å²	165.1	100%	1.309	83%	0.828	S	S	*	*			trans	-173.4	0	151.6	-102.2	150.6	0	0	0	107.2

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