A0A077ZMT9_TRITR Loading...

DUF1758 and DUF1759 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZMT9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 825 aa.

						>A0A077ZMT9_TRITR|A0A077ZMT9
MSAKKLLNQRECLKGGVERLLSEMKEHACAGQHALVRRTMELLDTYLVQCREVQYELQGHLQPEEVQTEVSNWMSFELAVVEAKAQIDSLQPESKGLPLFAAESQEPKGPLHGPHLPKWNLPVFDGNVLEFVAFWDQFEAGVHSRQELSDATKFVYLKSALKGAAWEAVTGLSLTSANYAVAVDILKNRFGRPDLIIQNHIVSLLDLQPCAQGSAERLRHLHDKLTWHVRALCAMGKNPAGQMTAAEVLLAIFKLKMPHFLRKKWENDVFTRKEEVTLDSFFEFLRTQVEVEESVKGTSGTYQKPFNVPYLKQNTGRERIATTSMLQTSVSPEIHLCPICSTDGHHFAQCPVFLKMNVKQRWRTVKEQRVCFICLQKGHSSARCEAQNGRCTITGCKQLHHQLLHYGKVDKRSYNGVSPKKESLSDNQHRTADRELHIGVAKTNDGKVILQTAQAKLIGPNGSKALVMCLLDVGSQRSFVRKDLADNLGLKGPNEYISILTFGNRHGRQEVARSVEFCLTPVAQGKPRKWIKALCVPQICGPLDANPPFSKMWKHLPKYNLSDQFPRGTKEVDVLIGADYYYDFVGNEVRKNAADEPVGVQSIFGWILCGKTGRTMEEVSTTLTCQISEEESVNVLLRQFWQLDAIGIIPEENNGSSRAERYCLKRPIQFNGERYVVPLPWKFKPKLPNNYPYALQRLKKLERQMEKKPNERRMYIAAMQEYIDKGWVEEVHPSVEEGKVWYLPHHAVIRGTDSMKKCRVVFDGSASYQGLSLNDLLNPGSALQNDLVGILLRYRRLRFAVQADVEAMFLQTELQQEDRDFVCFL
					

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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	58.7	Low	84.9	Confident	96 Å²	96	75.1 Å²	75.1	47%	0.473	38%	0.38	S	S	.	.				0	170.6	0	-81.5	-169.7	-95.5	0	0	108.5	K5 L6 H60	M1-K5 HydrophobicContact CG-CD 4.4Å; M1-K5 HydrophobicContact SD-CD 3.66Å; M1-K5 HydrophobicContact SD-CG 4.27Å; M1-L6 HydrophobicContact CB-CD1 4.43Å; M1-L6 HydrophobicContact CB-CD2 4.36Å; M1-L6 HydrophobicContact CB-CG 4.08Å; M1-L6 HydrophobicContact CE-CD2 3.84Å; M1-H60 PolarHBondContact N-NE2 2.92Å; M1-H60 PolarHBondContact O-CD2 3.43Å; M1-H60 PolarHBondContact O-NE2 3.5Å
2	S	78.2	Confident	85.5	Confident	78 Å²	78	77.1 Å²	77.1	55%	0.545	40%	0.404	S	S	.	.			trans	-67.1	140.8	170.8	75.9	0	0	0	0	109.3	K4 K5 L6	S2-K4 PolarHBondContact O-N 2.79Å; S2-K4 VanDerWaalsContact O-N 3.12Å; S2-K5 WeakPolarHBondContact O-CB 3.35Å; S2-K5 PolarHBondContact O-N 3.27Å; S2-K5 PolarHBondContact OG-N 3.02Å; S2-L6 PolarHBondContact O-N 3.47Å
3	A	83.4	Confident	86.2	Confident	30 Å²	30	72.8 Å²	72.8	25%	0.248	38%	0.382	C	S	.	.	H	α-helix	trans	-51.2	-37.5	178.2	0	0	0	0	0	111.7	K5 L6 L7 L57 H60 L61	A3-K5 VanDerWaalsContact C-N 3.33Å; A3-K5 PolarHBondContact O-N 2.83Å; A3-L6 PolarHBondContact O-N 3.11Å; A3-L7 WeakPolarHBondContact O-CB 3.2Å; A3-L7 PolarHBondContact O-N 3.49Å; A3-L57 HydrophobicContact CB-CD1 4.15Å; A3-L57 WeakPolarHBondContact O-CD1 3.34Å; A3-H60 HydrophobicContact CB-CB 4.13Å; A3-L61 HydrophobicContact CB-CD2 4.35Å
4	K	84.9	Confident	86.7	Confident	156 Å²	156	69 Å²	69	68%	0.678	36%	0.36	S	S	*	.	H	α-helix	trans	-59	-37.5	174.8	-168.3	173.6	-176.2	175.2	0	113.8	S2 N8	S2-K4 PolarHBondContact O-N 2.79Å; S2-K4 VanDerWaalsContact O-N 3.12Å; K4-N8 PolarHBondContact O-N 3.27Å; K4-N8 VanDerWaalsContact O-N 3.11Å
5	K	86.2	Confident	87.1	Confident	121 Å²	121	66.3 Å²	66.3	53%	0.526	36%	0.356	S	S	.	.	H	α-helix	trans	-71.7	-41.2	177.9	-171.2	178.8	174.3	-167.1	0	111.3	M1 S2 A3 N8 Q9	M1-K5 HydrophobicContact CG-CD 4.4Å; M1-K5 HydrophobicContact SD-CD 3.66Å; M1-K5 HydrophobicContact SD-CG 4.27Å; S2-K5 WeakPolarHBondContact O-CB 3.35Å; S2-K5 PolarHBondContact O-N 3.27Å; S2-K5 PolarHBondContact OG-N 3.02Å; A3-K5 VanDerWaalsContact C-N 3.33Å; A3-K5 PolarHBondContact O-N 2.83Å; K5-N8 PolarHBondContact O-N 3.19Å; K5-Q9 WeakPolarHBondContact O-CB 3.38Å; K5-Q9 PolarHBondContact O-N 3.18Å
6	L	90.1	Very high	87.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-42.6	175.9	-70.4	170.7	0	0	0	111.5	M1 S2 A3 Q9 R10 V53 E56 L57	M1-L6 HydrophobicContact CB-CD1 4.43Å; M1-L6 HydrophobicContact CB-CD2 4.36Å; M1-L6 HydrophobicContact CB-CG 4.08Å; M1-L6 HydrophobicContact CE-CD2 3.84Å; S2-L6 PolarHBondContact O-N 3.47Å; A3-L6 PolarHBondContact O-N 3.11Å; L6-Q9 PolarHBondContact O-N 2.8Å; L6-R10 WeakPolarHBondContact O-CB 3.39Å; L6-R10 PolarHBondContact O-N 2.81Å; L6-V53 HydrophobicContact CB-CG1 4.47Å; L6-V53 HydrophobicContact CD2-CG1 4.22Å; L6-V53 WeakPolarHBondContact O-CG1 3.17Å; L6-E56 HydrophobicContact CD1-CB 4.25Å; L6-E56 HydrophobicContact CD1-CG 3.85Å; L6-E56 HydrophobicContact CD2-CB 4.28Å; L6-E56 HydrophobicContact CD2-CG 4.15Å; L6-L57 HydrophobicContact CB-CB 4.2Å; L6-L57 HydrophobicContact CB-CD1 3.81Å
7	L	89.1	Confident	88	Confident	65 Å²	65	59.1 Å²	59.1	34%	0.34	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-50.9	174.2	-164.6	88.9	0	0	0	110.9	A3 Q9 R10 E11 L57	A3-L7 WeakPolarHBondContact O-CB 3.2Å; A3-L7 PolarHBondContact O-N 3.49Å; L7-Q9 VanDerWaalsContact C-N 3.3Å; L7-Q9 PolarHBondContact O-N 2.99Å; L7-R10 PolarHBondContact O-N 2.96Å; L7-E11 WeakPolarHBondContact O-CG 3.49Å; L7-E11 PolarHBondContact O-N 3.21Å; L7-L57 HydrophobicContact CB-CD1 4.46Å; L7-L57 HydrophobicContact CD1-CD2 3.86Å
8	N	89.6	Confident	88.4	Confident	103 Å²	103	61.8 Å²	61.8	55%	0.551	33%	0.331	S	S	*	.	H	α-helix	trans	-59.7	-39.8	176.8	-78.6	-4.9	0	0	0	112.7	K4 K5 C12	K4-N8 PolarHBondContact O-N 3.27Å; K4-N8 VanDerWaalsContact O-N 3.11Å; K5-N8 PolarHBondContact O-N 3.19Å; N8-C12 WeakPolarHBondContact O-CB 3.37Å; N8-C12 PolarHBondContact O-N 3.45Å
9	Q	90.9	Very high	88.7	Confident	80 Å²	80	67.4 Å²	67.4	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-65.5	-43.3	177.9	-176.3	176	-9.2	0	0	111.4	K5 L6 L7 C12 L13 V53	K5-Q9 WeakPolarHBondContact O-CB 3.38Å; K5-Q9 PolarHBondContact O-N 3.18Å; L6-Q9 PolarHBondContact O-N 2.8Å; L7-Q9 VanDerWaalsContact C-N 3.3Å; L7-Q9 PolarHBondContact O-N 2.99Å; Q9-C12 WeakPolarHBondContact O-CB 3.48Å; Q9-C12 PolarHBondContact O-N 3.3Å; Q9-L13 WeakPolarHBondContact O-CG 3.27Å; Q9-L13 PolarHBondContact O-N 2.86Å; Q9-V53 HydrophobicContact CB-CG1 4.29Å; Q9-V53 HydrophobicContact CG-CG1 4.33Å; Q9-V53 HydrophobicContact CG-CG2 4.14Å
10	R	92.2	Very high	89	Confident	10 Å²	10	64.8 Å²	64.8	4%	0.038	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-46.4	176	-171.5	-162.1	68.8	-155.6	2.8	111.6	L6 L7 C12 L13 K14 V53 E69 W73	L6-R10 WeakPolarHBondContact O-CB 3.39Å; L6-R10 PolarHBondContact O-N 2.81Å; L7-R10 PolarHBondContact O-N 2.96Å; R10-C12 VanDerWaalsContact C-N 3.26Å; R10-C12 PolarHBondContact O-N 2.8Å; R10-L13 PolarHBondContact O-N 3.14Å; R10-L13 VanDerWaalsContact O-N 3.13Å; R10-K14 HydrophobicContact CG-CG 4.47Å; R10-K14 WeakPolarHBondContact O-CG 3.49Å; R10-K14 PolarHBondContact O-N 2.94Å; R10-V53 HydrophobicContact CB-CG1 3.9Å; R10-E69 IonicContact CZ-OE1 3.15Å; R10-E69 IonicContact CZ-OE2 3.77Å; R10-E69 IonicContact NH1-OE1 3.75Å; R10-E69 PolarHBondContact NH1-OE1 2.98Å; R10-E69 IonicContact NH1-OE2 2.64Å; R10-E69 PolarHBondContact NH1-OE2 3.39Å; R10-E69 IonicContact NH2-OE1 2.82Å; R10-E69 IonicContact NH2-OE2 3.96Å; R10-E69 PolarHBondContact NH2-OE2 2.91Å; R10-W73 HydrophobicContact CG-CZ3 4.1Å
11	E	91.1	Very high	89.2	Confident	87 Å²	87	62.6 Å²	62.6	41%	0.407	32%	0.322	S	S	.	.	H	α-helix	trans	-62.2	-34.9	178.3	-67.6	-51.6	126.9	0	0	111.9	L7 K14 G15	L7-E11 WeakPolarHBondContact O-CG 3.49Å; L7-E11 PolarHBondContact O-N 3.21Å; E11-K14 PolarHBondContact O-N 3.06Å; E11-K14 IonicContact OE1-NZ 3.55Å; E11-G15 PolarHBondContact O-N 3.02Å
12	C	92.2	Very high	90.8	Very high	99 Å²	99	61.5 Å²	61.5	67%	0.669	32%	0.324	S	S	*	.	H	α-helix	trans	-63.7	-44.2	172.3	-175.6	0	0	0	0	112.4	N8 Q9 R10 G15 G16	N8-C12 WeakPolarHBondContact O-CB 3.37Å; N8-C12 PolarHBondContact O-N 3.45Å; Q9-C12 WeakPolarHBondContact O-CB 3.48Å; Q9-C12 PolarHBondContact O-N 3.3Å; R10-C12 VanDerWaalsContact C-N 3.26Å; R10-C12 PolarHBondContact O-N 2.8Å; C12-G15 PolarHBondContact O-N 3.34Å; C12-G16 PolarHBondContact O-N 3.35Å; C12-G16 VanDerWaalsContact O-N 3.14Å
13	L	94	Very high	91.5	Very high	22 Å²	22	61.5 Å²	61.5	12%	0.115	32%	0.315	C	S	.	.	H	α-helix	trans	-66.9	-41.1	176.9	-69.8	169.5	0	0	0	112	Q9 R10 G15 G16 V17 Y46 Q49 C50 V53	Q9-L13 WeakPolarHBondContact O-CG 3.27Å; Q9-L13 PolarHBondContact O-N 2.86Å; R10-L13 PolarHBondContact O-N 3.14Å; R10-L13 VanDerWaalsContact O-N 3.13Å; L13-G15 PolarHBondContact O-N 3.4Å; L13-G16 WeakPolarHBondContact O-CA 3.45Å; L13-G16 PolarHBondContact O-N 3.06Å; L13-V17 WeakPolarHBondContact O-CG2 3.44Å; L13-V17 PolarHBondContact O-N 3.19Å; L13-Y46 HydrophobicContact CD2-CD1 4.07Å; L13-Y46 HydrophobicContact CD2-CE1 4.21Å; L13-Q49 HydrophobicContact CD1-CB 4.07Å; L13-Q49 HydrophobicContact CD2-CB 4.35Å; L13-C50 WeakPolarHBondContact CB-SG 3.39Å; L13-V53 HydrophobicContact CD1-CG2 3.92Å
14	K	93.6	Very high	91.9	Very high	19 Å²	19	60 Å²	60	8%	0.083	30%	0.303	C	S	.	.	H	α-helix	trans	-57.1	-47.4	173.4	-77.1	-172.2	171.7	179.6	0	111.6	R10 E11 G16 V17 E18 W73 F76	R10-K14 HydrophobicContact CG-CG 4.47Å; R10-K14 WeakPolarHBondContact O-CG 3.49Å; R10-K14 PolarHBondContact O-N 2.94Å; E11-K14 PolarHBondContact O-N 3.06Å; E11-K14 IonicContact OE1-NZ 3.55Å; K14-G16 PolarHBondContact O-N 3.24Å; K14-V17 WeakPolarHBondContact O-CB 3.48Å; K14-V17 PolarHBondContact O-N 2.98Å; K14-E18 WeakPolarHBondContact O-CG 3.36Å; K14-E18 PolarHBondContact O-N 2.77Å; K14-W73 HydrophobicContact CD-CZ3 4.38Å; K14-W73 HydrophobicContact CG-CZ3 4.19Å; K14-F76 HydrophobicContact CB-CE2 3.95Å; K14-F76 HydrophobicContact CB-CZ 3.99Å; K14-F76 HydrophobicContact CD-CD2 3.98Å; K14-F76 HydrophobicContact CD-CE2 4.05Å; K14-F76 HydrophobicContact CD-CG 4.22Å; K14-F76 HydrophobicContact CD-CZ 4.35Å; K14-F76 HydrophobicContact CG-CD1 4.36Å; K14-F76 HydrophobicContact CG-CD2 4.2Å; K14-F76 HydrophobicContact CG-CE1 3.98Å; K14-F76 HydrophobicContact CG-CE2 3.79Å; K14-F76 HydrophobicContact CG-CG 4.46Å; K14-F76 HydrophobicContact CG-CZ 3.67Å
15	G	92.8	Very high	92.1	Very high	28 Å²	28	57.2 Å²	57.2	29%	0.289	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-30.6	174.7	0	0	0	0	0	113	E11 C12 L13 R19	E11-G15 PolarHBondContact O-N 3.02Å; C12-G15 PolarHBondContact O-N 3.34Å; L13-G15 PolarHBondContact O-N 3.4Å; G15-R19 WeakPolarHBondContact O-CB 3.37Å; G15-R19 PolarHBondContact O-N 2.9Å; G15-R19 VanDerWaalsContact O-N 3.12Å
16	G	93.6	Very high	92.3	Very high	11 Å²	11	58 Å²	58	11%	0.113	30%	0.297	C	S	.	.	H	α-helix	trans	-65.3	-46.9	170.3	0	0	0	0	0	112.9	C12 L13 K14 R19 L20	C12-G16 PolarHBondContact O-N 3.35Å; C12-G16 VanDerWaalsContact O-N 3.14Å; L13-G16 WeakPolarHBondContact O-CA 3.45Å; L13-G16 PolarHBondContact O-N 3.06Å; K14-G16 PolarHBondContact O-N 3.24Å; G16-R19 PolarHBondContact O-N 2.78Å; G16-L20 WeakPolarHBondContact O-CG 3.07Å; G16-L20 PolarHBondContact O-N 3.13Å
17	V	96.1	Very high	92.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-46.9	175.7	173.5	0	0	0	0	111.1	L13 K14 R19 L20 L21 L43 L47 F76 V80	L13-V17 WeakPolarHBondContact O-CG2 3.44Å; L13-V17 PolarHBondContact O-N 3.19Å; K14-V17 WeakPolarHBondContact O-CB 3.48Å; K14-V17 PolarHBondContact O-N 2.98Å; V17-R19 VanDerWaalsContact C-N 3.34Å; V17-R19 PolarHBondContact O-N 2.92Å; V17-L20 PolarHBondContact O-N 3.33Å; V17-L21 HydrophobicContact CG1-CD1 4.22Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 2.96Å; V17-L43 HydrophobicContact CB-CD1 4.27Å; V17-L43 HydrophobicContact CG1-CD1 3.69Å; V17-L47 HydrophobicContact CG1-CD2 3.94Å; V17-L47 HydrophobicContact CG2-CD2 4.04Å; V17-L47 HydrophobicContact CG2-CG 4.41Å; V17-F76 HydrophobicContact CB-CZ 3.95Å; V17-F76 HydrophobicContact CG1-CE1 4.44Å; V17-F76 HydrophobicContact CG1-CZ 3.75Å; V17-F76 HydrophobicContact CG2-CZ 4.37Å; V17-V80 HydrophobicContact CG1-CG2 3.79Å
18	E	94.1	Very high	92.2	Very high	108 Å²	108	56.8 Å²	56.8	51%	0.505	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-37.9	179.6	-71.1	173.9	174.7	0	0	112.7	K14 S22 F76	K14-E18 WeakPolarHBondContact O-CG 3.36Å; K14-E18 PolarHBondContact O-N 2.77Å; E18-S22 PolarHBondContact O-N 2.93Å; E18-S22 PolarHBondContact O-OG 2.97Å; E18-S22 VanDerWaalsContact O-OG 3.04Å; E18-F76 HydrophobicContact CG-CE2 4.36Å
19	R	93.9	Very high	92.1	Very high	167 Å²	167	56.3 Å²	56.3	63%	0.63	29%	0.293	S	S	*	.	H	α-helix	trans	-64.9	-45.8	173.9	-172.2	-179.8	-63.4	137.2	3.4	111.4	G15 G16 V17 L21 S22 E23	G15-R19 WeakPolarHBondContact O-CB 3.37Å; G15-R19 PolarHBondContact O-N 2.9Å; G15-R19 VanDerWaalsContact O-N 3.12Å; G16-R19 PolarHBondContact O-N 2.78Å; V17-R19 VanDerWaalsContact C-N 3.34Å; V17-R19 PolarHBondContact O-N 2.92Å; R19-L21 VanDerWaalsContact C-N 3.34Å; R19-L21 PolarHBondContact O-N 2.74Å; R19-S22 WeakPolarHBondContact O-CB 3.4Å; R19-S22 PolarHBondContact O-N 2.81Å; R19-E23 PolarHBondContact O-N 2.77Å
20	L	95	Very high	91.8	Very high	15 Å²	15	55.6 Å²	55.6	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-40.9	178.2	-71.3	170.9	0	0	0	111.7	G16 V17 S22 E23 M24 T39 L42 L43 Y46	G16-L20 WeakPolarHBondContact O-CG 3.07Å; G16-L20 PolarHBondContact O-N 3.13Å; V17-L20 PolarHBondContact O-N 3.33Å; L20-S22 VanDerWaalsContact C-N 3.35Å; L20-S22 PolarHBondContact O-N 2.83Å; L20-E23 PolarHBondContact O-N 3.42Å; L20-M24 WeakPolarHBondContact O-CB 3.49Å; L20-M24 WeakPolarHBondContact O-CG 3.47Å; L20-M24 PolarHBondContact O-N 3.14Å; L20-T39 HydrophobicContact CB-CG2 4.38Å; L20-T39 HydrophobicContact CD2-CG2 3.78Å; L20-L42 HydrophobicContact CD1-CD2 4.45Å; L20-L42 HydrophobicContact CD1-CG 4.12Å; L20-L42 HydrophobicContact CD2-CD2 3.77Å; L20-L42 HydrophobicContact CD2-CG 4.28Å; L20-L43 HydrophobicContact CB-CD1 3.8Å; L20-L43 HydrophobicContact CD1-CB 4.43Å; L20-L43 HydrophobicContact CD1-CD1 4.29Å; L20-Y46 HydrophobicContact CD1-CD2 3.93Å; L20-Y46 HydrophobicContact CD1-CE2 4.32Å; L20-Y46 HydrophobicContact CD1-CG 4.15Å
21	L	94.4	Very high	91.5	Very high	20 Å²	20	57 Å²	57	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-62.3	-41.5	174.8	-74.8	172.3	0	0	0	112.1	V17 R19 M24 K25 L43 V80 A83 K84 I87	V17-L21 HydrophobicContact CG1-CD1 4.22Å; V17-L21 WeakPolarHBondContact O-CG 3.33Å; V17-L21 PolarHBondContact O-N 2.96Å; R19-L21 VanDerWaalsContact C-N 3.34Å; R19-L21 PolarHBondContact O-N 2.74Å; L21-M24 PolarHBondContact O-N 3.23Å; L21-K25 PolarHBondContact O-N 2.9Å; L21-L43 HydrophobicContact CD2-CD1 4.27Å; L21-L43 HydrophobicContact CD2-CD2 3.64Å; L21-L43 HydrophobicContact CG-CD1 4Å; L21-L43 HydrophobicContact CG-CD2 4.29Å; L21-V80 HydrophobicContact CD1-CB 4.47Å; L21-V80 HydrophobicContact CD1-CG1 4.4Å; L21-V80 HydrophobicContact CD1-CG2 4.12Å; L21-A83 HydrophobicContact CD1-CB 3.86Å; L21-A83 HydrophobicContact CD2-CB 3.86Å; L21-A83 HydrophobicContact CG-CB 4.35Å; L21-K84 HydrophobicContact CD2-CG 4.44Å; L21-I87 HydrophobicContact CD2-CD1 4Å
22	S	92.2	Very high	91.3	Very high	72 Å²	72	57 Å²	57	50%	0.503	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-49	174.7	-62	0	0	0	0	111.7	E18 R19 L20 M24 K25 E26	E18-S22 PolarHBondContact O-N 2.93Å; E18-S22 PolarHBondContact O-OG 2.97Å; E18-S22 VanDerWaalsContact O-OG 3.04Å; R19-S22 WeakPolarHBondContact O-CB 3.4Å; R19-S22 PolarHBondContact O-N 2.81Å; L20-S22 VanDerWaalsContact C-N 3.35Å; L20-S22 PolarHBondContact O-N 2.83Å; S22-M24 VanDerWaalsContact C-N 3.34Å; S22-M24 PolarHBondContact O-N 2.88Å; S22-K25 WeakPolarHBondContact O-CB 3.36Å; S22-K25 PolarHBondContact O-N 2.62Å; S22-E26 PolarHBondContact O-N 3.46Å; S22-E26 VanDerWaalsContact O-N 3.08Å
23	E	91.6	Very high	90.8	Very high	78 Å²	78	54.8 Å²	54.8	36%	0.364	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-40.6	176.8	-74.2	178.3	-171.4	0	0	112	R19 L20 K25 E26 H27	R19-E23 PolarHBondContact O-N 2.77Å; L20-E23 PolarHBondContact O-N 3.42Å; E23-K25 VanDerWaalsContact C-N 3.3Å; E23-K25 PolarHBondContact O-N 3.12Å; E23-E26 PolarHBondContact O-N 2.67Å; E23-H27 WeakPolarHBondContact O-CB 3.42Å; E23-H27 PolarHBondContact O-N 3.34Å; E23-H27 PolarHBondContact O-ND1 3.48Å
24	M	91.7	Very high	90.3	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-38.7	176.6	-76.3	176.6	70.2	0	0	112.4	L20 L21 S22 H27 A28 V36 T39 M40 L43 I87	L20-M24 WeakPolarHBondContact O-CB 3.49Å; L20-M24 WeakPolarHBondContact O-CG 3.47Å; L20-M24 PolarHBondContact O-N 3.14Å; L21-M24 PolarHBondContact O-N 3.23Å; S22-M24 VanDerWaalsContact C-N 3.34Å; S22-M24 PolarHBondContact O-N 2.88Å; M24-H27 PolarHBondContact O-N 2.73Å; M24-A28 VanDerWaalsContact O-CB 3.25Å; M24-A28 WeakPolarHBondContact O-CB 3.25Å; M24-A28 PolarHBondContact O-N 3.43Å; M24-V36 HydrophobicContact CE-CG1 3.88Å; M24-T39 VanDerWaalsContact CG-CB 3.48Å; M24-T39 HydrophobicContact CG-CG2 3.34Å; M24-T39 HydrophobicContact SD-CG2 3.91Å; M24-M40 HydrophobicContact CE-CB 3.7Å; M24-M40 HydrophobicContact CE-CE 3.47Å; M24-M40 VanDerWaalsContact CE-CE 3.47Å; M24-M40 HydrophobicContact CE-CG 4.29Å; M24-M40 HydrophobicContact CE-SD 3.72Å; M24-L43 HydrophobicContact SD-CB 4.36Å; M24-L43 HydrophobicContact SD-CD2 3.92Å; M24-I87 HydrophobicContact CB-CD1 3.63Å; M24-I87 HydrophobicContact CB-CG1 4.4Å; M24-I87 HydrophobicContact CE-CD1 4.26Å; M24-I87 HydrophobicContact CE-CG2 4.27Å
25	K	90.1	Very high	90	Very high	97 Å²	97	60 Å²	60	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-66.1	-41.2	176.5	-167.6	170.5	-177.4	166.2	0	111.1	L21 S22 E23 A28 C29 I87 L90	L21-K25 PolarHBondContact O-N 2.9Å; S22-K25 WeakPolarHBondContact O-CB 3.36Å; S22-K25 PolarHBondContact O-N 2.62Å; E23-K25 VanDerWaalsContact C-N 3.3Å; E23-K25 PolarHBondContact O-N 3.12Å; K25-A28 PolarHBondContact O-N 2.96Å; K25-C29 WeakPolarHBondContact O-CB 3.43Å; K25-C29 PolarHBondContact O-N 2.92Å; K25-C29 PolarHBondContact O-SG 2.67Å; K25-I87 HydrophobicContact CB-CG1 4.45Å; K25-L90 HydrophobicContact CG-CD1 4.22Å
26	E	90	Very high	89.9	Confident	138 Å²	138	58.7 Å²	58.7	65%	0.645	32%	0.323	S	S	*	.	H	α-helix	trans	-62.8	-46.8	173.2	-70.6	-177.3	-177.8	0	0	112.1	S22 E23 A28 C29 A30	S22-E26 PolarHBondContact O-N 3.46Å; S22-E26 VanDerWaalsContact O-N 3.08Å; E23-E26 PolarHBondContact O-N 2.67Å; E26-A28 VanDerWaalsContact C-N 3.32Å; E26-A28 PolarHBondContact O-N 2.82Å; E26-C29 PolarHBondContact O-N 2.81Å; E26-A30 WeakPolarHBondContact O-CB 3.36Å; E26-A30 PolarHBondContact O-N 2.72Å
27	H	90.4	Very high	89.5	Confident	34 Å²	34	65.3 Å²	65.3	16%	0.157	34%	0.344	C	S	.	.	H	α-helix	trans	-62	-39.1	176.5	-65.9	154.9	0	0	0	112.2	E23 M24 A30 G31 Q32 L35 V36	E23-H27 WeakPolarHBondContact O-CB 3.42Å; E23-H27 PolarHBondContact O-N 3.34Å; E23-H27 PolarHBondContact O-ND1 3.48Å; M24-H27 PolarHBondContact O-N 2.73Å; H27-A30 CarbonylContact O-C 3.31Å; H27-A30 PolarHBondContact O-N 2.78Å; H27-G31 PolarHBondContact O-N 2.97Å; H27-Q32 HydrophobicContact CB-CB 4.24Å; H27-Q32 PolarHBondContact CD2-OE1 2.96Å; H27-Q32 PolarHBondContact O-N 2.96Å; H27-L35 HydrophobicContact CB-CB 4.38Å; H27-V36 HydrophobicContact CB-CG2 3.67Å
28	A	86.9	Confident	89.2	Confident	5 Å²	5	73.4 Å²	73.4	4%	0.041	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-46.5	176.6	0	0	0	0	0	111.2	M24 K25 E26 A30 G31 V36 I87 L90	M24-A28 VanDerWaalsContact O-CB 3.25Å; M24-A28 WeakPolarHBondContact O-CB 3.25Å; M24-A28 PolarHBondContact O-N 3.43Å; K25-A28 PolarHBondContact O-N 2.96Å; E26-A28 VanDerWaalsContact C-N 3.32Å; E26-A28 PolarHBondContact O-N 2.82Å; A28-A30 VanDerWaalsContact C-N 3.26Å; A28-A30 PolarHBondContact O-N 2.82Å; A28-G31 PolarHBondContact O-N 2.84Å; A28-V36 HydrophobicContact CB-CG2 3.99Å; A28-I87 HydrophobicContact CB-CG2 4.15Å; A28-L90 HydrophobicContact CB-CB 3.92Å; A28-L90 HydrophobicContact CB-CD1 4.21Å
29	C	86.6	Confident	89.1	Confident	92 Å²	92	69 Å²	69	62%	0.622	36%	0.355	S	S	*	.	H	α-helix	trans	-61.3	-32.9	173.9	-72	0	0	0	0	112.9	K25 E26 G31	K25-C29 WeakPolarHBondContact O-CB 3.43Å; K25-C29 PolarHBondContact O-N 2.92Å; K25-C29 PolarHBondContact O-SG 2.67Å; E26-C29 PolarHBondContact O-N 2.81Å; C29-G31 VanDerWaalsContact C-N 3.27Å; C29-G31 PolarHBondContact O-N 3.19Å
30	A	86.3	Confident	88.9	Confident	66 Å²	66	62.6 Å²	62.6	55%	0.545	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	0.3	175.4	0	0	0	0	0	113.9	E26 H27 A28 Q32	E26-A30 WeakPolarHBondContact O-CB 3.36Å; E26-A30 PolarHBondContact O-N 2.72Å; H27-A30 CarbonylContact O-C 3.31Å; H27-A30 PolarHBondContact O-N 2.78Å; A28-A30 VanDerWaalsContact C-N 3.26Å; A28-A30 PolarHBondContact O-N 2.82Å; A30-Q32 VanDerWaalsContact C-N 3.25Å; A30-Q32 HydrophobicContact CB-CG 4.08Å; A30-Q32 PolarHBondContact O-N 2.87Å
31	G	84.2	Confident	88.6	Confident	39 Å²	39	66.4 Å²	66.4	40%	0.402	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	16	-178.1	0	0	0	0	0	114.5	H27 A28 C29 H33	H27-G31 PolarHBondContact O-N 2.97Å; A28-G31 PolarHBondContact O-N 2.84Å; C29-G31 VanDerWaalsContact C-N 3.27Å; C29-G31 PolarHBondContact O-N 3.19Å; G31-H33 VanDerWaalsContact C-N 3.28Å; G31-H33 PolarHBondContact O-CD2 2.95Å; G31-H33 VanDerWaalsContact O-CD2 3.3Å; G31-H33 PolarHBondContact O-N 3.44Å; G31-H33 PolarHBondContact O-NE2 2.97Å
32	Q	86.8	Confident	88.6	Confident	86 Å²	86	69.4 Å²	69.4	40%	0.402	37%	0.366	S	S	.	.			trans	-85.3	59.5	-177.5	-63	-177	-18.9	0	0	111.9	H27 A30 A34 L35 V36	H27-Q32 HydrophobicContact CB-CB 4.24Å; H27-Q32 PolarHBondContact CD2-OE1 2.96Å; H27-Q32 PolarHBondContact O-N 2.96Å; A30-Q32 VanDerWaalsContact C-N 3.25Å; A30-Q32 HydrophobicContact CB-CG 4.08Å; A30-Q32 PolarHBondContact O-N 2.87Å; Q32-A34 VanDerWaalsContact C-N 3.25Å; Q32-A34 PolarHBondContact O-N 3.31Å; Q32-A34 VanDerWaalsContact O-N 3.13Å; Q32-L35 HydrophobicContact CB-CB 4.19Å; Q32-L35 HydrophobicContact CB-CD1 4.23Å; Q32-L35 WeakPolarHBondContact O-CB 3.41Å; Q32-L35 PolarHBondContact O-N 3.02Å; Q32-V36 PolarHBondContact O-N 2.86Å
33	H	82.1	Confident	88.6	Confident	54 Å²	54	66 Å²	66	25%	0.25	34%	0.342	C	S	.	.	H	α-helix	trans	-59	-31.3	-171.9	-53.7	-53.9	0	0	0	114.8	G31 V36 R37 P92	G31-H33 VanDerWaalsContact C-N 3.28Å; G31-H33 PolarHBondContact O-CD2 2.95Å; G31-H33 VanDerWaalsContact O-CD2 3.3Å; G31-H33 PolarHBondContact O-N 3.44Å; G31-H33 PolarHBondContact O-NE2 2.97Å; H33-V36 PolarHBondContact O-N 2.83Å; H33-R37 PolarHBondContact O-N 2.94Å; H33-P92 WeakPolarHBondContact CE1-CD 3.44Å; H33-P92 WeakPolarHBondContact NE2-CD 3.4Å; H33-P92 WeakPolarHBondContact NE2-CG 3.3Å
34	A	83	Confident	88.7	Confident	67 Å²	67	65.7 Å²	65.7	55%	0.554	34%	0.343	S	S	*	.	H	α-helix	trans	-66	-39.6	175	0	0	0	0	0	111.9	Q32 R38	Q32-A34 VanDerWaalsContact C-N 3.25Å; Q32-A34 PolarHBondContact O-N 3.31Å; Q32-A34 VanDerWaalsContact O-N 3.13Å; A34-R38 WeakPolarHBondContact O-CG 3.44Å; A34-R38 PolarHBondContact O-N 2.91Å
35	L	87.7	Confident	88.6	Confident	82 Å²	82	69.2 Å²	69.2	43%	0.429	37%	0.365	S	S	.	.	H	α-helix	trans	-66.6	-46	173	-93.7	104.2	0	0	0	110.5	H27 Q32 R37 R38 T39	H27-L35 HydrophobicContact CB-CB 4.38Å; Q32-L35 HydrophobicContact CB-CB 4.19Å; Q32-L35 HydrophobicContact CB-CD1 4.23Å; Q32-L35 WeakPolarHBondContact O-CB 3.41Å; Q32-L35 PolarHBondContact O-N 3.02Å; L35-R37 VanDerWaalsContact C-N 3.26Å; L35-R37 PolarHBondContact O-N 3Å; L35-R38 PolarHBondContact O-N 3.25Å; L35-T39 PolarHBondContact O-N 3.05Å; L35-T39 PolarHBondContact O-OG1 3.45Å
36	V	90.2	Very high	88.7	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.006	36%	0.36	C	S	.	.	H	α-helix	trans	-53.4	-45.2	177.7	-178.8	0	0	0	0	111.3	M24 H27 A28 Q32 H33 R38 T39 M40 I87 Q91	M24-V36 HydrophobicContact CE-CG1 3.88Å; H27-V36 HydrophobicContact CB-CG2 3.67Å; A28-V36 HydrophobicContact CB-CG2 3.99Å; Q32-V36 PolarHBondContact O-N 2.86Å; H33-V36 PolarHBondContact O-N 2.83Å; V36-R38 PolarHBondContact O-N 2.67Å; V36-T39 PolarHBondContact O-N 2.8Å; V36-M40 WeakPolarHBondContact O-CB 3.22Å; V36-M40 PolarHBondContact O-N 3.14Å; V36-I87 HydrophobicContact CG1-CG2 3.56Å; V36-Q91 VanDerWaalsContact CG1-NE2 3.26Å
37	R	86.8	Confident	88.9	Confident	151 Å²	151	62.7 Å²	62.7	57%	0.57	33%	0.333	S	S	*	.	H	α-helix	trans	-62	-42.5	177.5	-169.1	-177.5	-61.5	111.2	2.4	112.5	H33 L35 M40 E41	H33-R37 PolarHBondContact O-N 2.94Å; L35-R37 VanDerWaalsContact C-N 3.26Å; L35-R37 PolarHBondContact O-N 3Å; R37-M40 WeakPolarHBondContact O-CB 3.49Å; R37-M40 PolarHBondContact O-N 3.14Å; R37-E41 PolarHBondContact O-N 2.99Å
38	R	88.9	Confident	89	Confident	170 Å²	170	64.7 Å²	64.7	64%	0.642	35%	0.347	S	S	*	.	H	α-helix	trans	-69.5	-39.4	178.2	-70.5	-60	-170	-179.9	1.5	112.5	A34 L35 V36 M40 E41 L42	A34-R38 WeakPolarHBondContact O-CG 3.44Å; A34-R38 PolarHBondContact O-N 2.91Å; L35-R38 PolarHBondContact O-N 3.25Å; V36-R38 PolarHBondContact O-N 2.67Å; R38-M40 VanDerWaalsContact C-N 3.29Å; R38-M40 PolarHBondContact O-N 3.48Å; R38-E41 WeakPolarHBondContact CD-OE2 3.29Å; R38-E41 IonicContact CZ-OE2 2.85Å; R38-E41 IonicContact NE-OE2 3.02Å; R38-E41 IonicContact NH1-OE1 2.76Å; R38-E41 IonicContact NH1-OE2 3.03Å; R38-E41 PolarHBondContact NH1-OE2 2.8Å; R38-E41 PolarHBondContact O-N 2.91Å; R38-L42 PolarHBondContact O-N 3.17Å
39	T	91.6	Very high	89.3	Confident	15 Å²	15	68.4 Å²	68.4	9%	0.092	36%	0.364	C	S	.	.	H	α-helix	trans	-68.1	-31.8	175.8	-46.3	0	0	0	0	111.1	L20 M24 L35 V36 L42 L43	L20-T39 HydrophobicContact CB-CG2 4.38Å; L20-T39 HydrophobicContact CD2-CG2 3.78Å; M24-T39 VanDerWaalsContact CG-CB 3.48Å; M24-T39 HydrophobicContact CG-CG2 3.34Å; M24-T39 HydrophobicContact SD-CG2 3.91Å; L35-T39 PolarHBondContact O-N 3.05Å; L35-T39 PolarHBondContact O-OG1 3.45Å; V36-T39 PolarHBondContact O-N 2.8Å; T39-L42 PolarHBondContact O-N 2.9Å; T39-L43 WeakPolarHBondContact O-CB 3.27Å; T39-L43 PolarHBondContact O-N 2.67Å
40	M	91.1	Very high	89.6	Confident	33 Å²	33	64 Å²	64	16%	0.163	34%	0.335	C	S	.	.	H	α-helix	trans	-61.4	-43.9	171.7	-170.7	71.2	81.5	0	0	112	M24 V36 R37 R38 L42 L43 D44 K84	M24-M40 HydrophobicContact CE-CB 3.7Å; M24-M40 HydrophobicContact CE-CE 3.47Å; M24-M40 VanDerWaalsContact CE-CE 3.47Å; M24-M40 HydrophobicContact CE-CG 4.29Å; M24-M40 HydrophobicContact CE-SD 3.72Å; V36-M40 WeakPolarHBondContact O-CB 3.22Å; V36-M40 PolarHBondContact O-N 3.14Å; R37-M40 WeakPolarHBondContact O-CB 3.49Å; R37-M40 PolarHBondContact O-N 3.14Å; R38-M40 VanDerWaalsContact C-N 3.29Å; R38-M40 PolarHBondContact O-N 3.48Å; M40-L42 VanDerWaalsContact C-N 3.28Å; M40-L42 PolarHBondContact O-N 2.75Å; M40-L43 WeakPolarHBondContact O-CB 3.3Å; M40-L43 PolarHBondContact O-N 2.85Å; M40-L43 HydrophobicContact SD-CD2 4.05Å; M40-D44 PolarHBondContact O-N 2.93Å; M40-K84 HydrophobicContact CE-CB 4.4Å; M40-K84 HydrophobicContact CE-CD 4.3Å; M40-K84 HydrophobicContact CE-CG 4.05Å; M40-K84 HydrophobicContact SD-CD 3.8Å; M40-K84 WeakPolarHBondContact SD-CE 3.24Å; M40-K84 HydrophobicContact SD-CG 3.99Å
41	E	88.9	Confident	89.9	Confident	95 Å²	95	66.5 Å²	66.5	44%	0.444	33%	0.33	S	S	.	.	H	α-helix	trans	-59.8	-39.7	175.5	-67.3	169.5	177.8	0	0	111.6	R37 R38 T45	R37-E41 PolarHBondContact O-N 2.99Å; R38-E41 WeakPolarHBondContact CD-OE2 3.29Å; R38-E41 IonicContact CZ-OE2 2.85Å; R38-E41 IonicContact NE-OE2 3.02Å; R38-E41 IonicContact NH1-OE1 2.76Å; R38-E41 IonicContact NH1-OE2 3.03Å; R38-E41 PolarHBondContact NH1-OE2 2.8Å; R38-E41 PolarHBondContact O-N 2.91Å; E41-T45 PolarHBondContact O-N 3.41Å; E41-T45 PolarHBondContact O-OG1 3.18Å; E41-T45 VanDerWaalsContact O-OG1 3.06Å
42	L	92.4	Very high	90.3	Very high	83 Å²	83	70.8 Å²	70.8	44%	0.435	34%	0.339	S	S	.	.	H	α-helix	trans	-69.9	-41.9	177	-175	60.3	0	0	0	112	L20 R38 T39 M40 D44 T45 Y46	L20-L42 HydrophobicContact CD1-CD2 4.45Å; L20-L42 HydrophobicContact CD1-CG 4.12Å; L20-L42 HydrophobicContact CD2-CD2 3.77Å; L20-L42 HydrophobicContact CD2-CG 4.28Å; R38-L42 PolarHBondContact O-N 3.17Å; T39-L42 PolarHBondContact O-N 2.9Å; M40-L42 VanDerWaalsContact C-N 3.28Å; M40-L42 PolarHBondContact O-N 2.75Å; L42-D44 VanDerWaalsContact C-N 3.33Å; L42-D44 PolarHBondContact O-N 2.77Å; L42-T45 WeakPolarHBondContact O-CB 3.28Å; L42-T45 PolarHBondContact O-N 2.88Å; L42-T45 VanDerWaalsContact O-N 3.17Å; L42-Y46 HydrophobicContact CD1-CD2 4.28Å; L42-Y46 HydrophobicContact CD1-CE2 4.08Å; L42-Y46 HydrophobicContact CG-CD2 4.38Å; L42-Y46 HydrophobicContact CG-CE2 4.33Å; L42-Y46 WeakPolarHBondContact O-CD2 3.44Å; L42-Y46 PolarHBondContact O-N 2.73Å; L42-Y46 VanDerWaalsContact O-N 3.12Å
43	L	94.2	Very high	90.6	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-57.6	-45.3	175.5	-177.4	75	0	0	0	111.3	V17 L20 L21 M24 T39 M40 T45 Y46 L47 K84	V17-L43 HydrophobicContact CB-CD1 4.27Å; V17-L43 HydrophobicContact CG1-CD1 3.69Å; L20-L43 HydrophobicContact CB-CD1 3.8Å; L20-L43 HydrophobicContact CD1-CB 4.43Å; L20-L43 HydrophobicContact CD1-CD1 4.29Å; L21-L43 HydrophobicContact CD2-CD1 4.27Å; L21-L43 HydrophobicContact CD2-CD2 3.64Å; L21-L43 HydrophobicContact CG-CD1 4Å; L21-L43 HydrophobicContact CG-CD2 4.29Å; M24-L43 HydrophobicContact SD-CB 4.36Å; M24-L43 HydrophobicContact SD-CD2 3.92Å; T39-L43 WeakPolarHBondContact O-CB 3.27Å; T39-L43 PolarHBondContact O-N 2.67Å; M40-L43 WeakPolarHBondContact O-CB 3.3Å; M40-L43 PolarHBondContact O-N 2.85Å; M40-L43 HydrophobicContact SD-CD2 4.05Å; L43-T45 VanDerWaalsContact C-N 3.27Å; L43-T45 PolarHBondContact O-N 3.3Å; L43-Y46 PolarHBondContact O-N 2.66Å; L43-L47 HydrophobicContact CG-CD1 4.31Å; L43-L47 WeakPolarHBondContact O-CG 3.42Å; L43-L47 PolarHBondContact O-N 3.43Å; L43-K84 HydrophobicContact CD2-CD 4.44Å; L43-K84 HydrophobicContact CD2-CG 4.26Å
44	D	92.2	Very high	91	Very high	72 Å²	72	64.7 Å²	64.7	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-36.1	177.8	-74.5	-22.6	0	0	0	112.2	M40 L42 L47 V48 K84	M40-D44 PolarHBondContact O-N 2.93Å; L42-D44 VanDerWaalsContact C-N 3.33Å; L42-D44 PolarHBondContact O-N 2.77Å; D44-L47 PolarHBondContact O-N 3.27Å; D44-V48 WeakPolarHBondContact O-CG2 3.02Å; D44-V48 PolarHBondContact O-N 3.15Å; D44-V48 VanDerWaalsContact O-N 3.11Å; D44-K84 IonicContact OD1-NZ 3.86Å; D44-K84 PolarHBondContact OD1-NZ 3.37Å
45	T	91.1	Very high	91.4	Very high	74 Å²	74	69.4 Å²	69.4	45%	0.454	32%	0.316	S	S	.	.	H	α-helix	trans	-64.2	-43.9	175	-54.8	0	0	0	0	111.6	E41 L42 L43 V48 Q49	E41-T45 PolarHBondContact O-N 3.41Å; E41-T45 PolarHBondContact O-OG1 3.18Å; E41-T45 VanDerWaalsContact O-OG1 3.06Å; L42-T45 WeakPolarHBondContact O-CB 3.28Å; L42-T45 PolarHBondContact O-N 2.88Å; L42-T45 VanDerWaalsContact O-N 3.17Å; L43-T45 VanDerWaalsContact C-N 3.27Å; L43-T45 PolarHBondContact O-N 3.3Å; T45-V48 PolarHBondContact O-N 3.17Å; T45-Q49 PolarHBondContact O-N 3.21Å
46	Y	92	Very high	91.5	Very high	81 Å²	81	69.3 Å²	69.3	32%	0.318	31%	0.314	S	S	.	.	H	α-helix	trans	-64.1	-39.7	175.8	-91.1	-107.4	0	0	0	112.2	L13 L20 L42 L43 V48 Q49 C50	L13-Y46 HydrophobicContact CD2-CD1 4.07Å; L13-Y46 HydrophobicContact CD2-CE1 4.21Å; L20-Y46 HydrophobicContact CD1-CD2 3.93Å; L20-Y46 HydrophobicContact CD1-CE2 4.32Å; L20-Y46 HydrophobicContact CD1-CG 4.15Å; L42-Y46 HydrophobicContact CD1-CD2 4.28Å; L42-Y46 HydrophobicContact CD1-CE2 4.08Å; L42-Y46 HydrophobicContact CG-CD2 4.38Å; L42-Y46 HydrophobicContact CG-CE2 4.33Å; L42-Y46 WeakPolarHBondContact O-CD2 3.44Å; L42-Y46 PolarHBondContact O-N 2.73Å; L42-Y46 VanDerWaalsContact O-N 3.12Å; L43-Y46 PolarHBondContact O-N 2.66Å; Y46-V48 VanDerWaalsContact C-N 3.33Å; Y46-V48 PolarHBondContact O-N 3.16Å; Y46-Q49 PolarHBondContact O-N 3.18Å; Y46-C50 VanDerWaalsContact O-CB 3.31Å; Y46-C50 WeakPolarHBondContact O-CB 3.08Å; Y46-C50 PolarHBondContact O-N 3.03Å
47	L	93.3	Very high	91.5	Very high	16 Å²	16	69.3 Å²	69.3	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-38.6	178.1	-71.6	170.4	0	0	0	112.4	V17 L43 D44 C50 R51 F76 V80	V17-L47 HydrophobicContact CG1-CD2 3.94Å; V17-L47 HydrophobicContact CG2-CD2 4.04Å; V17-L47 HydrophobicContact CG2-CG 4.41Å; L43-L47 HydrophobicContact CG-CD1 4.31Å; L43-L47 WeakPolarHBondContact O-CG 3.42Å; L43-L47 PolarHBondContact O-N 3.43Å; D44-L47 PolarHBondContact O-N 3.27Å; L47-C50 VanDerWaalsContact O-CB 3.31Å; L47-C50 WeakPolarHBondContact O-CB 3.43Å; L47-C50 PolarHBondContact O-N 2.99Å; L47-R51 WeakPolarHBondContact O-CG 3.39Å; L47-R51 PolarHBondContact O-N 3.35Å; L47-F76 HydrophobicContact CD2-CE1 4.33Å; L47-V80 HydrophobicContact CD1-CG1 3.89Å; L47-V80 HydrophobicContact CD2-CG1 4.13Å; L47-V80 HydrophobicContact CD2-CG2 4.26Å
48	V	92.8	Very high	91.6	Very high	76 Å²	76	64.4 Å²	64.4	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-48.5	174.4	172.6	0	0	0	0	110.9	D44 T45 Y46 C50 R51 E52	D44-V48 WeakPolarHBondContact O-CG2 3.02Å; D44-V48 PolarHBondContact O-N 3.15Å; D44-V48 VanDerWaalsContact O-N 3.11Å; T45-V48 PolarHBondContact O-N 3.17Å; Y46-V48 VanDerWaalsContact C-N 3.33Å; Y46-V48 PolarHBondContact O-N 3.16Å; V48-C50 VanDerWaalsContact C-N 3.3Å; V48-C50 PolarHBondContact O-N 3.3Å; V48-R51 PolarHBondContact O-N 2.9Å; V48-R51 VanDerWaalsContact O-N 3.13Å; V48-E52 PolarHBondContact O-N 2.91Å
49	Q	93	Very high	91.5	Very high	84 Å²	84	59.6 Å²	59.6	39%	0.393	30%	0.301	S	S	.	.	H	α-helix	trans	-61	-40.7	177.9	-68.1	179.8	-1.5	0	0	112.1	L13 T45 Y46 R51 E52 V53	L13-Q49 HydrophobicContact CD1-CB 4.07Å; L13-Q49 HydrophobicContact CD2-CB 4.35Å; T45-Q49 PolarHBondContact O-N 3.21Å; Y46-Q49 PolarHBondContact O-N 3.18Å; Q49-R51 VanDerWaalsContact C-N 3.35Å; Q49-R51 PolarHBondContact O-N 2.88Å; Q49-E52 PolarHBondContact O-N 2.82Å; Q49-V53 WeakPolarHBondContact O-CG2 3.23Å; Q49-V53 PolarHBondContact O-N 3.26Å; Q49-V53 VanDerWaalsContact O-N 3.09Å
50	C	93	Very high	91.3	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-55.8	-47	173.4	-106.2	0	0	0	0	112.2	L13 Y46 L47 V48 V53 Q54 W73	L13-C50 WeakPolarHBondContact CB-SG 3.39Å; Y46-C50 VanDerWaalsContact O-CB 3.31Å; Y46-C50 WeakPolarHBondContact O-CB 3.08Å; Y46-C50 PolarHBondContact O-N 3.03Å; L47-C50 VanDerWaalsContact O-CB 3.31Å; L47-C50 WeakPolarHBondContact O-CB 3.43Å; L47-C50 PolarHBondContact O-N 2.99Å; V48-C50 VanDerWaalsContact C-N 3.3Å; V48-C50 PolarHBondContact O-N 3.3Å; C50-V53 PolarHBondContact O-N 2.73Å; C50-Q54 WeakPolarHBondContact O-CB 3.49Å; C50-Q54 PolarHBondContact O-N 2.82Å; C50-W73 HydrophobicContact CB-CH2 3.52Å; C50-W73 HydrophobicContact CB-CZ2 4.19Å; C50-W73 HydrophobicContact CB-CZ3 4.38Å
51	R	93	Very high	91.2	Very high	117 Å²	117	63.3 Å²	63.3	44%	0.442	32%	0.317	S	S	.	.	H	α-helix	trans	-64.3	-41.9	178.6	-75.4	175.7	178.9	165.1	0.8	112	L47 V48 Q49 V53 Q54 Y55 W73 E77	L47-R51 WeakPolarHBondContact O-CG 3.39Å; L47-R51 PolarHBondContact O-N 3.35Å; V48-R51 PolarHBondContact O-N 2.9Å; V48-R51 VanDerWaalsContact O-N 3.13Å; Q49-R51 VanDerWaalsContact C-N 3.35Å; Q49-R51 PolarHBondContact O-N 2.88Å; R51-V53 PolarHBondContact O-N 3.41Å; R51-Q54 PolarHBondContact O-N 2.87Å; R51-Y55 HydrophobicContact CB-CE2 4.39Å; R51-Y55 WeakPolarHBondContact O-CD2 3.44Å; R51-Y55 PolarHBondContact O-N 2.93Å; R51-W73 HydrophobicContact CG-CZ2 4.03Å; R51-E77 IonicContact CZ-OE1 3.15Å; R51-E77 IonicContact NE-OE1 3.1Å; R51-E77 PolarHBondContact NE-OE1 2.94Å; R51-E77 IonicContact NH2-OE1 3.36Å; R51-E77 PolarHBondContact NH2-OE1 3.24Å
52	E	92.6	Very high	91	Very high	129 Å²	129	65 Å²	65	60%	0.603	33%	0.325	S	S	*	.	H	α-helix	trans	-59.5	-47.6	176.7	-70.7	179.3	170.8	0	0	111.5	V48 Q49 Q54 Y55 E56	V48-E52 PolarHBondContact O-N 2.91Å; Q49-E52 PolarHBondContact O-N 2.82Å; E52-Q54 VanDerWaalsContact C-N 3.32Å; E52-Q54 PolarHBondContact O-N 2.84Å; E52-Y55 PolarHBondContact O-N 2.93Å; E52-E56 PolarHBondContact O-N 3.13Å; E52-E56 VanDerWaalsContact O-N 3.08Å
53	V	91.8	Very high	90.3	Very high	10 Å²	10	66 Å²	66	6%	0.061	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-37.2	177	178.9	0	0	0	0	111.4	L6 Q9 R10 L13 Q49 C50 R51 E56 L57	L6-V53 HydrophobicContact CB-CG1 4.47Å; L6-V53 HydrophobicContact CD2-CG1 4.22Å; L6-V53 WeakPolarHBondContact O-CG1 3.17Å; Q9-V53 HydrophobicContact CB-CG1 4.29Å; Q9-V53 HydrophobicContact CG-CG1 4.33Å; Q9-V53 HydrophobicContact CG-CG2 4.14Å; R10-V53 HydrophobicContact CB-CG1 3.9Å; L13-V53 HydrophobicContact CD1-CG2 3.92Å; Q49-V53 WeakPolarHBondContact O-CG2 3.23Å; Q49-V53 PolarHBondContact O-N 3.26Å; Q49-V53 VanDerWaalsContact O-N 3.09Å; C50-V53 PolarHBondContact O-N 2.73Å; R51-V53 PolarHBondContact O-N 3.41Å; V53-E56 PolarHBondContact O-N 3.22Å; V53-L57 WeakPolarHBondContact O-CB 3.27Å; V53-L57 PolarHBondContact O-N 3.05Å
54	Q	92.3	Very high	89.7	Confident	3 Å²	3	74 Å²	74	1%	0.014	37%	0.374	C	S	.	.	H	α-helix	trans	-63.8	-43.8	176.8	-179.8	64.8	7.9	0	0	112	C50 R51 E52 E56 L57 Q58 E69 W73	C50-Q54 WeakPolarHBondContact O-CB 3.49Å; C50-Q54 PolarHBondContact O-N 2.82Å; R51-Q54 PolarHBondContact O-N 2.87Å; E52-Q54 VanDerWaalsContact C-N 3.32Å; E52-Q54 PolarHBondContact O-N 2.84Å; Q54-E56 VanDerWaalsContact C-N 3.35Å; Q54-L57 PolarHBondContact O-N 3.34Å; Q54-Q58 WeakPolarHBondContact O-CG 3.43Å; Q54-Q58 PolarHBondContact O-N 3.37Å; Q54-E69 PolarHBondContact NE2-OE1 3.35Å; Q54-E69 PolarHBondContact OE1-OE1 3.46Å; Q54-W73 HydrophobicContact CB-CD2 4.18Å; Q54-W73 HydrophobicContact CB-CE3 4.35Å; Q54-W73 HydrophobicContact CG-CB 4.29Å; Q54-W73 HydrophobicContact CG-CD2 3.68Å; Q54-W73 HydrophobicContact CG-CE3 4.12Å; Q54-W73 HydrophobicContact CG-CG 3.69Å
55	Y	90.1	Very high	89.3	Confident	166 Å²	166	75.5 Å²	75.5	65%	0.651	38%	0.378	S	S	*	.	H	α-helix	trans	-63.5	-40.2	175.3	-76	-59.3	0	0	0	111.9	R51 E52 Q58 G59	R51-Y55 HydrophobicContact CB-CE2 4.39Å; R51-Y55 WeakPolarHBondContact O-CD2 3.44Å; R51-Y55 PolarHBondContact O-N 2.93Å; E52-Y55 PolarHBondContact O-N 2.93Å; Y55-Q58 PolarHBondContact O-N 2.86Å; Y55-G59 PolarHBondContact O-N 3.46Å
56	E	91	Very high	89	Confident	80 Å²	80	73.7 Å²	73.7	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-40.4	175.4	-163.4	-174.8	156.2	0	0	111.5	L6 E52 V53 Q54 G59 H60	L6-E56 HydrophobicContact CD1-CB 4.25Å; L6-E56 HydrophobicContact CD1-CG 3.85Å; L6-E56 HydrophobicContact CD2-CB 4.28Å; L6-E56 HydrophobicContact CD2-CG 4.15Å; E52-E56 PolarHBondContact O-N 3.13Å; E52-E56 VanDerWaalsContact O-N 3.08Å; V53-E56 PolarHBondContact O-N 3.22Å; Q54-E56 VanDerWaalsContact C-N 3.35Å; E56-G59 PolarHBondContact O-N 3.4Å; E56-H60 PolarHBondContact O-ND1 3Å; E56-H60 IonicContact OE1-CE1 2.76Å
57	L	90.2	Very high	88.5	Confident	1 Å²	1	77 Å²	77	1%	0.005	39%	0.386	C	S	.	.	H	α-helix	trans	-62.6	-44	178.3	179.9	68.3	0	0	0	111.8	A3 L6 L7 V53 Q54 G59 H60 L61 E69	A3-L57 HydrophobicContact CB-CD1 4.15Å; A3-L57 WeakPolarHBondContact O-CD1 3.34Å; L6-L57 HydrophobicContact CB-CB 4.2Å; L6-L57 HydrophobicContact CB-CD1 3.81Å; L7-L57 HydrophobicContact CB-CD1 4.46Å; L7-L57 HydrophobicContact CD1-CD2 3.86Å; V53-L57 WeakPolarHBondContact O-CB 3.27Å; V53-L57 PolarHBondContact O-N 3.05Å; Q54-L57 PolarHBondContact O-N 3.34Å; L57-G59 PolarHBondContact O-N 2.86Å; L57-H60 PolarHBondContact O-N 3.29Å; L57-L61 HydrophobicContact CD1-CD1 4.42Å; L57-L61 HydrophobicContact CD1-CG 4.4Å; L57-L61 HydrophobicContact CD2-CD1 4.39Å; L57-L61 HydrophobicContact CG-CD1 3.95Å; L57-L61 HydrophobicContact CG-CG 4.36Å; L57-L61 WeakPolarHBondContact O-CG 3.23Å; L57-L61 PolarHBondContact O-N 3.17Å; L57-E69 HydrophobicContact CD2-CG 4.21Å
58	Q	87.8	Confident	88.2	Confident	48 Å²	48	80.5 Å²	80.5	22%	0.224	41%	0.408	C	S	.	.	H	α-helix	trans	-58.6	-33.4	178.1	-72.6	170.5	18.1	0	0	112.3	Q54 Y55 H60 V66 V70	Q54-Q58 WeakPolarHBondContact O-CG 3.43Å; Q54-Q58 PolarHBondContact O-N 3.37Å; Y55-Q58 PolarHBondContact O-N 2.86Å; Q58-H60 PolarHBondContact O-N 3.09Å; Q58-V66 HydrophobicContact CG-CG1 4.44Å; Q58-V66 WeakPolarHBondContact O-CG2 3.27Å; Q58-V70 HydrophobicContact CG-CG2 4.43Å
59	G	87.5	Confident	88	Confident	69 Å²	69	77.6 Å²	77.6	71%	0.711	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-12.5	174.8	0	0	0	0	0	115	Y55 E56 L57	Y55-G59 PolarHBondContact O-N 3.46Å; E56-G59 PolarHBondContact O-N 3.4Å; L57-G59 PolarHBondContact O-N 2.86Å
60	H	88	Confident	87.7	Confident	88 Å²	88	76 Å²	76	41%	0.407	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-1.5	-178.3	-67.7	79.7	0	0	0	113.9	M1 A3 E56 L57 Q58	M1-H60 PolarHBondContact N-NE2 2.92Å; M1-H60 PolarHBondContact O-CD2 3.43Å; M1-H60 PolarHBondContact O-NE2 3.5Å; A3-H60 HydrophobicContact CB-CB 4.13Å; E56-H60 PolarHBondContact O-ND1 3Å; E56-H60 IonicContact OE1-CE1 2.76Å; L57-H60 PolarHBondContact O-N 3.29Å; Q58-H60 PolarHBondContact O-N 3.09Å
61	L	87.7	Confident	87.4	Confident	37 Å²	37	79.3 Å²	79.3	19%	0.194	41%	0.408	C	S	.	.	S	Bend	trans	-100.6	157.3	-178.2	-69.9	173.6	0	0	0	111.7	A3 L57 E65 V66 E69	A3-L61 HydrophobicContact CB-CD2 4.35Å; L57-L61 HydrophobicContact CD1-CD1 4.42Å; L57-L61 HydrophobicContact CD1-CG 4.4Å; L57-L61 HydrophobicContact CD2-CD1 4.39Å; L57-L61 HydrophobicContact CG-CD1 3.95Å; L57-L61 HydrophobicContact CG-CG 4.36Å; L57-L61 WeakPolarHBondContact O-CG 3.23Å; L57-L61 PolarHBondContact O-N 3.17Å; L61-E65 HydrophobicContact CB-CB 4.15Å; L61-E65 HydrophobicContact CD2-CB 4.38Å; L61-E65 WeakPolarHBondContact CD2-OE2 3.45Å; L61-V66 HydrophobicContact CB-CG2 3.71Å; L61-E69 HydrophobicContact CD1-CB 3.88Å; L61-E69 HydrophobicContact CD1-CG 3.66Å
62	Q	84.9	Confident	87.2	Confident	132 Å²	132	78 Å²	78	62%	0.617	41%	0.41	S	S	*	.			trans	-72.8	153.1	172.3	-66	-64.4	-18.3	0	0	110.8	E64 E65 V66	Q62-E64 VanDerWaalsContact C-N 3.26Å; Q62-E64 PolarHBondContact O-N 2.95Å; Q62-E64 VanDerWaalsContact O-N 3.11Å; Q62-E65 HydrophobicContact CB-CG 4.31Å; Q62-E65 PolarHBondContact N-OE2 3.07Å; Q62-E65 WeakPolarHBondContact O-CA 3.24Å; Q62-E65 WeakPolarHBondContact O-CB 3.15Å; Q62-E65 PolarHBondContact O-N 2.86Å; Q62-V66 WeakPolarHBondContact O-CG2 3.27Å; Q62-V66 PolarHBondContact O-N 3.2Å
63	P	78.7	Confident	87.2	Confident	103 Å²	103	72.5 Å²	72.5	67%	0.669	38%	0.384	S	S	*	.	H	α-helix	trans	-53.4	-37.9	-174.3	-27.2	34.1	0	0	0	114.8	V66 Q67	P63-V66 PolarHBondContact O-N 3.43Å; P63-Q67 PolarHBondContact O-N 2.89Å
64	E	80.5	Confident	87.1	Confident	169 Å²	169	77.1 Å²	77.1	79%	0.79	41%	0.406	S	S	*	.	H	α-helix	trans	-68	-39.7	177.3	-59.1	-171.5	-166.8	0	0	111.9	Q62	Q62-E64 VanDerWaalsContact C-N 3.26Å; Q62-E64 PolarHBondContact O-N 2.95Å; Q62-E64 VanDerWaalsContact O-N 3.11Å
65	E	85.1	Confident	87.1	Confident	102 Å²	102	80.4 Å²	80.4	48%	0.477	43%	0.429	S	S	.	.	H	α-helix	trans	-69.2	-35.7	176.6	-61.7	174.4	166.8	0	0	111.6	L61 Q62 Q67 T68 E69	L61-E65 HydrophobicContact CB-CB 4.15Å; L61-E65 HydrophobicContact CD2-CB 4.38Å; L61-E65 WeakPolarHBondContact CD2-OE2 3.45Å; Q62-E65 HydrophobicContact CB-CG 4.31Å; Q62-E65 PolarHBondContact N-OE2 3.07Å; Q62-E65 WeakPolarHBondContact O-CA 3.24Å; Q62-E65 WeakPolarHBondContact O-CB 3.15Å; Q62-E65 PolarHBondContact O-N 2.86Å; E65-Q67 VanDerWaalsContact C-N 3.3Å; E65-Q67 PolarHBondContact O-N 3.16Å; E65-T68 PolarHBondContact O-N 3.28Å; E65-E69 WeakPolarHBondContact O-CB 3.29Å; E65-E69 PolarHBondContact O-N 3.41Å
66	V	82.9	Confident	87.2	Confident	36 Å²	36	73.4 Å²	73.4	22%	0.218	40%	0.402	C	S	.	.	H	α-helix	trans	-59.4	-41.1	178.1	172.6	0	0	0	0	111	Q58 L61 Q62 P63 E69 V70	Q58-V66 HydrophobicContact CG-CG1 4.44Å; Q58-V66 WeakPolarHBondContact O-CG2 3.27Å; L61-V66 HydrophobicContact CB-CG2 3.71Å; Q62-V66 WeakPolarHBondContact O-CG2 3.27Å; Q62-V66 PolarHBondContact O-N 3.2Å; P63-V66 PolarHBondContact O-N 3.43Å; V66-E69 PolarHBondContact O-N 3.37Å; V66-V70 HydrophobicContact CG1-CG2 4.09Å; V66-V70 WeakPolarHBondContact O-CB 3.4Å; V66-V70 VanDerWaalsContact O-CG2 3.26Å; V66-V70 WeakPolarHBondContact O-CG2 3.33Å; V66-V70 PolarHBondContact O-N 3.02Å
67	Q	83	Confident	87.3	Confident	152 Å²	152	71.8 Å²	71.8	71%	0.71	39%	0.394	S	S	*	.	H	α-helix	trans	-66.1	-44.7	-178.8	-169.7	174.4	0.2	0	0	111.9	P63 E65 E69 S71	P63-Q67 PolarHBondContact O-N 2.89Å; E65-Q67 VanDerWaalsContact C-N 3.3Å; E65-Q67 PolarHBondContact O-N 3.16Å; Q67-E69 VanDerWaalsContact C-N 3.28Å; Q67-E69 PolarHBondContact O-N 3.29Å; Q67-S71 PolarHBondContact O-N 2.78Å; Q67-S71 VanDerWaalsContact O-N 3.1Å
68	T	85.8	Confident	87.3	Confident	88 Å²	88	76.7 Å²	76.7	54%	0.54	42%	0.42	S	S	.	.	H	α-helix	trans	-61.1	-41.3	173.7	-52.1	0	0	0	0	111.1	E65 S71 N72	E65-T68 PolarHBondContact O-N 3.28Å; T68-S71 PolarHBondContact O-N 2.87Å; T68-N72 VanDerWaalsContact O-CG 3.3Å; T68-N72 PolarHBondContact O-N 2.75Å; T68-N72 PolarHBondContact O-ND2 2.73Å
69	E	88.6	Confident	87.6	Confident	16 Å²	16	76.9 Å²	76.9	8%	0.075	43%	0.43	C	S	.	.	H	α-helix	trans	-67.1	-46.2	-179	-179.1	45	-112.1	0	0	112.4	R10 Q54 L57 L61 E65 V66 Q67 S71 N72 W73	R10-E69 IonicContact CZ-OE1 3.15Å; R10-E69 IonicContact CZ-OE2 3.77Å; R10-E69 IonicContact NH1-OE1 3.75Å; R10-E69 PolarHBondContact NH1-OE1 2.98Å; R10-E69 IonicContact NH1-OE2 2.64Å; R10-E69 PolarHBondContact NH1-OE2 3.39Å; R10-E69 IonicContact NH2-OE1 2.82Å; R10-E69 IonicContact NH2-OE2 3.96Å; R10-E69 PolarHBondContact NH2-OE2 2.91Å; Q54-E69 PolarHBondContact NE2-OE1 3.35Å; Q54-E69 PolarHBondContact OE1-OE1 3.46Å; L57-E69 HydrophobicContact CD2-CG 4.21Å; L61-E69 HydrophobicContact CD1-CB 3.88Å; L61-E69 HydrophobicContact CD1-CG 3.66Å; E65-E69 WeakPolarHBondContact O-CB 3.29Å; E65-E69 PolarHBondContact O-N 3.41Å; V66-E69 PolarHBondContact O-N 3.37Å; Q67-E69 VanDerWaalsContact C-N 3.28Å; Q67-E69 PolarHBondContact O-N 3.29Å; E69-S71 VanDerWaalsContact C-N 3.31Å; E69-S71 PolarHBondContact O-N 3.44Å; E69-N72 PolarHBondContact O-N 3.18Å; E69-W73 WeakPolarHBondContact O-CB 3.22Å; E69-W73 PolarHBondContact O-N 3.26Å
70	V	87.2	Confident	87.9	Confident	50 Å²	50	73.9 Å²	73.9	30%	0.303	40%	0.397	S	S	.	.	H	α-helix	trans	-58.8	-42.8	173.9	170.7	0	0	0	0	111.1	Q58 V66 W73 M74	Q58-V70 HydrophobicContact CG-CG2 4.43Å; V66-V70 HydrophobicContact CG1-CG2 4.09Å; V66-V70 WeakPolarHBondContact O-CB 3.4Å; V66-V70 VanDerWaalsContact O-CG2 3.26Å; V66-V70 WeakPolarHBondContact O-CG2 3.33Å; V66-V70 PolarHBondContact O-N 3.02Å; V70-W73 PolarHBondContact O-N 3.12Å; V70-M74 HydrophobicContact CG1-SD 4.32Å; V70-M74 WeakPolarHBondContact O-CG 3.42Å; V70-M74 PolarHBondContact O-N 2.96Å
71	S	87	Confident	88.1	Confident	70 Å²	70	74.1 Å²	74.1	49%	0.49	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-45.7	177.5	-168.1	0	0	0	0	111.9	Q67 T68 E69 W73 M74 S75	Q67-S71 PolarHBondContact O-N 2.78Å; Q67-S71 VanDerWaalsContact O-N 3.1Å; T68-S71 PolarHBondContact O-N 2.87Å; E69-S71 VanDerWaalsContact C-N 3.31Å; E69-S71 PolarHBondContact O-N 3.44Å; S71-W73 VanDerWaalsContact C-N 3.27Å; S71-W73 PolarHBondContact O-N 3.13Å; S71-M74 PolarHBondContact O-N 3.14Å; S71-S75 PolarHBondContact O-N 2.81Å; S71-S75 VanDerWaalsContact O-N 3.09Å; S71-S75 PolarHBondContact O-OG 3.32Å
72	N	89.2	Confident	88.3	Confident	88 Å²	88	78.1 Å²	78.1	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-37.2	177.4	-73.2	-19.2	0	0	0	111.9	T68 E69 F76	T68-N72 VanDerWaalsContact O-CG 3.3Å; T68-N72 PolarHBondContact O-N 2.75Å; T68-N72 PolarHBondContact O-ND2 2.73Å; E69-N72 PolarHBondContact O-N 3.18Å; N72-F76 PolarHBondContact O-N 3.27Å
73	W	92.1	Very high	88.6	Confident	15 Å²	15	73 Å²	73	6%	0.057	40%	0.402	C	S	.	.	H	α-helix	trans	-67.6	-44.2	176.3	-177.4	-101.4	0	0	0	112.6	R10 K14 C50 R51 Q54 E69 V70 S71 S75 F76 E77	R10-W73 HydrophobicContact CG-CZ3 4.1Å; K14-W73 HydrophobicContact CD-CZ3 4.38Å; K14-W73 HydrophobicContact CG-CZ3 4.19Å; C50-W73 HydrophobicContact CB-CH2 3.52Å; C50-W73 HydrophobicContact CB-CZ2 4.19Å; C50-W73 HydrophobicContact CB-CZ3 4.38Å; R51-W73 HydrophobicContact CG-CZ2 4.03Å; Q54-W73 HydrophobicContact CB-CD2 4.18Å; Q54-W73 HydrophobicContact CB-CE3 4.35Å; Q54-W73 HydrophobicContact CG-CB 4.29Å; Q54-W73 HydrophobicContact CG-CD2 3.68Å; Q54-W73 HydrophobicContact CG-CE3 4.12Å; Q54-W73 HydrophobicContact CG-CG 3.69Å; E69-W73 WeakPolarHBondContact O-CB 3.22Å; E69-W73 PolarHBondContact O-N 3.26Å; V70-W73 PolarHBondContact O-N 3.12Å; S71-W73 VanDerWaalsContact C-N 3.27Å; S71-W73 PolarHBondContact O-N 3.13Å; W73-S75 VanDerWaalsContact C-N 3.32Å; W73-S75 PolarHBondContact O-N 2.93Å; W73-F76 HydrophobicContact CE3-CD1 4.28Å; W73-F76 AromaticContact CH2-CD1 3.69Å; W73-F76 HydrophobicContact CH2-CD1 3.69Å; W73-F76 AromaticContact CH2-CE1 3.77Å; W73-F76 HydrophobicContact CH2-CE1 3.77Å; W73-F76 HydrophobicContact CZ2-CD1 4.33Å; W73-F76 AromaticContact CZ3-CD1 3.72Å; W73-F76 HydrophobicContact CZ3-CD1 3.72Å; W73-F76 HydrophobicContact CZ3-CE1 4.06Å; W73-F76 WeakPolarHBondContact O-CB 3.3Å; W73-F76 PolarHBondContact O-N 3.06Å; W73-F76 VanDerWaalsContact O-N 3.14Å; W73-E77 HydrophobicContact CZ2-CG 4.02Å; W73-E77 VanDerWaalsContact NE1-CD 3.28Å; W73-E77 PolarHBondContact NE1-OE2 2.96Å; W73-E77 PolarHBondContact O-N 2.67Å
74	M	89.7	Confident	89.2	Confident	107 Å²	107	69.9 Å²	69.9	53%	0.527	38%	0.379	S	S	.	.	H	α-helix	trans	-60.1	-41.3	176.1	-75	-178	68.8	0	0	112.2	V70 S71 F76 E77 L78	V70-M74 HydrophobicContact CG1-SD 4.32Å; V70-M74 WeakPolarHBondContact O-CG 3.42Å; V70-M74 PolarHBondContact O-N 2.96Å; S71-M74 PolarHBondContact O-N 3.14Å; M74-F76 VanDerWaalsContact C-N 3.29Å; M74-F76 PolarHBondContact O-N 3.44Å; M74-E77 PolarHBondContact O-N 2.77Å; M74-L78 WeakPolarHBondContact O-CG 3.35Å; M74-L78 PolarHBondContact O-N 3.35Å
75	S	91.7	Very high	89.5	Confident	71 Å²	71	64.6 Å²	64.6	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-60.2	-39.6	175	-62.5	0	0	0	0	112.3	S71 W73 A79	S71-S75 PolarHBondContact O-N 2.81Å; S71-S75 VanDerWaalsContact O-N 3.09Å; S71-S75 PolarHBondContact O-OG 3.32Å; W73-S75 VanDerWaalsContact C-N 3.32Å; W73-S75 PolarHBondContact O-N 2.93Å; S75-A79 PolarHBondContact O-N 2.92Å; S75-A79 VanDerWaalsContact O-N 3.1Å
76	F	93.5	Very high	89.7	Confident	19 Å²	19	64.4 Å²	64.4	8%	0.083	36%	0.363	C	S	.	.	H	α-helix	trans	-65.5	-45.2	175	174.8	-98.1	0	0	0	112	K14 V17 E18 L47 N72 W73 M74 L78 A79 V80	K14-F76 HydrophobicContact CB-CE2 3.95Å; K14-F76 HydrophobicContact CB-CZ 3.99Å; K14-F76 HydrophobicContact CD-CD2 3.98Å; K14-F76 HydrophobicContact CD-CE2 4.05Å; K14-F76 HydrophobicContact CD-CG 4.22Å; K14-F76 HydrophobicContact CD-CZ 4.35Å; K14-F76 HydrophobicContact CG-CD1 4.36Å; K14-F76 HydrophobicContact CG-CD2 4.2Å; K14-F76 HydrophobicContact CG-CE1 3.98Å; K14-F76 HydrophobicContact CG-CE2 3.79Å; K14-F76 HydrophobicContact CG-CG 4.46Å; K14-F76 HydrophobicContact CG-CZ 3.67Å; V17-F76 HydrophobicContact CB-CZ 3.95Å; V17-F76 HydrophobicContact CG1-CE1 4.44Å; V17-F76 HydrophobicContact CG1-CZ 3.75Å; V17-F76 HydrophobicContact CG2-CZ 4.37Å; E18-F76 HydrophobicContact CG-CE2 4.36Å; L47-F76 HydrophobicContact CD2-CE1 4.33Å; N72-F76 PolarHBondContact O-N 3.27Å; W73-F76 HydrophobicContact CE3-CD1 4.28Å; W73-F76 AromaticContact CH2-CD1 3.69Å; W73-F76 HydrophobicContact CH2-CD1 3.69Å; W73-F76 AromaticContact CH2-CE1 3.77Å; W73-F76 HydrophobicContact CH2-CE1 3.77Å; W73-F76 HydrophobicContact CZ2-CD1 4.33Å; W73-F76 AromaticContact CZ3-CD1 3.72Å; W73-F76 HydrophobicContact CZ3-CD1 3.72Å; W73-F76 HydrophobicContact CZ3-CE1 4.06Å; W73-F76 WeakPolarHBondContact O-CB 3.3Å; W73-F76 PolarHBondContact O-N 3.06Å; W73-F76 VanDerWaalsContact O-N 3.14Å; M74-F76 VanDerWaalsContact C-N 3.29Å; M74-F76 PolarHBondContact O-N 3.44Å; F76-L78 VanDerWaalsContact C-N 3.34Å; F76-L78 PolarHBondContact O-N 2.88Å; F76-A79 PolarHBondContact O-N 2.86Å; F76-V80 HydrophobicContact CD1-CG2 4.42Å; F76-V80 HydrophobicContact CE1-CG2 3.98Å; F76-V80 HydrophobicContact CE2-CG2 4.35Å; F76-V80 HydrophobicContact CZ-CG2 3.95Å; F76-V80 WeakPolarHBondContact O-CG2 3.31Å; F76-V80 PolarHBondContact O-N 3.21Å; F76-V80 VanDerWaalsContact O-N 3.07Å
77	E	91.6	Very high	89.9	Confident	47 Å²	47	62.8 Å²	62.8	22%	0.22	35%	0.353	C	S	.	.	H	α-helix	trans	-62.7	-40.1	178.2	-73.1	-166.4	117.3	0	0	112.6	R51 W73 M74 V80 V81	R51-E77 IonicContact CZ-OE1 3.15Å; R51-E77 IonicContact NE-OE1 3.1Å; R51-E77 PolarHBondContact NE-OE1 2.94Å; R51-E77 IonicContact NH2-OE1 3.36Å; R51-E77 PolarHBondContact NH2-OE1 3.24Å; W73-E77 HydrophobicContact CZ2-CG 4.02Å; W73-E77 VanDerWaalsContact NE1-CD 3.28Å; W73-E77 PolarHBondContact NE1-OE2 2.96Å; W73-E77 PolarHBondContact O-N 2.67Å; M74-E77 PolarHBondContact O-N 2.77Å; E77-V80 PolarHBondContact O-N 3.01Å; E77-V81 WeakPolarHBondContact O-CG2 3.39Å; E77-V81 PolarHBondContact O-N 3.33Å
78	L	91.1	Very high	89.9	Confident	104 Å²	104	59.9 Å²	59.9	55%	0.545	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-44.3	174.8	-74.9	169.8	0	0	0	111.7	M74 F76 V80 V81 E82	M74-L78 WeakPolarHBondContact O-CG 3.35Å; M74-L78 PolarHBondContact O-N 3.35Å; F76-L78 VanDerWaalsContact C-N 3.34Å; F76-L78 PolarHBondContact O-N 2.88Å; L78-V80 VanDerWaalsContact C-N 3.28Å; L78-V80 PolarHBondContact O-N 3.2Å; L78-V81 PolarHBondContact O-N 2.7Å; L78-V81 VanDerWaalsContact O-N 3.14Å; L78-E82 WeakPolarHBondContact O-CG 3.32Å; L78-E82 PolarHBondContact O-N 2.76Å
79	A	93.5	Very high	89.7	Confident	51 Å²	51	60.3 Å²	60.3	42%	0.421	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-37.6	176.6	0	0	0	0	0	112.4	S75 F76 A83	S75-A79 PolarHBondContact O-N 2.92Å; S75-A79 VanDerWaalsContact O-N 3.1Å; F76-A79 PolarHBondContact O-N 2.86Å; A79-A83 WeakPolarHBondContact O-CB 3.17Å; A79-A83 PolarHBondContact O-N 3.43Å
80	V	94.2	Very high	89.2	Confident	6 Å²	6	63 Å²	63	4%	0.036	36%	0.363	C	S	.	.	H	α-helix	trans	-66.1	-42.7	174.9	173.5	0	0	0	0	111.4	V17 L21 L47 F76 E77 L78 A83 K84	V17-V80 HydrophobicContact CG1-CG2 3.79Å; L21-V80 HydrophobicContact CD1-CB 4.47Å; L21-V80 HydrophobicContact CD1-CG1 4.4Å; L21-V80 HydrophobicContact CD1-CG2 4.12Å; L47-V80 HydrophobicContact CD1-CG1 3.89Å; L47-V80 HydrophobicContact CD2-CG1 4.13Å; L47-V80 HydrophobicContact CD2-CG2 4.26Å; F76-V80 HydrophobicContact CD1-CG2 4.42Å; F76-V80 HydrophobicContact CE1-CG2 3.98Å; F76-V80 HydrophobicContact CE2-CG2 4.35Å; F76-V80 HydrophobicContact CZ-CG2 3.95Å; F76-V80 WeakPolarHBondContact O-CG2 3.31Å; F76-V80 PolarHBondContact O-N 3.21Å; F76-V80 VanDerWaalsContact O-N 3.07Å; E77-V80 PolarHBondContact O-N 3.01Å; L78-V80 VanDerWaalsContact C-N 3.28Å; L78-V80 PolarHBondContact O-N 3.2Å; V80-A83 PolarHBondContact O-N 3.28Å; V80-K84 WeakPolarHBondContact O-CG 3.32Å; V80-K84 PolarHBondContact O-N 3.04Å
81	V	91.5	Very high	88.3	Confident	93 Å²	93	63.1 Å²	63.1	56%	0.564	36%	0.361	S	S	*	.	H	α-helix	trans	-62.9	-45	177.6	171.1	0	0	0	0	111	E77 L78 A83 K84 A85	E77-V81 WeakPolarHBondContact O-CG2 3.39Å; E77-V81 PolarHBondContact O-N 3.33Å; L78-V81 PolarHBondContact O-N 2.7Å; L78-V81 VanDerWaalsContact O-N 3.14Å; V81-A83 VanDerWaalsContact C-N 3.35Å; V81-A83 PolarHBondContact O-N 3.25Å; V81-K84 PolarHBondContact O-N 3.16Å; V81-A85 PolarHBondContact O-N 3.22Å
82	E	92	Very high	87	Confident	122 Å²	122	64 Å²	64	57%	0.57	36%	0.364	S	S	*	.	H	α-helix	trans	-60.9	-43.2	175.6	-72.3	177.6	178.9	0	0	111.8	L78 A85 Q86	L78-E82 WeakPolarHBondContact O-CG 3.32Å; L78-E82 PolarHBondContact O-N 2.76Å; E82-A85 PolarHBondContact O-N 2.94Å; E82-Q86 WeakPolarHBondContact O-CG 3.28Å; E82-Q86 PolarHBondContact O-N 2.9Å
83	A	91.5	Very high	85	Confident	23 Å²	23	68.3 Å²	68.3	19%	0.19	38%	0.382	C	S	.	.	H	α-helix	trans	-63.5	-41.7	176.9	0	0	0	0	0	112.2	L21 A79 V80 V81 Q86 I87	L21-A83 HydrophobicContact CD1-CB 3.86Å; L21-A83 HydrophobicContact CD2-CB 3.86Å; L21-A83 HydrophobicContact CG-CB 4.35Å; A79-A83 WeakPolarHBondContact O-CB 3.17Å; A79-A83 PolarHBondContact O-N 3.43Å; V80-A83 PolarHBondContact O-N 3.28Å; V81-A83 VanDerWaalsContact C-N 3.35Å; V81-A83 PolarHBondContact O-N 3.25Å; A83-Q86 PolarHBondContact O-N 3.16Å; A83-I87 WeakPolarHBondContact O-CD1 3.22Å; A83-I87 WeakPolarHBondContact O-CG1 3.36Å; A83-I87 PolarHBondContact O-N 3.36Å
84	K	90.8	Very high	82.7	Confident	39 Å²	39	73 Å²	73	17%	0.17	42%	0.417	C	S	.	.	H	α-helix	trans	-60.5	-45.8	173.9	-75.3	-176.6	174.2	-164.8	0	111.7	L21 M40 L43 D44 V80 V81 Q86 I87 D88	L21-K84 HydrophobicContact CD2-CG 4.44Å; M40-K84 HydrophobicContact CE-CB 4.4Å; M40-K84 HydrophobicContact CE-CD 4.3Å; M40-K84 HydrophobicContact CE-CG 4.05Å; M40-K84 HydrophobicContact SD-CD 3.8Å; M40-K84 WeakPolarHBondContact SD-CE 3.24Å; M40-K84 HydrophobicContact SD-CG 3.99Å; L43-K84 HydrophobicContact CD2-CD 4.44Å; L43-K84 HydrophobicContact CD2-CG 4.26Å; D44-K84 IonicContact OD1-NZ 3.86Å; D44-K84 PolarHBondContact OD1-NZ 3.37Å; V80-K84 WeakPolarHBondContact O-CG 3.32Å; V80-K84 PolarHBondContact O-N 3.04Å; V81-K84 PolarHBondContact O-N 3.16Å; K84-Q86 VanDerWaalsContact C-N 3.3Å; K84-Q86 PolarHBondContact O-N 3.46Å; K84-I87 PolarHBondContact O-N 2.9Å; K84-D88 PolarHBondContact O-N 2.75Å
85	A	87.5	Confident	80.2	Confident	58 Å²	58	77.6 Å²	77.6	48%	0.479	43%	0.434	S	S	.	.	H	α-helix	trans	-61.4	-37.4	177.4	0	0	0	0	0	112.5	V81 E82 I87 D88 S89	V81-A85 PolarHBondContact O-N 3.22Å; E82-A85 PolarHBondContact O-N 2.94Å; A85-I87 VanDerWaalsContact C-N 3.35Å; A85-D88 PolarHBondContact O-N 3.32Å; A85-S89 PolarHBondContact O-N 2.8Å; A85-S89 VanDerWaalsContact O-N 3.1Å; A85-S89 PolarHBondContact O-OG 3.15Å
86	Q	88.5	Confident	77.4	Confident	97 Å²	97	77.3 Å²	77.3	45%	0.453	44%	0.443	S	S	.	.	H	α-helix	trans	-66.3	-34.3	172.7	-71.4	177.8	21.1	0	0	113	E82 A83 K84 S89 L90	E82-Q86 WeakPolarHBondContact O-CG 3.28Å; E82-Q86 PolarHBondContact O-N 2.9Å; A83-Q86 PolarHBondContact O-N 3.16Å; K84-Q86 VanDerWaalsContact C-N 3.3Å; K84-Q86 PolarHBondContact O-N 3.46Å; Q86-S89 PolarHBondContact O-OG 3.01Å; Q86-L90 WeakPolarHBondContact O-CG 3.41Å; Q86-L90 PolarHBondContact O-N 2.89Å
87	I	87.8	Confident	74.4	Confident	3 Å²	3	84.2 Å²	84.2	2%	0.015	48%	0.48	C	S	.	.	H	α-helix	trans	-72.9	-40.3	177.2	-70	157.7	0	0	0	110.7	L21 M24 K25 A28 V36 A83 K84 A85 S89 L90 Q91	L21-I87 HydrophobicContact CD2-CD1 4Å; M24-I87 HydrophobicContact CB-CD1 3.63Å; M24-I87 HydrophobicContact CB-CG1 4.4Å; M24-I87 HydrophobicContact CE-CD1 4.26Å; M24-I87 HydrophobicContact CE-CG2 4.27Å; K25-I87 HydrophobicContact CB-CG1 4.45Å; A28-I87 HydrophobicContact CB-CG2 4.15Å; V36-I87 HydrophobicContact CG1-CG2 3.56Å; A83-I87 WeakPolarHBondContact O-CD1 3.22Å; A83-I87 WeakPolarHBondContact O-CG1 3.36Å; A83-I87 PolarHBondContact O-N 3.36Å; K84-I87 PolarHBondContact O-N 2.9Å; A85-I87 VanDerWaalsContact C-N 3.35Å; I87-S89 VanDerWaalsContact C-N 3.31Å; I87-S89 PolarHBondContact O-N 3.27Å; I87-L90 WeakPolarHBondContact O-CB 3.41Å; I87-L90 PolarHBondContact O-N 3.13Å; I87-Q91 PolarHBondContact O-N 3Å
88	D	82.8	Confident	71.7	Confident	90 Å²	90	86.4 Å²	86.4	48%	0.481	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-36.3	177.7	-71.9	-21.5	0	0	0	111.5	K84 A85 L90 Q91	K84-D88 PolarHBondContact O-N 2.75Å; A85-D88 PolarHBondContact O-N 3.32Å; D88-L90 VanDerWaalsContact C-N 3.28Å; D88-L90 PolarHBondContact O-N 3.14Å; D88-Q91 PolarHBondContact O-N 3.09Å
89	S	81.1	Confident	68.8	Low	97 Å²	97	90.1 Å²	90.1	68%	0.678	52%	0.517	S	S	*	.	H	α-helix	trans	-71.5	-18.6	175.2	69.6	0	0	0	0	114.3	A85 Q86 I87	A85-S89 PolarHBondContact O-N 2.8Å; A85-S89 VanDerWaalsContact O-N 3.1Å; A85-S89 PolarHBondContact O-OG 3.15Å; Q86-S89 PolarHBondContact O-OG 3.01Å; I87-S89 VanDerWaalsContact C-N 3.31Å; I87-S89 PolarHBondContact O-N 3.27Å
90	L	79.1	Confident	65.9	Low	73 Å²	73	96.7 Å²	96.7	38%	0.382	54%	0.537	S	S	.	.	H	α-helix	trans	-82.7	-14.3	171.8	-70.9	169.2	0	0	0	112.7	K25 A28 Q86 I87 D88	K25-L90 HydrophobicContact CG-CD1 4.22Å; A28-L90 HydrophobicContact CB-CB 3.92Å; A28-L90 HydrophobicContact CB-CD1 4.21Å; Q86-L90 WeakPolarHBondContact O-CG 3.41Å; Q86-L90 PolarHBondContact O-N 2.89Å; I87-L90 WeakPolarHBondContact O-CB 3.41Å; I87-L90 PolarHBondContact O-N 3.13Å; D88-L90 VanDerWaalsContact C-N 3.28Å; D88-L90 PolarHBondContact O-N 3.14Å
91	Q	67.2	Low	62.9	Low	52 Å²	52	100.9 Å²	100.9	24%	0.243	57%	0.572	C	S	.	*	S	Bend	trans	-75.3	131.6	171.6	-58.9	-156.2	-1.9	0	0	109.1	V36 I87 D88 E93	V36-Q91 VanDerWaalsContact CG1-NE2 3.26Å; I87-Q91 PolarHBondContact O-N 3Å; D88-Q91 PolarHBondContact O-N 3.09Å; Q91-E93 PolarHBondContact O-N 3.12Å
92	P	60.3	Low	59.9	Low	88 Å²	88	101 Å²	101	57%	0.571	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-60	119.2	177.5	24.5	-29.9	0	0	0	107.8	H33 S94	H33-P92 WeakPolarHBondContact CE1-CD 3.44Å; H33-P92 WeakPolarHBondContact NE2-CD 3.4Å; H33-P92 WeakPolarHBondContact NE2-CG 3.3Å; P92-S94 PolarHBondContact O-N 3.26Å; P92-S94 VanDerWaalsContact O-N 3.09Å
93	E	47.6	Very low	57	Low	179 Å²	179	104.3 Å²	104.3	84%	0.836	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-47.5	123.4	165.5	-71.8	-174.2	161.2	0	0	106.9	Q91 K95	Q91-E93 PolarHBondContact O-N 3.12Å; E93-K95 PolarHBondContact O-N 3.29Å
94	S	43.7	Very low	54	Low	114 Å²	114	109 Å²	109	80%	0.797	63%	0.63	S	S	*	*			trans	-43.3	110.1	172.9	50.3	0	0	0	0	107.7	P92 G96	P92-S94 PolarHBondContact O-N 3.26Å; P92-S94 VanDerWaalsContact O-N 3.09Å; S94-G96 VanDerWaalsContact C-N 3.27Å; S94-G96 PolarHBondContact O-N 3.02Å
95	K	36.9	Very low	51.2	Low	203 Å²	203	116.1 Å²	116.1	88%	0.883	66%	0.664	S	S	*	*			trans	-46.4	89.2	-172.4	-69.1	-179.8	175	179.2	0	111.1	E93	E93-K95 PolarHBondContact O-N 3.29Å
96	G	33.2	Very low	48.6	Very low	66 Å²	66	121.3 Å²	121.3	68%	0.68	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-66.3	130	146.7	0	0	0	0	0	105.8	S94	S94-G96 VanDerWaalsContact C-N 3.27Å; S94-G96 PolarHBondContact O-N 3.02Å
97	L	30.7	Very low	46.1	Very low	163 Å²	163	123.2 Å²	123.2	85%	0.853	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-51.6	147.7	-178.2	-79.1	123.6	0	0	0	111.9	L99	L97-L99 PolarHBondContact O-N 2.88Å
98	P	33.7	Very low	43.6	Very low	94 Å²	94	132.7 Å²	132.7	61%	0.61	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-58.7	132.4	-168.5	-19.1	30.3	0	0	0	112.2	F100	P98-F100 VanDerWaalsContact C-N 3.28Å; P98-F100 HydrophobicContact CB-CE2 4.37Å; P98-F100 PolarHBondContact O-N 3.41Å
99	L	30.8	Very low	41.3	Very low	181 Å²	181	131.3 Å²	131.3	95%	0.948	75%	0.747	S	S	*	*			trans	-59.3	88.3	165.5	-78.7	152.1	0	0	0	109	L97 A101	L97-L99 PolarHBondContact O-N 2.88Å; L99-A101 PolarHBondContact O-N 2.8Å
100	F	33.5	Very low	39.5	Very low	189 Å²	189	132.3 Å²	132.3	83%	0.829	75%	0.752	S	S	*	*			trans	-68.8	122	162.8	-82.5	-81.2	0	0	0	108.1	P98	P98-F100 VanDerWaalsContact C-N 3.28Å; P98-F100 HydrophobicContact CB-CE2 4.37Å; P98-F100 PolarHBondContact O-N 3.41Å
101	A	31.5	Very low	37.6	Very low	95 Å²	95	137.4 Å²	137.4	79%	0.785	78%	0.778	S	S	*	*			trans	-54.5	135.3	176.9	0	0	0	0	0	111.2	L99	L99-A101 PolarHBondContact O-N 2.8Å
102	A	28.1	Very low	36.5	Very low	96 Å²	96	144.1 Å²	144.1	79%	0.793	81%	0.809	S	S	*	*			trans	16.7	103.9	152.9	0	0	0	0	0	117.3
103	E	30.8	Very low	35.7	Very low	190 Å²	190	142.6 Å²	142.6	89%	0.888	81%	0.809	S	S	*	*			trans	-152	121.8	134.4	-111.6	168.6	-157.2	0	0	109.1	Q105	E103-Q105 PolarHBondContact O-N 2.81Å; E103-Q105 VanDerWaalsContact O-N 3.15Å
104	S	29.2	Very low	35.7	Very low	123 Å²	123	139.6 Å²	139.6	86%	0.86	81%	0.805	S	S	*	*			trans	-59.9	105.5	-177.7	36.2	0	0	0	0	111.9
105	Q	30.6	Very low	35.9	Very low	187 Å²	187	142 Å²	142	87%	0.874	80%	0.803	S	S	*	*			trans	-137	131.3	161.1	-70	-168.3	-11.9	0	0	110.3	E103	E103-Q105 PolarHBondContact O-N 2.81Å; E103-Q105 VanDerWaalsContact O-N 3.15Å
106	E	32.8	Very low	37	Very low	167 Å²	167	138.8 Å²	138.8	78%	0.78	80%	0.796	S	S	*	*			trans	-51.6	148.3	-175.2	-66.4	173.9	147.5	0	0	113.9	K108	E106-K108 PolarHBondContact O-N 2.78Å
107	P	35.7	Very low	38.9	Very low	138 Å²	138	141.3 Å²	141.3	90%	0.896	80%	0.8	S	S	*	*			trans	-71.5	96.2	-170.2	29.9	-34.6	0	0	0	111.2
108	K	36.8	Very low	40.9	Very low	201 Å²	201	142.2 Å²	142.2	87%	0.874	80%	0.797	S	S	*	*			trans	-99.4	101.3	166.7	-70.9	-178.7	-179	172.1	0	109.7	E106	E106-K108 PolarHBondContact O-N 2.78Å
109	G	34.2	Very low	43.2	Very low	61 Å²	61	143.9 Å²	143.9	63%	0.629	79%	0.791	S	S	*	*	S	Bend	trans	130.1	128.7	158.3	0	0	0	0	0	115.2	L111	G109-L111 PolarHBondContact O-N 2.8Å
110	P	43.7	Very low	45.9	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	78%	0.779	S	S	*	*			trans	-70.4	125.1	175.8	26.7	-30.2	0	0	0	111.2	H112	P110-H112 PolarHBondContact O-N 3.36Å
111	L	39.2	Very low	48.5	Very low	179 Å²	179	134.6 Å²	134.6	94%	0.937	75%	0.751	S	S	*	*			trans	-55.9	118.1	176.9	-78.1	143.2	0	0	0	111.5	G109 G113	G109-L111 PolarHBondContact O-N 2.8Å; L111-G113 PolarHBondContact O-N 2.84Å
112	H	43.2	Very low	51.3	Low	194 Å²	194	130.8 Å²	130.8	90%	0.898	72%	0.718	S	S	*	*			trans	-76	81.2	173.4	-74.4	-76.1	0	0	0	110.8	P110	P110-H112 PolarHBondContact O-N 3.36Å
113	G	43	Very low	54.5	Low	55 Å²	55	130.1 Å²	130.1	57%	0.567	70%	0.704	S	S	*	*			trans	-78.9	157.2	166	0	0	0	0	0	112.3	L111	L111-G113 PolarHBondContact O-N 2.84Å
114	P	48.2	Very low	57.7	Low	117 Å²	117	121.2 Å²	121.2	76%	0.76	66%	0.662	S	S	*	*			trans	-55.2	139.6	175.3	22.3	-31.7	0	0	0	111.1	L116	P114-L116 VanDerWaalsContact C-N 3.29Å; P114-L116 PolarHBondContact O-N 2.77Å
115	H	47.1	Very low	60.8	Low	163 Å²	163	119.5 Å²	119.5	76%	0.755	64%	0.644	S	S	*	*			trans	-73.2	80.6	-172.3	-153.5	-63.4	0	0	0	110.8
116	L	60.5	Low	63.8	Low	137 Å²	137	111.2 Å²	111.2	72%	0.717	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-59	150.9	173.8	-68.6	166	0	0	0	110.2	P114	P114-L116 VanDerWaalsContact C-N 3.29Å; P114-L116 PolarHBondContact O-N 2.77Å
117	P	73.5	Confident	66.7	Low	118 Å²	118	106.5 Å²	106.5	77%	0.766	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-51	146.2	170.7	-24.9	33.8	0	0	0	110.6	W119	P117-W119 PolarHBondContact O-N 2.93Å
118	K	73.3	Confident	69.5	Low	183 Å²	183	100.9 Å²	100.9	80%	0.796	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-57.6	116.2	175.5	-70.7	-175.9	179.9	-179.3	0	108.7	N120	K118-N120 PolarHBondContact O-N 2.8Å
119	W	81.9	Confident	72.2	Confident	128 Å²	128	92.6 Å²	92.6	49%	0.485	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-63.8	128.6	171.9	179.2	87.9	0	0	0	108.8	P117 L121 P122 Q137 V142	P117-W119 PolarHBondContact O-N 2.93Å; W119-L121 HydrophobicContact CH2-CD1 3.93Å; W119-L121 HydrophobicContact CZ3-CB 4.5Å; W119-L121 HydrophobicContact CZ3-CD1 4.12Å; W119-P122 VanDerWaalsContact CH2-CD 3.49Å; W119-P122 VanDerWaalsContact CZ2-CD 3.4Å; W119-P122 HydrophobicContact CZ2-CG 4.28Å; W119-Q137 WeakPolarHBondContact CZ2-O 3.43Å; W119-V142 HydrophobicContact CH2-CG2 4.24Å
120	N	86.2	Confident	75	Confident	130 Å²	130	93.6 Å²	93.6	70%	0.695	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-98.9	145.2	176.7	-67	-46.1	0	0	0	109	K118	K118-N120 PolarHBondContact O-N 2.8Å
121	L	88.6	Confident	77.4	Confident	46 Å²	46	88.4 Å²	88.4	24%	0.241	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-59.9	125.7	174.7	-170.3	71.9	0	0	0	109.7	W119 F138 V142 Y156 S159 A160	W119-L121 HydrophobicContact CH2-CD1 3.93Å; W119-L121 HydrophobicContact CZ3-CB 4.5Å; W119-L121 HydrophobicContact CZ3-CD1 4.12Å; L121-F138 HydrophobicContact CD1-CD2 4.09Å; L121-F138 HydrophobicContact CD1-CE2 4.06Å; L121-V142 HydrophobicContact CD1-CG2 3.61Å; L121-Y156 HydrophobicContact CD2-CD1 4.23Å; L121-Y156 WeakPolarHBondContact CD2-O 3.38Å; L121-S159 WeakPolarHBondContact CD2-OG 3.36Å; L121-A160 HydrophobicContact CD2-CB 3.86Å; L121-A160 HydrophobicContact CG-CB 4Å
122	P	91.4	Very high	79.9	Confident	14 Å²	14	82.4 Å²	82.4	9%	0.091	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-67.1	152.5	-179.9	31.1	-38.3	0	0	0	110	W119 F134 Q137 F138 A160	W119-P122 VanDerWaalsContact CH2-CD 3.49Å; W119-P122 VanDerWaalsContact CZ2-CD 3.4Å; W119-P122 HydrophobicContact CZ2-CG 4.28Å; P122-F134 HydrophobicContact CB-CD2 4Å; P122-F134 HydrophobicContact CB-CE2 4.49Å; P122-F134 HydrophobicContact CG-CD2 3.97Å; P122-F134 HydrophobicContact CG-CE2 4.13Å; P122-Q137 HydrophobicContact CB-CB 4.15Å; P122-Q137 HydrophobicContact CG-CB 3.85Å; P122-F138 HydrophobicContact CG-CB 4.21Å; P122-A160 VanDerWaalsContact O-CB 3.23Å; P122-A160 WeakPolarHBondContact O-CB 3.36Å
123	V	94.8	Very high	82.3	Confident	83 Å²	83	75.3 Å²	75.3	50%	0.503	42%	0.416	S	S	.	.			trans	-113.8	137.3	-179.5	178.2	0	0	0	0	109.8	A160 K162	V123-A160 CarbonylContact C-O 3.59Å; V123-A160 VanDerWaalsContact CA-O 3.24Å; V123-A160 WeakPolarHBondContact CA-O 3.49Å; V123-K162 HydrophobicContact CG1-CD 3.57Å; V123-K162 HydrophobicContact CG1-CG 3.86Å
124	F	97.8	Very high	84.8	Confident	3 Å²	3	73 Å²	73	1%	0.013	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-133.3	125.3	179.7	179.7	-113.8	0	0	0	112.1	G126 N127 F131 F134 A160 L161 K162 A165 F190	F124-G126 VanDerWaalsContact CZ-CA 3.45Å; F124-N127 VanDerWaalsContact CE2-O 3.28Å; F124-N127 WeakPolarHBondContact CE2-O 3.47Å; F124-F131 AromaticContact CE1-CD2 3.79Å; F124-F131 HydrophobicContact CE1-CD2 3.79Å; F124-F131 HydrophobicContact CE1-CE2 4.4Å; F124-F131 HydrophobicContact CE2-CB 3.98Å; F124-F131 HydrophobicContact CE2-CD2 4.15Å; F124-F131 HydrophobicContact CZ-CB 4.02Å; F124-F131 AromaticContact CZ-CD2 3.59Å; F124-F131 HydrophobicContact CZ-CD2 3.59Å; F124-F131 HydrophobicContact CZ-CG 4.3Å; F124-F134 HydrophobicContact CB-CB 4.1Å; F124-F134 HydrophobicContact CB-CD1 3.61Å; F124-F134 HydrophobicContact CB-CD2 3.4Å; F124-F134 VanDerWaalsContact CB-CD2 3.4Å; F124-F134 HydrophobicContact CB-CE1 3.8Å; F124-F134 HydrophobicContact CB-CE2 3.59Å; F124-F134 HydrophobicContact CB-CG 3.4Å; F124-F134 VanDerWaalsContact CB-CG 3.4Å; F124-F134 HydrophobicContact CB-CZ 3.78Å; F124-F134 AromaticContact CD1-CD1 3.97Å; F124-F134 HydrophobicContact CD1-CD1 3.97Å; F124-F134 HydrophobicContact CD1-CE1 4.01Å; F124-F134 HydrophobicContact CD2-CB 3.98Å; F124-F134 HydrophobicContact CD2-CD1 4.09Å; F124-F134 HydrophobicContact CD2-CG 4.05Å; F124-F134 HydrophobicContact CG-CB 4.23Å; F124-F134 AromaticContact CG-CD1 3.63Å; F124-F134 HydrophobicContact CG-CD1 3.63Å; F124-F134 HydrophobicContact CG-CD2 4.29Å; F124-F134 HydrophobicContact CG-CE1 4Å; F124-F134 AromaticContact CG-CG 3.78Å; F124-F134 HydrophobicContact CG-CG 3.78Å; F124-F134 HydrophobicContact CG-CZ 4.47Å; F124-A160 PolarHBondContact N-O 3.14Å; F124-L161 HydrophobicContact CB-CD2 4.28Å; F124-L161 HydrophobicContact CD1-CD2 3.91Å; F124-L161 CarbonylContact O-C 3.51Å; F124-L161 WeakPolarHBondContact O-CA 3.19Å; F124-K162 PolarHBondContact O-N 3.45Å; F124-A165 HydrophobicContact CD1-CB 3.4Å; F124-A165 HydrophobicContact CE1-CB 3.49Å; F124-A165 VanDerWaalsContact CE1-CB 3.49Å; F124-A165 HydrophobicContact CG-CB 4.44Å; F124-F190 HydrophobicContact CE1-CB 4.19Å; F124-F190 AromaticContact CE1-CD2 3.97Å; F124-F190 HydrophobicContact CE1-CD2 3.97Å; F124-F190 HydrophobicContact CE1-CE2 4.49Å; F124-F190 AromaticContact CE1-CG 3.97Å; F124-F190 HydrophobicContact CE1-CG 3.97Å; F124-F190 HydrophobicContact CZ-CB 3.9Å; F124-F190 HydrophobicContact CZ-CD1 4.28Å; F124-F190 HydrophobicContact CZ-CD2 4.43Å; F124-F190 AromaticContact CZ-CG 3.96Å; F124-F190 HydrophobicContact CZ-CG 3.96Å
125	D	95	Very high	87.1	Confident	87 Å²	87	68.1 Å²	68.1	47%	0.465	36%	0.357	S	S	.	.			trans	-99.8	-11.9	-174.6	63.8	-3.9	0	0	0	114.3	N127 K162 G163 A164 A165	D125-N127 WeakPolarHBondContact OD1-CB 3.37Å; D125-N127 PolarHBondContact OD1-N 3.24Å; D125-K162 CarbonylContact C-O 3.52Å; D125-K162 VanDerWaalsContact CA-O 3.31Å; D125-K162 WeakPolarHBondContact CA-O 3.36Å; D125-K162 HydrophobicContact CB-CB 4.36Å; D125-K162 VanDerWaalsContact O-O 3.08Å; D125-G163 CarbonylContact O-C 3.55Å; D125-A164 PolarHBondContact O-N 2.74Å; D125-A165 PolarHBondContact O-N 3.26Å
126	G	92.9	Very high	89.3	Confident	13 Å²	13	64.8 Å²	64.8	13%	0.134	34%	0.344	C	S	.	.	S	Bend	trans	111.4	0.7	-174.8	0	0	0	0	0	114.7	F124 V128 F190	F124-G126 VanDerWaalsContact CZ-CA 3.45Å; G126-V128 PolarHBondContact O-N 2.79Å; G126-V128 VanDerWaalsContact O-N 3.11Å; G126-F190 VanDerWaalsContact O-CD1 3.25Å; G126-F190 WeakPolarHBondContact O-CD1 3.37Å; G126-F190 WeakPolarHBondContact O-CE1 3.25Å
127	N	94.3	Very high	90.9	Very high	68 Å²	68	62.6 Å²	62.6	36%	0.364	33%	0.33	S	S	.	.			trans	-67.1	109.4	172.3	-178.4	2.6	0	0	0	111	F124 D125 L129 E130 F131	F124-N127 VanDerWaalsContact CE2-O 3.28Å; F124-N127 WeakPolarHBondContact CE2-O 3.47Å; D125-N127 WeakPolarHBondContact OD1-CB 3.37Å; D125-N127 PolarHBondContact OD1-N 3.24Å; N127-L129 PolarHBondContact O-N 3.12Å; N127-L129 VanDerWaalsContact O-N 3.1Å; N127-L129 PolarHBondContact OD1-N 3.32Å; N127-L129 VanDerWaalsContact OD1-N 3.14Å; N127-E130 HydrophobicContact CB-CG 4.37Å; N127-E130 PolarHBondContact O-N 2.92Å; N127-F131 PolarHBondContact O-N 3.17Å
128	V	93.3	Very high	92	Very high	19 Å²	19	57 Å²	57	12%	0.115	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-53	-35	-177.8	174.3	0	0	0	0	113	G126 E130 F131 F190 L195 I196	G126-V128 PolarHBondContact O-N 2.79Å; G126-V128 VanDerWaalsContact O-N 3.11Å; V128-E130 PolarHBondContact O-N 3.32Å; V128-F131 WeakPolarHBondContact O-CB 3.29Å; V128-F131 PolarHBondContact O-N 3.41Å; V128-F190 HydrophobicContact CG2-CD1 4.2Å; V128-L195 HydrophobicContact CG1-CD2 4.02Å; V128-L195 HydrophobicContact CG1-CG 4.09Å; V128-L195 HydrophobicContact CG2-CD2 3.8Å; V128-I196 HydrophobicContact CG1-CB 4.14Å; V128-I196 HydrophobicContact CG1-CD1 4.49Å; V128-I196 HydrophobicContact CG1-CG1 3.31Å
129	L	93.7	Very high	93	Very high	28 Å²	28	51.1 Å²	51.1	15%	0.147	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-66.7	-23	-179.9	-59.3	-173.3	0	0	0	113.6	N127 N199 W227	N127-L129 PolarHBondContact O-N 3.12Å; N127-L129 VanDerWaalsContact O-N 3.1Å; N127-L129 PolarHBondContact OD1-N 3.32Å; N127-L129 VanDerWaalsContact OD1-N 3.14Å; L129-N199 HydrophobicContact CD2-CB 3.58Å; L129-N199 HydrophobicContact CG-CB 4.44Å; L129-W227 HydrophobicContact CD1-CH2 4.02Å
130	E	93.4	Very high	93.4	Very high	81 Å²	81	48.7 Å²	48.7	38%	0.379	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-99.2	-4.9	-179.2	-59.8	-61.2	140.6	0	0	112.4	N127 V128 V132 A133 F134 W227	N127-E130 HydrophobicContact CB-CG 4.37Å; N127-E130 PolarHBondContact O-N 2.92Å; V128-E130 PolarHBondContact O-N 3.32Å; E130-V132 PolarHBondContact O-N 3.47Å; E130-A133 PolarHBondContact O-N 3.24Å; E130-F134 WeakPolarHBondContact O-CB 3.04Å; E130-F134 PolarHBondContact O-N 2.94Å; E130-W227 WeakPolarHBondContact OE1-CZ2 3.44Å
131	F	95	Very high	93.5	Very high	11 Å²	11	43.3 Å²	43.3	5%	0.048	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-43	-172.7	-179.9	-92	0	0	0	112.6	F124 N127 V128 F134 W135 L186 K187 F190	F124-F131 AromaticContact CE1-CD2 3.79Å; F124-F131 HydrophobicContact CE1-CD2 3.79Å; F124-F131 HydrophobicContact CE1-CE2 4.4Å; F124-F131 HydrophobicContact CE2-CB 3.98Å; F124-F131 HydrophobicContact CE2-CD2 4.15Å; F124-F131 HydrophobicContact CZ-CB 4.02Å; F124-F131 AromaticContact CZ-CD2 3.59Å; F124-F131 HydrophobicContact CZ-CD2 3.59Å; F124-F131 HydrophobicContact CZ-CG 4.3Å; N127-F131 PolarHBondContact O-N 3.17Å; V128-F131 WeakPolarHBondContact O-CB 3.29Å; V128-F131 PolarHBondContact O-N 3.41Å; F131-F134 PolarHBondContact O-N 3.23Å; F131-W135 HydrophobicContact CD1-CB 4.38Å; F131-W135 HydrophobicContact CE1-CB 3.95Å; F131-W135 HydrophobicContact CE1-CG 4.29Å; F131-W135 HydrophobicContact CZ-CB 4.16Å; F131-W135 HydrophobicContact CZ-CD2 4.46Å; F131-W135 HydrophobicContact CZ-CE3 4.37Å; F131-W135 HydrophobicContact CZ-CG 4.35Å; F131-W135 VanDerWaalsContact O-CB 3.32Å; F131-W135 WeakPolarHBondContact O-CB 3.3Å; F131-W135 PolarHBondContact O-N 2.74Å; F131-L186 HydrophobicContact CE2-CB 4.24Å; F131-K187 HydrophobicContact CZ-CG 4.05Å; F131-F190 HydrophobicContact CB-CB 4.44Å; F131-F190 HydrophobicContact CD2-CB 3.57Å; F131-F190 HydrophobicContact CE2-CB 4.06Å; F131-F190 HydrophobicContact CG-CB 4.1Å
132	V	91.7	Very high	93.8	Very high	53 Å²	53	41.3 Å²	41.3	32%	0.321	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-52	-178.7	-179.1	0	0	0	0	110.2	E130 F134 W135 D136 I196 M235	E130-V132 PolarHBondContact O-N 3.47Å; V132-F134 VanDerWaalsContact C-N 3.3Å; V132-F134 PolarHBondContact O-N 3.29Å; V132-W135 PolarHBondContact O-N 3.43Å; V132-D136 WeakPolarHBondContact O-CB 3.4Å; V132-D136 VanDerWaalsContact O-CG 3.29Å; V132-D136 PolarHBondContact O-N 2.96Å; V132-I196 HydrophobicContact CG2-CD1 4Å; V132-M235 HydrophobicContact CG2-SD 3.92Å
133	A	91.7	Very high	94	Very high	45 Å²	45	43 Å²	43	37%	0.372	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-36.9	179.6	0	0	0	0	0	112.7	E130 Q137	E130-A133 PolarHBondContact O-N 3.24Å; A133-Q137 VanDerWaalsContact O-CG 3.31Å; A133-Q137 WeakPolarHBondContact O-CG 3.43Å; A133-Q137 PolarHBondContact O-N 2.94Å; A133-Q137 PolarHBondContact O-NE2 3.03Å
134	F	96.2	Very high	94	Very high	7 Å²	7	42.1 Å²	42.1	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-51.6	173	162	-106.6	0	0	0	111.7	P122 F124 E130 F131 V132 D136 Q137 F138 L157 A160 L161	P122-F134 HydrophobicContact CB-CD2 4Å; P122-F134 HydrophobicContact CB-CE2 4.49Å; P122-F134 HydrophobicContact CG-CD2 3.97Å; P122-F134 HydrophobicContact CG-CE2 4.13Å; F124-F134 HydrophobicContact CB-CB 4.1Å; F124-F134 HydrophobicContact CB-CD1 3.61Å; F124-F134 HydrophobicContact CB-CD2 3.4Å; F124-F134 VanDerWaalsContact CB-CD2 3.4Å; F124-F134 HydrophobicContact CB-CE1 3.8Å; F124-F134 HydrophobicContact CB-CE2 3.59Å; F124-F134 HydrophobicContact CB-CG 3.4Å; F124-F134 VanDerWaalsContact CB-CG 3.4Å; F124-F134 HydrophobicContact CB-CZ 3.78Å; F124-F134 AromaticContact CD1-CD1 3.97Å; F124-F134 HydrophobicContact CD1-CD1 3.97Å; F124-F134 HydrophobicContact CD1-CE1 4.01Å; F124-F134 HydrophobicContact CD2-CB 3.98Å; F124-F134 HydrophobicContact CD2-CD1 4.09Å; F124-F134 HydrophobicContact CD2-CG 4.05Å; F124-F134 HydrophobicContact CG-CB 4.23Å; F124-F134 AromaticContact CG-CD1 3.63Å; F124-F134 HydrophobicContact CG-CD1 3.63Å; F124-F134 HydrophobicContact CG-CD2 4.29Å; F124-F134 HydrophobicContact CG-CE1 4Å; F124-F134 AromaticContact CG-CG 3.78Å; F124-F134 HydrophobicContact CG-CG 3.78Å; F124-F134 HydrophobicContact CG-CZ 4.47Å; E130-F134 WeakPolarHBondContact O-CB 3.04Å; E130-F134 PolarHBondContact O-N 2.94Å; F131-F134 PolarHBondContact O-N 3.23Å; V132-F134 VanDerWaalsContact C-N 3.3Å; V132-F134 PolarHBondContact O-N 3.29Å; F134-D136 PolarHBondContact O-N 2.71Å; F134-Q137 PolarHBondContact O-N 3.36Å; F134-F138 HydrophobicContact CE2-CB 4.14Å; F134-F138 HydrophobicContact CE2-CD2 4.32Å; F134-F138 HydrophobicContact CE2-CG 4.45Å; F134-F138 HydrophobicContact CZ-CB 4.18Å; F134-F138 HydrophobicContact CZ-CD2 4.29Å; F134-F138 HydrophobicContact CZ-CG 4.24Å; F134-F138 WeakPolarHBondContact O-CB 3.42Å; F134-F138 PolarHBondContact O-N 2.89Å; F134-L157 HydrophobicContact CZ-CD1 4.31Å; F134-A160 HydrophobicContact CE2-CB 4.08Å; F134-A160 HydrophobicContact CZ-CB 4.42Å; F134-L161 HydrophobicContact CE1-CD2 4.31Å; F134-L161 HydrophobicContact CZ-CD2 4Å
135	W	96.4	Very high	93.6	Very high	14 Å²	14	47.2 Å²	47.2	5%	0.053	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-44.6	-173.9	-176.3	-98.1	0	0	0	110.6	F131 V132 Q137 F138 E139 H143 V183	F131-W135 HydrophobicContact CD1-CB 4.38Å; F131-W135 HydrophobicContact CE1-CB 3.95Å; F131-W135 HydrophobicContact CE1-CG 4.29Å; F131-W135 HydrophobicContact CZ-CB 4.16Å; F131-W135 HydrophobicContact CZ-CD2 4.46Å; F131-W135 HydrophobicContact CZ-CE3 4.37Å; F131-W135 HydrophobicContact CZ-CG 4.35Å; F131-W135 VanDerWaalsContact O-CB 3.32Å; F131-W135 WeakPolarHBondContact O-CB 3.3Å; F131-W135 PolarHBondContact O-N 2.74Å; V132-W135 PolarHBondContact O-N 3.43Å; W135-Q137 VanDerWaalsContact C-N 3.31Å; W135-Q137 PolarHBondContact O-N 2.96Å; W135-F138 HydrophobicContact CZ3-CD1 4.14Å; W135-F138 CarbonylContact O-C 3.44Å; W135-F138 PolarHBondContact O-N 3.31Å; W135-E139 PolarHBondContact NE1-OE1 3.31Å; W135-E139 WeakPolarHBondContact O-CA 3.48Å; W135-E139 WeakPolarHBondContact O-CB 3.44Å; W135-E139 PolarHBondContact O-N 3.48Å; W135-H143 AromaticContact CZ2-CD2 3.84Å; W135-V183 HydrophobicContact CH2-CB 4.14Å; W135-V183 HydrophobicContact CH2-CG1 3.31Å; W135-V183 HydrophobicContact CH2-CG2 3.79Å; W135-V183 HydrophobicContact CZ2-CG1 3.9Å; W135-V183 HydrophobicContact CZ3-CG1 4.02Å; W135-V183 HydrophobicContact CZ3-CG2 4.24Å
136	D	93.2	Very high	93.4	Very high	92 Å²	92	50.9 Å²	50.9	49%	0.492	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-42.3	178.6	-68.8	-7.1	0	0	0	111.8	V132 F134 E139 A140	V132-D136 WeakPolarHBondContact O-CB 3.4Å; V132-D136 VanDerWaalsContact O-CG 3.29Å; V132-D136 PolarHBondContact O-N 2.96Å; F134-D136 PolarHBondContact O-N 2.71Å; D136-E139 PolarHBondContact O-N 2.83Å; D136-A140 WeakPolarHBondContact O-CB 3.45Å; D136-A140 PolarHBondContact O-N 3.25Å
137	Q	93.7	Very high	93.3	Very high	91 Å²	91	56.3 Å²	56.3	43%	0.425	30%	0.301	S	S	.	.	H	α-helix	trans	-67.9	-44.2	176.5	-74.6	177.5	72	0	0	112.1	W119 P122 A133 F134 W135 E139 G141	W119-Q137 WeakPolarHBondContact CZ2-O 3.43Å; P122-Q137 HydrophobicContact CB-CB 4.15Å; P122-Q137 HydrophobicContact CG-CB 3.85Å; A133-Q137 VanDerWaalsContact O-CG 3.31Å; A133-Q137 WeakPolarHBondContact O-CG 3.43Å; A133-Q137 PolarHBondContact O-N 2.94Å; A133-Q137 PolarHBondContact O-NE2 3.03Å; F134-Q137 PolarHBondContact O-N 3.36Å; W135-Q137 VanDerWaalsContact C-N 3.31Å; W135-Q137 PolarHBondContact O-N 2.96Å; Q137-E139 VanDerWaalsContact C-N 3.27Å; Q137-E139 PolarHBondContact O-N 3.13Å; Q137-G141 PolarHBondContact O-N 3.41Å
138	F	96.5	Very high	93.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-34.6	178	-173.2	-90.9	0	0	0	111.1	L121 P122 F134 W135 V142 H143 L157 A160	L121-F138 HydrophobicContact CD1-CD2 4.09Å; L121-F138 HydrophobicContact CD1-CE2 4.06Å; P122-F138 HydrophobicContact CG-CB 4.21Å; F134-F138 HydrophobicContact CE2-CB 4.14Å; F134-F138 HydrophobicContact CE2-CD2 4.32Å; F134-F138 HydrophobicContact CE2-CG 4.45Å; F134-F138 HydrophobicContact CZ-CB 4.18Å; F134-F138 HydrophobicContact CZ-CD2 4.29Å; F134-F138 HydrophobicContact CZ-CG 4.24Å; F134-F138 WeakPolarHBondContact O-CB 3.42Å; F134-F138 PolarHBondContact O-N 2.89Å; W135-F138 HydrophobicContact CZ3-CD1 4.14Å; W135-F138 CarbonylContact O-C 3.44Å; W135-F138 PolarHBondContact O-N 3.31Å; F138-V142 HydrophobicContact CD1-CB 4.48Å; F138-V142 HydrophobicContact CD2-CB 4.32Å; F138-V142 HydrophobicContact CD2-CG2 4.25Å; F138-V142 HydrophobicContact CE1-CB 4.1Å; F138-V142 HydrophobicContact CE1-CG1 4.19Å; F138-V142 HydrophobicContact CE2-CB 3.93Å; F138-V142 HydrophobicContact CE2-CG1 4.1Å; F138-V142 HydrophobicContact CE2-CG2 3.97Å; F138-V142 HydrophobicContact CZ-CB 3.79Å; F138-V142 HydrophobicContact CZ-CG1 3.65Å; F138-V142 HydrophobicContact CZ-CG2 4.33Å; F138-V142 WeakPolarHBondContact O-CA 3.5Å; F138-V142 WeakPolarHBondContact O-CB 3.3Å; F138-V142 PolarHBondContact O-N 2.97Å; F138-H143 HydrophobicContact CD1-CB 4.44Å; F138-H143 HydrophobicContact CE1-CB 4.48Å; F138-H143 PolarHBondContact O-N 2.7Å; F138-L157 HydrophobicContact CD1-CD1 4.27Å; F138-L157 HydrophobicContact CD2-CD1 4.5Å; F138-L157 HydrophobicContact CE1-CB 4.27Å; F138-L157 HydrophobicContact CE1-CD1 3.82Å; F138-L157 HydrophobicContact CE2-CB 4.16Å; F138-L157 HydrophobicContact CE2-CD1 4.06Å; F138-L157 HydrophobicContact CZ-CB 3.57Å; F138-L157 HydrophobicContact CZ-CD1 3.72Å; F138-L157 HydrophobicContact CZ-CG 4.22Å; F138-A160 HydrophobicContact CD2-CB 4.35Å; F138-A160 HydrophobicContact CE2-CB 4.33Å
139	E	95.4	Very high	93	Very high	60 Å²	60	56.6 Å²	56.6	28%	0.28	31%	0.306	S	S	.	.	I	π-helix	trans	-66.9	-52.9	-179.8	-177.2	161.5	-101.5	0	0	110.6	W135 D136 Q137 G141 H143 S144	W135-E139 PolarHBondContact NE1-OE1 3.31Å; W135-E139 WeakPolarHBondContact O-CA 3.48Å; W135-E139 WeakPolarHBondContact O-CB 3.44Å; W135-E139 PolarHBondContact O-N 3.48Å; D136-E139 PolarHBondContact O-N 2.83Å; Q137-E139 VanDerWaalsContact C-N 3.27Å; Q137-E139 PolarHBondContact O-N 3.13Å; E139-G141 PolarHBondContact O-N 3Å; E139-H143 HydrophobicContact CB-CB 4.24Å; E139-H143 HydrophobicContact CG-CB 4.17Å; E139-H143 PolarHBondContact O-N 2.93Å; E139-H143 IonicContact OE1-CD2 2.69Å; E139-S144 WeakPolarHBondContact CG-OG 3.2Å; E139-S144 VanDerWaalsContact O-CB 3.29Å; E139-S144 WeakPolarHBondContact O-CB 3.39Å; E139-S144 PolarHBondContact O-N 2.76Å; E139-S144 PolarHBondContact O-OG 3.32Å; E139-S144 VanDerWaalsContact O-OG 3.14Å
140	A	90.2	Very high	93	Very high	78 Å²	78	58.4 Å²	58.4	65%	0.645	32%	0.316	S	S	*	.	I	π-helix	trans	-62.9	-41.3	175.7	0	0	0	0	0	112.7	D136	D136-A140 WeakPolarHBondContact O-CB 3.45Å; D136-A140 PolarHBondContact O-N 3.25Å
141	G	89.2	Confident	92.8	Very high	16 Å²	16	55.7 Å²	55.7	17%	0.165	31%	0.308	C	S	.	.	I	π-helix	trans	-82.6	-27	-173.6	0	0	0	0	0	115.2	Q137 E139 R145	Q137-G141 PolarHBondContact O-N 3.41Å; E139-G141 PolarHBondContact O-N 3Å; G141-R145 WeakPolarHBondContact O-CD 3.22Å
142	V	94.1	Very high	92.7	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.024	32%	0.32	C	S	.	.	I	π-helix	trans	-138.7	-53.7	-171.4	-175.5	0	0	0	0	113	W119 L121 F138 S144 R145 L148 K153 Y156	W119-V142 HydrophobicContact CH2-CG2 4.24Å; L121-V142 HydrophobicContact CD1-CG2 3.61Å; F138-V142 HydrophobicContact CD1-CB 4.48Å; F138-V142 HydrophobicContact CD2-CB 4.32Å; F138-V142 HydrophobicContact CD2-CG2 4.25Å; F138-V142 HydrophobicContact CE1-CB 4.1Å; F138-V142 HydrophobicContact CE1-CG1 4.19Å; F138-V142 HydrophobicContact CE2-CB 3.93Å; F138-V142 HydrophobicContact CE2-CG1 4.1Å; F138-V142 HydrophobicContact CE2-CG2 3.97Å; F138-V142 HydrophobicContact CZ-CB 3.79Å; F138-V142 HydrophobicContact CZ-CG1 3.65Å; F138-V142 HydrophobicContact CZ-CG2 4.33Å; F138-V142 WeakPolarHBondContact O-CA 3.5Å; F138-V142 WeakPolarHBondContact O-CB 3.3Å; F138-V142 PolarHBondContact O-N 2.97Å; V142-S144 PolarHBondContact O-N 3.15Å; V142-R145 PolarHBondContact O-N 3.22Å; V142-L148 HydrophobicContact CG1-CD1 4.18Å; V142-K153 HydrophobicContact CG1-CB 4.19Å; V142-K153 HydrophobicContact CG1-CG 4.14Å; V142-Y156 HydrophobicContact CG1-CD2 4.16Å; V142-Y156 HydrophobicContact CG1-CG 4.35Å
143	H	95.2	Very high	92.9	Very high	51 Å²	51	55.7 Å²	55.7	24%	0.236	31%	0.307	C	S	.	.	I	π-helix	trans	-61.6	-46.1	-170.8	-171.4	57.2	0	0	0	112.7	W135 F138 E139 R145 K153 Y179	W135-H143 AromaticContact CZ2-CD2 3.84Å; F138-H143 HydrophobicContact CD1-CB 4.44Å; F138-H143 HydrophobicContact CE1-CB 4.48Å; F138-H143 PolarHBondContact O-N 2.7Å; E139-H143 HydrophobicContact CB-CB 4.24Å; E139-H143 HydrophobicContact CG-CB 4.17Å; E139-H143 PolarHBondContact O-N 2.93Å; E139-H143 IonicContact OE1-CD2 2.69Å; H143-R145 VanDerWaalsContact C-N 3.28Å; H143-R145 PolarHBondContact O-N 2.88Å; H143-K153 VanDerWaalsContact O-CE 3.3Å; H143-K153 WeakPolarHBondContact O-CE 3.34Å; H143-K153 PolarHBondContact O-NZ 2.98Å; H143-Y179 AromaticContact ND1-CE1 3.64Å; H143-Y179 AromaticContact ND1-CZ 3.57Å; H143-Y179 PolarHBondContact ND1-OH 3.47Å
144	S	93.9	Very high	93.1	Very high	63 Å²	63	53.5 Å²	53.5	44%	0.441	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-10.2	-174.3	-62.6	0	0	0	0	113.7	E139 V142 Q146	E139-S144 WeakPolarHBondContact CG-OG 3.2Å; E139-S144 VanDerWaalsContact O-CB 3.29Å; E139-S144 WeakPolarHBondContact O-CB 3.39Å; E139-S144 PolarHBondContact O-N 2.76Å; E139-S144 PolarHBondContact O-OG 3.32Å; E139-S144 VanDerWaalsContact O-OG 3.14Å; V142-S144 PolarHBondContact O-N 3.15Å; S144-Q146 PolarHBondContact O-N 3.32Å
145	R	90.6	Very high	92.9	Very high	111 Å²	111	56.6 Å²	56.6	42%	0.419	31%	0.309	S	S	.	.			trans	-73.2	111	179.1	-67.1	-172.7	69.3	171.4	2.7	110.4	G141 V142 H143 E147 L148 K153	G141-R145 WeakPolarHBondContact O-CD 3.22Å; V142-R145 PolarHBondContact O-N 3.22Å; H143-R145 VanDerWaalsContact C-N 3.28Å; H143-R145 PolarHBondContact O-N 2.88Å; R145-E147 VanDerWaalsContact C-N 3.31Å; R145-E147 VanDerWaalsContact C-OE2 3.31Å; R145-E147 WeakPolarHBondContact CA-OE2 3.4Å; R145-E147 WeakPolarHBondContact CB-OE2 3.38Å; R145-E147 IonicContact CZ-OE1 3.47Å; R145-E147 IonicContact NE-OE1 2.59Å; R145-E147 PolarHBondContact NE-OE1 3.03Å; R145-E147 IonicContact NH2-OE1 2.87Å; R145-E147 PolarHBondContact NH2-OE1 2.88Å; R145-L148 HydrophobicContact CB-CD1 3.98Å; R145-L148 HydrophobicContact CB-CG 4.06Å; R145-L148 PolarHBondContact O-N 3.46Å; R145-K153 WeakPolarHBondContact O-CE 3.28Å; R145-K153 PolarHBondContact O-NZ 2.76Å
146	Q	90.2	Very high	92.8	Very high	163 Å²	163	60.8 Å²	60.8	76%	0.762	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-20.5	-176.5	-60.6	-59.6	-28.7	0	0	112.8	S144 L148	S144-Q146 PolarHBondContact O-N 3.32Å; Q146-L148 VanDerWaalsContact C-N 3.27Å; Q146-L148 PolarHBondContact O-N 3.1Å
147	E	90.7	Very high	93	Very high	127 Å²	127	56.4 Å²	56.4	59%	0.593	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.7	176.5	69	-88	-147.7	0	0	113.5	R145	R145-E147 VanDerWaalsContact C-N 3.31Å; R145-E147 VanDerWaalsContact C-OE2 3.31Å; R145-E147 WeakPolarHBondContact CA-OE2 3.4Å; R145-E147 WeakPolarHBondContact CB-OE2 3.38Å; R145-E147 IonicContact CZ-OE1 3.47Å; R145-E147 IonicContact NE-OE1 2.59Å; R145-E147 PolarHBondContact NE-OE1 3.03Å; R145-E147 IonicContact NH2-OE1 2.87Å; R145-E147 PolarHBondContact NH2-OE1 2.88Å
148	L	90.3	Very high	92.9	Very high	31 Å²	31	54.1 Å²	54.1	16%	0.162	29%	0.291	C	S	.	.	S	Bend	trans	-92.6	126.6	177.2	-61.9	-179	0	0	0	109.6	V142 R145 Q146 T152 K153 Y156	V142-L148 HydrophobicContact CG1-CD1 4.18Å; R145-L148 HydrophobicContact CB-CD1 3.98Å; R145-L148 HydrophobicContact CB-CG 4.06Å; R145-L148 PolarHBondContact O-N 3.46Å; Q146-L148 VanDerWaalsContact C-N 3.27Å; Q146-L148 PolarHBondContact O-N 3.1Å; L148-T152 HydrophobicContact CD2-CG2 4.26Å; L148-K153 HydrophobicContact CB-CG 3.83Å; L148-K153 VanDerWaalsContact O-CE 3.23Å; L148-K153 WeakPolarHBondContact O-CE 3.24Å; L148-Y156 HydrophobicContact CD1-CD2 4.46Å; L148-Y156 HydrophobicContact CD1-CE2 4.36Å
149	S	91	Very high	92.8	Very high	62 Å²	62	57.5 Å²	57.5	43%	0.434	31%	0.314	S	S	.	.			trans	-66.3	151.7	170.1	66.7	0	0	0	0	111.1	A151 T152 K153	S149-A151 PolarHBondContact O-N 3.48Å; S149-T152 CarbonylContact O-C 3.58Å; S149-T152 WeakPolarHBondContact O-CA 3.35Å; S149-T152 WeakPolarHBondContact O-CB 3.31Å; S149-T152 PolarHBondContact O-N 3.33Å; S149-T152 PolarHBondContact OG-N 3.38Å; S149-T152 PolarHBondContact OG-OG1 2.89Å; S149-K153 PolarHBondContact O-N 3.41Å
150	D	94	Very high	92.8	Very high	67 Å²	67	54.6 Å²	54.6	36%	0.358	30%	0.301	S	S	.	.	H	α-helix	trans	-58.6	-34.9	179.6	-72.8	-15.8	0	0	0	113.1	T152 K153 F154 Y179	D150-T152 VanDerWaalsContact C-N 3.31Å; D150-T152 PolarHBondContact O-N 2.91Å; D150-K153 PolarHBondContact O-N 3.37Å; D150-F154 WeakPolarHBondContact O-CB 3.43Å; D150-F154 PolarHBondContact O-N 3.32Å; D150-Y179 HydrophobicContact CB-CD1 3.94Å; D150-Y179 HydrophobicContact CB-CG 4.21Å
151	A	90.4	Very high	93.1	Very high	24 Å²	24	51.2 Å²	51.2	20%	0.198	27%	0.272	C	S	.	.	H	α-helix	trans	-59.3	-42.8	171.4	0	0	0	0	0	111.8	S149 F154 V155 S176	S149-A151 PolarHBondContact O-N 3.48Å; A151-F154 PolarHBondContact O-N 3.38Å; A151-V155 WeakPolarHBondContact O-CG2 3.42Å; A151-V155 PolarHBondContact O-N 3.27Å; A151-S176 WeakPolarHBondContact CB-OG 3.46Å; A151-S176 PolarHBondContact N-OG 3.15Å
152	T	92	Very high	93.3	Very high	52 Å²	52	56.2 Å²	56.2	32%	0.319	29%	0.289	S	S	.	.	H	α-helix	trans	-68.8	-43.4	178.1	-51	0	0	0	0	111.1	L148 S149 D150 F154 V155 Y156	L148-T152 HydrophobicContact CD2-CG2 4.26Å; S149-T152 CarbonylContact O-C 3.58Å; S149-T152 WeakPolarHBondContact O-CA 3.35Å; S149-T152 WeakPolarHBondContact O-CB 3.31Å; S149-T152 PolarHBondContact O-N 3.33Å; S149-T152 PolarHBondContact OG-N 3.38Å; S149-T152 PolarHBondContact OG-OG1 2.89Å; D150-T152 VanDerWaalsContact C-N 3.31Å; D150-T152 PolarHBondContact O-N 2.91Å; T152-F154 PolarHBondContact O-N 3.39Å; T152-V155 WeakPolarHBondContact O-CB 3.18Å; T152-V155 PolarHBondContact O-N 3.43Å; T152-Y156 HydrophobicContact CG2-CD2 4.08Å; T152-Y156 HydrophobicContact CG2-CE2 3.68Å; T152-Y156 VanDerWaalsContact O-CD2 3.23Å; T152-Y156 WeakPolarHBondContact O-CD2 3.45Å; T152-Y156 PolarHBondContact O-N 3.3Å; T152-Y156 VanDerWaalsContact O-N 3.12Å
153	K	96.6	Very high	93.3	Very high	11 Å²	11	58 Å²	58	5%	0.048	31%	0.308	C	S	.	.	H	α-helix	trans	-57.6	-36.1	172.5	-65.1	180	179.8	173.2	0	111.2	V142 H143 R145 L148 S149 D150 Y156 L157 Y179	V142-K153 HydrophobicContact CG1-CB 4.19Å; V142-K153 HydrophobicContact CG1-CG 4.14Å; H143-K153 VanDerWaalsContact O-CE 3.3Å; H143-K153 WeakPolarHBondContact O-CE 3.34Å; H143-K153 PolarHBondContact O-NZ 2.98Å; R145-K153 WeakPolarHBondContact O-CE 3.28Å; R145-K153 PolarHBondContact O-NZ 2.76Å; L148-K153 HydrophobicContact CB-CG 3.83Å; L148-K153 VanDerWaalsContact O-CE 3.23Å; L148-K153 WeakPolarHBondContact O-CE 3.24Å; S149-K153 PolarHBondContact O-N 3.41Å; D150-K153 PolarHBondContact O-N 3.37Å; K153-Y156 PolarHBondContact O-N 3.29Å; K153-L157 WeakPolarHBondContact O-CB 3.36Å; K153-L157 PolarHBondContact O-N 2.77Å; K153-Y179 HydrophobicContact CB-CD1 4.33Å; K153-Y179 HydrophobicContact CB-CD2 4.05Å; K153-Y179 HydrophobicContact CB-CE1 3.91Å; K153-Y179 HydrophobicContact CB-CE2 3.59Å; K153-Y179 HydrophobicContact CB-CG 4.39Å; K153-Y179 HydrophobicContact CD-CD1 4.45Å; K153-Y179 HydrophobicContact CD-CE1 3.72Å; K153-Y179 HydrophobicContact CG-CE1 4.48Å
154	F	95.5	Very high	93.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-71.8	-35.6	178.3	-162.9	-166.6	0	0	0	113.3	D150 A151 T152 Y156 L157 K158 L172 S173 L174 N178 Y179 A182	D150-F154 WeakPolarHBondContact O-CB 3.43Å; D150-F154 PolarHBondContact O-N 3.32Å; A151-F154 PolarHBondContact O-N 3.38Å; T152-F154 PolarHBondContact O-N 3.39Å; F154-Y156 VanDerWaalsContact C-N 3.34Å; F154-L157 HydrophobicContact CD2-CB 4.36Å; F154-L157 HydrophobicContact CD2-CD2 4.33Å; F154-L157 PolarHBondContact O-N 3.31Å; F154-K158 HydrophobicContact CD2-CG 3.95Å; F154-K158 HydrophobicContact CE2-CD 4.15Å; F154-K158 HydrophobicContact CE2-CG 3.68Å; F154-K158 HydrophobicContact CZ-CD 4.38Å; F154-K158 VanDerWaalsContact CZ-CE 3.43Å; F154-K158 HydrophobicContact CZ-CG 4.38Å; F154-K158 PolarHBondContact O-N 3.03Å; F154-L172 HydrophobicContact CE1-CB 4.26Å; F154-L172 HydrophobicContact CZ-CB 3.81Å; F154-L172 HydrophobicContact CZ-CD1 4.31Å; F154-S173 WeakPolarHBondContact CE1-O 3.3Å; F154-L174 HydrophobicContact CD1-CG 4.38Å; F154-N178 HydrophobicContact CD1-CB 4.33Å; F154-N178 HydrophobicContact CE1-CB 3.67Å; F154-N178 HydrophobicContact CZ-CB 4.43Å; F154-Y179 HydrophobicContact CB-CD2 3.76Å; F154-Y179 HydrophobicContact CB-CG 4.31Å; F154-Y179 HydrophobicContact CD2-CD2 4.31Å; F154-Y179 HydrophobicContact CG-CD2 4.24Å; F154-A182 HydrophobicContact CD2-CB 4.19Å; F154-A182 HydrophobicContact CE2-CB 3.46Å; F154-A182 VanDerWaalsContact CE2-CB 3.46Å; F154-A182 HydrophobicContact CZ-CB 3.81Å
155	V	92.3	Very high	93.3	Very high	71 Å²	71	54.3 Å²	54.3	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-56.7	-51.1	169.3	178.3	0	0	0	0	109.9	A151 T152 K158 S159 L174	A151-V155 WeakPolarHBondContact O-CG2 3.42Å; A151-V155 PolarHBondContact O-N 3.27Å; T152-V155 WeakPolarHBondContact O-CB 3.18Å; T152-V155 PolarHBondContact O-N 3.43Å; V155-K158 PolarHBondContact O-N 3.32Å; V155-S159 WeakPolarHBondContact O-CB 3.41Å; V155-S159 PolarHBondContact O-N 3.19Å; V155-S159 PolarHBondContact O-OG 3.39Å; V155-L174 HydrophobicContact CB-CD1 4.31Å; V155-L174 HydrophobicContact CG2-CD1 3.64Å; V155-L174 HydrophobicContact CG2-CD2 3.65Å; V155-L174 HydrophobicContact CG2-CG 4.16Å
156	Y	94.7	Very high	93.4	Very high	103 Å²	103	54.5 Å²	54.5	40%	0.404	29%	0.291	S	S	.	.	H	α-helix	trans	-61.4	-47	178.8	-73.6	-59.6	0	0	0	111.3	L121 V142 L148 T152 K153 F154 K158 S159 A160	L121-Y156 HydrophobicContact CD2-CD1 4.23Å; L121-Y156 WeakPolarHBondContact CD2-O 3.38Å; V142-Y156 HydrophobicContact CG1-CD2 4.16Å; V142-Y156 HydrophobicContact CG1-CG 4.35Å; L148-Y156 HydrophobicContact CD1-CD2 4.46Å; L148-Y156 HydrophobicContact CD1-CE2 4.36Å; T152-Y156 HydrophobicContact CG2-CD2 4.08Å; T152-Y156 HydrophobicContact CG2-CE2 3.68Å; T152-Y156 VanDerWaalsContact O-CD2 3.23Å; T152-Y156 WeakPolarHBondContact O-CD2 3.45Å; T152-Y156 PolarHBondContact O-N 3.3Å; T152-Y156 VanDerWaalsContact O-N 3.12Å; K153-Y156 PolarHBondContact O-N 3.29Å; F154-Y156 VanDerWaalsContact C-N 3.34Å; Y156-K158 PolarHBondContact O-N 3.21Å; Y156-S159 WeakPolarHBondContact CA-OG 3.43Å; Y156-S159 PolarHBondContact O-N 3.34Å; Y156-S159 VanDerWaalsContact O-N 3.14Å; Y156-S159 PolarHBondContact O-OG 3.02Å; Y156-A160 WeakPolarHBondContact O-CB 3.43Å; Y156-A160 PolarHBondContact O-N 3.48Å
157	L	96.5	Very high	93.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-55.3	-53.7	176.8	-175.7	59.4	0	0	0	110.8	F134 F138 K153 F154 S159 A160 L161 Y179 A182 V183 L186	F134-L157 HydrophobicContact CZ-CD1 4.31Å; F138-L157 HydrophobicContact CD1-CD1 4.27Å; F138-L157 HydrophobicContact CD2-CD1 4.5Å; F138-L157 HydrophobicContact CE1-CB 4.27Å; F138-L157 HydrophobicContact CE1-CD1 3.82Å; F138-L157 HydrophobicContact CE2-CB 4.16Å; F138-L157 HydrophobicContact CE2-CD1 4.06Å; F138-L157 HydrophobicContact CZ-CB 3.57Å; F138-L157 HydrophobicContact CZ-CD1 3.72Å; F138-L157 HydrophobicContact CZ-CG 4.22Å; K153-L157 WeakPolarHBondContact O-CB 3.36Å; K153-L157 PolarHBondContact O-N 2.77Å; F154-L157 HydrophobicContact CD2-CB 4.36Å; F154-L157 HydrophobicContact CD2-CD2 4.33Å; F154-L157 PolarHBondContact O-N 3.31Å; L157-S159 VanDerWaalsContact C-N 3.26Å; L157-S159 PolarHBondContact O-N 2.8Å; L157-A160 WeakPolarHBondContact O-CB 3.44Å; L157-A160 PolarHBondContact O-N 3.47Å; L157-L161 HydrophobicContact CD1-CD1 4.29Å; L157-L161 HydrophobicContact CD1-CD2 4.41Å; L157-L161 HydrophobicContact CD1-CG 4.38Å; L157-L161 HydrophobicContact CG-CD1 4.1Å; L157-L161 VanDerWaalsContact O-CG 3.27Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.07Å; L157-Y179 HydrophobicContact CB-CE2 4.26Å; L157-Y179 HydrophobicContact CD2-CD2 4.22Å; L157-Y179 HydrophobicContact CD2-CE2 3.91Å; L157-A182 HydrophobicContact CD2-CB 4.09Å; L157-V183 HydrophobicContact CD2-CG2 4.03Å; L157-L186 HydrophobicContact CD1-CD1 3.77Å; L157-L186 HydrophobicContact CD2-CD1 4.02Å; L157-L186 HydrophobicContact CG-CD1 4.2Å
158	K	92.5	Very high	93.6	Very high	42 Å²	42	47.6 Å²	47.6	18%	0.183	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-35.9	178.7	-77.4	-162.4	173.6	-162	0	113.3	F154 V155 Y156 A160 L161 T170 L172 L174	F154-K158 HydrophobicContact CD2-CG 3.95Å; F154-K158 HydrophobicContact CE2-CD 4.15Å; F154-K158 HydrophobicContact CE2-CG 3.68Å; F154-K158 HydrophobicContact CZ-CD 4.38Å; F154-K158 VanDerWaalsContact CZ-CE 3.43Å; F154-K158 HydrophobicContact CZ-CG 4.38Å; F154-K158 PolarHBondContact O-N 3.03Å; V155-K158 PolarHBondContact O-N 3.32Å; Y156-K158 PolarHBondContact O-N 3.21Å; K158-A160 VanDerWaalsContact C-N 3.29Å; K158-A160 PolarHBondContact O-N 3.44Å; K158-L161 PolarHBondContact O-N 2.76Å; K158-T170 PolarHBondContact NZ-O 3.33Å; K158-L172 WeakPolarHBondContact CE-O 3.31Å; K158-L172 PolarHBondContact NZ-O 2.81Å; K158-L174 HydrophobicContact CD-CD1 4.48Å
159	S	92.9	Very high	93.7	Very high	71 Å²	71	46.1 Å²	46.1	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-71.3	-23.9	177.1	73.5	0	0	0	0	113.7	L121 V155 Y156 L157	L121-S159 WeakPolarHBondContact CD2-OG 3.36Å; V155-S159 WeakPolarHBondContact O-CB 3.41Å; V155-S159 PolarHBondContact O-N 3.19Å; V155-S159 PolarHBondContact O-OG 3.39Å; Y156-S159 WeakPolarHBondContact CA-OG 3.43Å; Y156-S159 PolarHBondContact O-N 3.34Å; Y156-S159 VanDerWaalsContact O-N 3.14Å; Y156-S159 PolarHBondContact O-OG 3.02Å; L157-S159 VanDerWaalsContact C-N 3.26Å; L157-S159 PolarHBondContact O-N 2.8Å
160	A	95.6	Very high	93.7	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-81.5	-20	176.4	0	0	0	0	0	113.1	L121 P122 V123 F124 F134 F138 Y156 L157 K158	L121-A160 HydrophobicContact CD2-CB 3.86Å; L121-A160 HydrophobicContact CG-CB 4Å; P122-A160 VanDerWaalsContact O-CB 3.23Å; P122-A160 WeakPolarHBondContact O-CB 3.36Å; V123-A160 CarbonylContact C-O 3.59Å; V123-A160 VanDerWaalsContact CA-O 3.24Å; V123-A160 WeakPolarHBondContact CA-O 3.49Å; F124-A160 PolarHBondContact N-O 3.14Å; F134-A160 HydrophobicContact CE2-CB 4.08Å; F134-A160 HydrophobicContact CZ-CB 4.42Å; F138-A160 HydrophobicContact CD2-CB 4.35Å; F138-A160 HydrophobicContact CE2-CB 4.33Å; Y156-A160 WeakPolarHBondContact O-CB 3.43Å; Y156-A160 PolarHBondContact O-N 3.48Å; L157-A160 WeakPolarHBondContact O-CB 3.44Å; L157-A160 PolarHBondContact O-N 3.47Å; K158-A160 VanDerWaalsContact C-N 3.29Å; K158-A160 PolarHBondContact O-N 3.44Å
161	L	97.1	Very high	93.3	Very high	7 Å²	7	46.3 Å²	46.3	4%	0.037	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-92.5	143.7	-174	-59.6	170	0	0	0	112.3	F124 F134 L157 K158 A165 W166 V169 L186	F124-L161 HydrophobicContact CB-CD2 4.28Å; F124-L161 HydrophobicContact CD1-CD2 3.91Å; F124-L161 CarbonylContact O-C 3.51Å; F124-L161 WeakPolarHBondContact O-CA 3.19Å; F134-L161 HydrophobicContact CE1-CD2 4.31Å; F134-L161 HydrophobicContact CZ-CD2 4Å; L157-L161 HydrophobicContact CD1-CD1 4.29Å; L157-L161 HydrophobicContact CD1-CD2 4.41Å; L157-L161 HydrophobicContact CD1-CG 4.38Å; L157-L161 HydrophobicContact CG-CD1 4.1Å; L157-L161 VanDerWaalsContact O-CG 3.27Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.07Å; K158-L161 PolarHBondContact O-N 2.76Å; L161-A165 HydrophobicContact CD2-CB 3.95Å; L161-W166 HydrophobicContact CB-CB 3.91Å; L161-V169 HydrophobicContact CD1-CG2 3.43Å; L161-V169 VanDerWaalsContact CD1-CG2 3.43Å; L161-L186 HydrophobicContact CD1-CD1 3.89Å; L161-L186 HydrophobicContact CD1-CD2 4.26Å; L161-L186 HydrophobicContact CD2-CD1 3.97Å; L161-L186 HydrophobicContact CD2-CD2 4.1Å
162	K	93.7	Very high	93.3	Very high	120 Å²	120	46.8 Å²	46.8	52%	0.522	27%	0.27	S	S	.	.			trans	-135.9	172.4	171.8	-64.5	-173.5	-177.3	177.2	0	110.2	V123 F124 D125 A165 W166	V123-K162 HydrophobicContact CG1-CD 3.57Å; V123-K162 HydrophobicContact CG1-CG 3.86Å; F124-K162 PolarHBondContact O-N 3.45Å; D125-K162 CarbonylContact C-O 3.52Å; D125-K162 VanDerWaalsContact CA-O 3.31Å; D125-K162 WeakPolarHBondContact CA-O 3.36Å; D125-K162 HydrophobicContact CB-CB 4.36Å; D125-K162 VanDerWaalsContact O-O 3.08Å; K162-A165 PolarHBondContact O-N 3.45Å; K162-W166 PolarHBondContact O-N 3.08Å
163	G	94	Very high	93.1	Very high	41 Å²	41	48.3 Å²	48.3	42%	0.423	28%	0.283	S	S	.	.	H	α-helix	trans	50.8	-137.1	171.4	0	0	0	0	0	114	D125 A165 W166 E167	D125-G163 CarbonylContact O-C 3.55Å; G163-A165 PolarHBondContact O-N 3.03Å; G163-W166 PolarHBondContact O-N 2.78Å; G163-E167 WeakPolarHBondContact O-CG 3.14Å; G163-E167 PolarHBondContact O-N 2.79Å
164	A	92.8	Very high	92.7	Very high	38 Å²	38	52.1 Å²	52.1	31%	0.314	30%	0.303	S	S	.	.	H	α-helix	trans	-61.3	-28.5	-178	0	0	0	0	0	113.2	D125 A168 F190	D125-A164 PolarHBondContact O-N 2.74Å; A164-A168 PolarHBondContact O-N 3.22Å; A164-A168 VanDerWaalsContact O-N 3.15Å; A164-F190 HydrophobicContact CB-CE1 4.45Å; A164-F190 HydrophobicContact CB-CZ 4.33Å
165	A	95.2	Very high	92.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-73	-39.8	177.3	0	0	0	0	0	112.4	F124 D125 L161 K162 G163 A168 L186 F190	F124-A165 HydrophobicContact CD1-CB 3.4Å; F124-A165 HydrophobicContact CE1-CB 3.49Å; F124-A165 VanDerWaalsContact CE1-CB 3.49Å; F124-A165 HydrophobicContact CG-CB 4.44Å; D125-A165 PolarHBondContact O-N 3.26Å; L161-A165 HydrophobicContact CD2-CB 3.95Å; K162-A165 PolarHBondContact O-N 3.45Å; G163-A165 PolarHBondContact O-N 3.03Å; A165-A168 WeakPolarHBondContact O-CB 3.46Å; A165-A168 PolarHBondContact O-N 2.96Å; A165-L186 HydrophobicContact CB-CD2 4.14Å; A165-F190 HydrophobicContact CB-CE2 4.04Å; A165-F190 HydrophobicContact CB-CZ 4.22Å
166	W	93.5	Very high	92	Very high	115 Å²	115	54.1 Å²	54.1	44%	0.436	32%	0.318	S	S	.	.	H	α-helix	trans	-66.9	-44.8	173.9	-177.5	85.8	0	0	0	111.5	L161 K162 G163 A168 V169 T170	L161-W166 HydrophobicContact CB-CB 3.91Å; K162-W166 PolarHBondContact O-N 3.08Å; G163-W166 PolarHBondContact O-N 2.78Å; W166-A168 PolarHBondContact O-N 2.83Å; W166-V169 PolarHBondContact O-N 3.22Å; W166-V169 VanDerWaalsContact O-N 3.08Å; W166-T170 VanDerWaalsContact CH2-OG1 3.23Å; W166-T170 WeakPolarHBondContact CH2-OG1 3.35Å; W166-T170 VanDerWaalsContact CZ2-OG1 3.32Å; W166-T170 WeakPolarHBondContact CZ2-OG1 3.49Å; W166-T170 WeakPolarHBondContact O-CB 3.49Å; W166-T170 PolarHBondContact O-N 2.75Å
167	E	92.5	Very high	91.8	Very high	124 Å²	124	53 Å²	53	58%	0.579	33%	0.329	S	S	*	.	H	α-helix	trans	-57.3	-32.7	175.6	-72.5	173.7	-174.1	0	0	112.8	G163 V169 T170	G163-E167 WeakPolarHBondContact O-CG 3.14Å; G163-E167 PolarHBondContact O-N 2.79Å; E167-V169 PolarHBondContact O-N 3.15Å; E167-T170 WeakPolarHBondContact O-CG2 3.47Å
168	A	91.7	Very high	91.6	Very high	20 Å²	20	54.8 Å²	54.8	17%	0.165	34%	0.339	C	S	.	.	H	α-helix	trans	-62.5	-29.7	178.2	0	0	0	0	0	113.5	A164 A165 W166 I185 F190	A164-A168 PolarHBondContact O-N 3.22Å; A164-A168 VanDerWaalsContact O-N 3.15Å; A165-A168 WeakPolarHBondContact O-CB 3.46Å; A165-A168 PolarHBondContact O-N 2.96Å; W166-A168 PolarHBondContact O-N 2.83Å; A168-I185 HydrophobicContact CB-CG2 3.93Å; A168-F190 HydrophobicContact CB-CE2 4.12Å
169	V	93.3	Very high	91.8	Very high	1 Å²	1	53 Å²	53	1%	0.006	33%	0.331	C	S	.	.	H	α-helix	trans	-122	0.2	-172.8	-57.5	0	0	0	0	113.5	L161 W166 E167 G171 L172 A182 I185 L186	L161-V169 HydrophobicContact CD1-CG2 3.43Å; L161-V169 VanDerWaalsContact CD1-CG2 3.43Å; W166-V169 PolarHBondContact O-N 3.22Å; W166-V169 VanDerWaalsContact O-N 3.08Å; E167-V169 PolarHBondContact O-N 3.15Å; V169-G171 VanDerWaalsContact C-N 3.26Å; V169-G171 PolarHBondContact O-N 3.22Å; V169-L172 HydrophobicContact CB-CD1 4.39Å; V169-L172 WeakPolarHBondContact O-CB 2.78Å; V169-L172 PolarHBondContact O-N 2.8Å; V169-L172 VanDerWaalsContact O-N 3.1Å; V169-A182 HydrophobicContact CB-CB 4.29Å; V169-A182 HydrophobicContact CG1-CB 4.03Å; V169-I185 HydrophobicContact CG1-CB 4.25Å; V169-I185 HydrophobicContact CG1-CG2 3.95Å; V169-L186 HydrophobicContact CG1-CD2 4.31Å; V169-L186 HydrophobicContact CG1-CG 4.13Å
170	T	90	Very high	91.9	Very high	59 Å²	59	52.2 Å²	52.2	36%	0.362	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-38.8	-175.4	-168.6	0	0	0	0	112.4	K158 W166 E167 L172	K158-T170 PolarHBondContact NZ-O 3.33Å; W166-T170 VanDerWaalsContact CH2-OG1 3.23Å; W166-T170 WeakPolarHBondContact CH2-OG1 3.35Å; W166-T170 VanDerWaalsContact CZ2-OG1 3.32Å; W166-T170 WeakPolarHBondContact CZ2-OG1 3.49Å; W166-T170 WeakPolarHBondContact O-CB 3.49Å; W166-T170 PolarHBondContact O-N 2.75Å; E167-T170 WeakPolarHBondContact O-CG2 3.47Å; T170-L172 PolarHBondContact O-N 3.43Å
171	G	86.8	Confident	91.8	Very high	74 Å²	74	55.2 Å²	55.2	76%	0.763	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-10.7	179.4	0	0	0	0	0	115.5	V169	V169-G171 VanDerWaalsContact C-N 3.26Å; V169-G171 PolarHBondContact O-N 3.22Å
172	L	89.5	Confident	91.7	Very high	34 Å²	34	54.9 Å²	54.9	18%	0.178	35%	0.345	C	S	.	.	S	Bend	trans	-81.7	123.7	176.4	-66.1	178.4	0	0	0	110.4	F154 K158 V169 T170 N178 V181 A182 I185	F154-L172 HydrophobicContact CE1-CB 4.26Å; F154-L172 HydrophobicContact CZ-CB 3.81Å; F154-L172 HydrophobicContact CZ-CD1 4.31Å; K158-L172 WeakPolarHBondContact CE-O 3.31Å; K158-L172 PolarHBondContact NZ-O 2.81Å; V169-L172 HydrophobicContact CB-CD1 4.39Å; V169-L172 WeakPolarHBondContact O-CB 2.78Å; V169-L172 PolarHBondContact O-N 2.8Å; V169-L172 VanDerWaalsContact O-N 3.1Å; T170-L172 PolarHBondContact O-N 3.43Å; L172-N178 HydrophobicContact CB-CB 4.35Å; L172-V181 HydrophobicContact CD1-CB 4.44Å; L172-V181 HydrophobicContact CD1-CG1 4.23Å; L172-V181 HydrophobicContact CD2-CG1 4.34Å; L172-A182 HydrophobicContact CD1-CB 3.7Å; L172-I185 HydrophobicContact CD1-CD1 3.89Å
173	S	88.2	Confident	91.9	Very high	84 Å²	84	49.5 Å²	49.5	59%	0.587	32%	0.322	S	S	*	.			trans	-65.2	146.1	174.4	-68.8	0	0	0	0	111.3	F154 T175 N178	F154-S173 WeakPolarHBondContact CE1-O 3.3Å; S173-T175 PolarHBondContact O-N 3.22Å; S173-N178 PolarHBondContact N-ND2 3.4Å; S173-N178 PolarHBondContact O-ND2 2.89Å
174	L	88.4	Confident	92	Very high	91 Å²	91	51.8 Å²	51.8	48%	0.476	33%	0.325	S	S	.	.	S	Bend	trans	-72.9	87.2	-176.9	-164.1	136.5	0	0	0	111.1	F154 V155 K158	F154-L174 HydrophobicContact CD1-CG 4.38Å; V155-L174 HydrophobicContact CB-CD1 4.31Å; V155-L174 HydrophobicContact CG2-CD1 3.64Å; V155-L174 HydrophobicContact CG2-CD2 3.65Å; V155-L174 HydrophobicContact CG2-CG 4.16Å; K158-L174 HydrophobicContact CD-CD1 4.48Å
175	T	87.2	Confident	92.1	Very high	56 Å²	56	52.4 Å²	52.4	34%	0.344	32%	0.323	S	S	.	.			trans	-135.7	154.8	179.4	66.9	0	0	0	0	109.7	S173 A177 N178	S173-T175 PolarHBondContact O-N 3.22Å; T175-A177 VanDerWaalsContact C-N 3.28Å; T175-A177 PolarHBondContact O-N 2.98Å; T175-N178 PolarHBondContact O-N 2.72Å; T175-N178 WeakPolarHBondContact OG1-CB 3.29Å; T175-N178 VanDerWaalsContact OG1-CG 3.26Å; T175-N178 PolarHBondContact OG1-N 3.26Å; T175-N178 PolarHBondContact OG1-ND2 3.14Å; T175-N178 VanDerWaalsContact OG1-ND2 3.13Å
176	S	86.8	Confident	92.2	Very high	57 Å²	57	52.4 Å²	52.4	40%	0.399	32%	0.323	S	S	.	.	H	α-helix	trans	-56.5	-42	177.5	-59.3	0	0	0	0	112.3	A151 N178 Y179	A151-S176 WeakPolarHBondContact CB-OG 3.46Å; A151-S176 PolarHBondContact N-OG 3.15Å; S176-N178 VanDerWaalsContact C-N 3.28Å; S176-N178 PolarHBondContact O-N 3.32Å; S176-Y179 WeakPolarHBondContact O-CB 3.19Å; S176-Y179 PolarHBondContact O-N 3.23Å
177	A	88.6	Confident	92.2	Very high	78 Å²	78	50.5 Å²	50.5	65%	0.645	32%	0.317	S	S	*	.	H	α-helix	trans	-62.7	-33.3	-179	0	0	0	0	0	113.3	T175 Y179	T175-A177 VanDerWaalsContact C-N 3.28Å; T175-A177 PolarHBondContact O-N 2.98Å; A177-Y179 VanDerWaalsContact C-N 3.32Å; A177-Y179 PolarHBondContact O-N 3.38Å
178	N	93.7	Very high	92.2	Very high	39 Å²	39	50.1 Å²	50.1	21%	0.209	32%	0.319	C	S	.	.	H	α-helix	trans	-80.6	-11.6	-177.9	-72.7	-18	0	0	0	113.5	F154 L172 S173 T175 S176 V181 A182	F154-N178 HydrophobicContact CD1-CB 4.33Å; F154-N178 HydrophobicContact CE1-CB 3.67Å; F154-N178 HydrophobicContact CZ-CB 4.43Å; L172-N178 HydrophobicContact CB-CB 4.35Å; S173-N178 PolarHBondContact N-ND2 3.4Å; S173-N178 PolarHBondContact O-ND2 2.89Å; T175-N178 PolarHBondContact O-N 2.72Å; T175-N178 WeakPolarHBondContact OG1-CB 3.29Å; T175-N178 VanDerWaalsContact OG1-CG 3.26Å; T175-N178 PolarHBondContact OG1-N 3.26Å; T175-N178 PolarHBondContact OG1-ND2 3.14Å; T175-N178 VanDerWaalsContact OG1-ND2 3.13Å; S176-N178 VanDerWaalsContact C-N 3.28Å; S176-N178 PolarHBondContact O-N 3.32Å; N178-V181 PolarHBondContact O-N 3.16Å; N178-A182 WeakPolarHBondContact O-CB 3.49Å; N178-A182 PolarHBondContact O-N 2.74Å
179	Y	96.6	Very high	92.2	Very high	5 Å²	5	54.9 Å²	54.9	2%	0.02	33%	0.333	C	S	.	.	H	α-helix	trans	-61.9	-51.4	-179.6	176	-116.9	0	0	0	111.9	H143 D150 K153 F154 L157 S176 A177 V181 A182 V183	H143-Y179 AromaticContact ND1-CE1 3.64Å; H143-Y179 AromaticContact ND1-CZ 3.57Å; H143-Y179 PolarHBondContact ND1-OH 3.47Å; D150-Y179 HydrophobicContact CB-CD1 3.94Å; D150-Y179 HydrophobicContact CB-CG 4.21Å; K153-Y179 HydrophobicContact CB-CD1 4.33Å; K153-Y179 HydrophobicContact CB-CD2 4.05Å; K153-Y179 HydrophobicContact CB-CE1 3.91Å; K153-Y179 HydrophobicContact CB-CE2 3.59Å; K153-Y179 HydrophobicContact CB-CG 4.39Å; K153-Y179 HydrophobicContact CD-CD1 4.45Å; K153-Y179 HydrophobicContact CD-CE1 3.72Å; K153-Y179 HydrophobicContact CG-CE1 4.48Å; F154-Y179 HydrophobicContact CB-CD2 3.76Å; F154-Y179 HydrophobicContact CB-CG 4.31Å; F154-Y179 HydrophobicContact CD2-CD2 4.31Å; F154-Y179 HydrophobicContact CG-CD2 4.24Å; L157-Y179 HydrophobicContact CB-CE2 4.26Å; L157-Y179 HydrophobicContact CD2-CD2 4.22Å; L157-Y179 HydrophobicContact CD2-CE2 3.91Å; S176-Y179 WeakPolarHBondContact O-CB 3.19Å; S176-Y179 PolarHBondContact O-N 3.23Å; A177-Y179 VanDerWaalsContact C-N 3.32Å; A177-Y179 PolarHBondContact O-N 3.38Å; Y179-V181 VanDerWaalsContact C-N 3.29Å; Y179-V181 PolarHBondContact O-N 3.33Å; Y179-A182 WeakPolarHBondContact O-CB 3.42Å; Y179-A182 PolarHBondContact O-N 3.34Å; Y179-A182 VanDerWaalsContact O-N 3.13Å; Y179-V183 HydrophobicContact CD2-CG2 4.3Å; Y179-V183 HydrophobicContact CE1-CG2 4.22Å; Y179-V183 HydrophobicContact CE2-CG2 3.83Å; Y179-V183 WeakPolarHBondContact O-CG2 3.12Å; Y179-V183 PolarHBondContact O-N 3.46Å
180	A	94	Very high	92.2	Very high	53 Å²	53	55.3 Å²	55.3	44%	0.438	34%	0.335	S	S	.	.	H	α-helix	trans	-58	-44.5	178.2	0	0	0	0	0	111	A182 V183 D184	A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.5Å; A180-V183 WeakPolarHBondContact O-CB 3.36Å; A180-V183 PolarHBondContact O-N 2.85Å; A180-D184 PolarHBondContact O-N 2.87Å
181	V	95.1	Very high	92.3	Very high	64 Å²	64	53.5 Å²	53.5	39%	0.388	33%	0.327	S	S	.	.	H	α-helix	trans	-60.2	-41.9	176.5	-176.2	0	0	0	0	111.8	L172 N178 Y179 D184 I185	L172-V181 HydrophobicContact CD1-CB 4.44Å; L172-V181 HydrophobicContact CD1-CG1 4.23Å; L172-V181 HydrophobicContact CD2-CG1 4.34Å; N178-V181 PolarHBondContact O-N 3.16Å; Y179-V181 VanDerWaalsContact C-N 3.29Å; Y179-V181 PolarHBondContact O-N 3.33Å; V181-D184 PolarHBondContact O-N 2.82Å; V181-I185 HydrophobicContact CG1-CD1 4.04Å; V181-I185 VanDerWaalsContact O-CG1 3.26Å; V181-I185 WeakPolarHBondContact O-CG1 3.42Å; V181-I185 PolarHBondContact O-N 3.23Å
182	A	95	Very high	92.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-42.1	177.2	0	0	0	0	0	112	F154 L157 V169 L172 N178 Y179 A180 I185 L186	F154-A182 HydrophobicContact CD2-CB 4.19Å; F154-A182 HydrophobicContact CE2-CB 3.46Å; F154-A182 VanDerWaalsContact CE2-CB 3.46Å; F154-A182 HydrophobicContact CZ-CB 3.81Å; L157-A182 HydrophobicContact CD2-CB 4.09Å; V169-A182 HydrophobicContact CB-CB 4.29Å; V169-A182 HydrophobicContact CG1-CB 4.03Å; L172-A182 HydrophobicContact CD1-CB 3.7Å; N178-A182 WeakPolarHBondContact O-CB 3.49Å; N178-A182 PolarHBondContact O-N 2.74Å; Y179-A182 WeakPolarHBondContact O-CB 3.42Å; Y179-A182 PolarHBondContact O-N 3.34Å; Y179-A182 VanDerWaalsContact O-N 3.13Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 3.5Å; A182-I185 PolarHBondContact O-N 3.1Å; A182-L186 WeakPolarHBondContact O-CG 3.46Å; A182-L186 PolarHBondContact O-N 3.14Å; A182-L186 VanDerWaalsContact O-N 3.08Å
183	V	96.6	Very high	92.3	Very high	6 Å²	6	54.8 Å²	54.8	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-61	-46.5	175	168.1	0	0	0	0	110.7	W135 L157 Y179 A180 I185 L186 K187	W135-V183 HydrophobicContact CH2-CB 4.14Å; W135-V183 HydrophobicContact CH2-CG1 3.31Å; W135-V183 HydrophobicContact CH2-CG2 3.79Å; W135-V183 HydrophobicContact CZ2-CG1 3.9Å; W135-V183 HydrophobicContact CZ3-CG1 4.02Å; W135-V183 HydrophobicContact CZ3-CG2 4.24Å; L157-V183 HydrophobicContact CD2-CG2 4.03Å; Y179-V183 HydrophobicContact CD2-CG2 4.3Å; Y179-V183 HydrophobicContact CE1-CG2 4.22Å; Y179-V183 HydrophobicContact CE2-CG2 3.83Å; Y179-V183 WeakPolarHBondContact O-CG2 3.12Å; Y179-V183 PolarHBondContact O-N 3.46Å; A180-V183 WeakPolarHBondContact O-CB 3.36Å; A180-V183 PolarHBondContact O-N 2.85Å; V183-I185 PolarHBondContact O-N 3.45Å; V183-L186 PolarHBondContact O-N 3.49Å; V183-K187 HydrophobicContact CG1-CD 4.14Å; V183-K187 HydrophobicContact CG1-CG 4.45Å; V183-K187 PolarHBondContact O-N 2.93Å
184	D	96.1	Very high	92.3	Very high	89 Å²	89	54.7 Å²	54.7	48%	0.476	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-42.2	178.4	-71.2	-21.2	0	0	0	111.7	A180 V181 L186 K187 N188	A180-D184 PolarHBondContact O-N 2.87Å; V181-D184 PolarHBondContact O-N 2.82Å; D184-L186 VanDerWaalsContact C-N 3.32Å; D184-L186 PolarHBondContact O-N 2.91Å; D184-K187 PolarHBondContact O-N 3.43Å; D184-N188 WeakPolarHBondContact O-CB 3.45Å; D184-N188 PolarHBondContact O-N 3.44Å; D184-N188 PolarHBondContact O-ND2 3.05Å
185	I	95.8	Very high	92.2	Very high	52 Å²	52	52.1 Å²	52.1	27%	0.267	30%	0.296	S	S	.	.	H	α-helix	trans	-58.8	-45	175	-72.8	165	0	0	0	110.9	A168 V169 L172 V181 A182 V183 R189	A168-I185 HydrophobicContact CB-CG2 3.93Å; V169-I185 HydrophobicContact CG1-CB 4.25Å; V169-I185 HydrophobicContact CG1-CG2 3.95Å; L172-I185 HydrophobicContact CD1-CD1 3.89Å; V181-I185 HydrophobicContact CG1-CD1 4.04Å; V181-I185 VanDerWaalsContact O-CG1 3.26Å; V181-I185 WeakPolarHBondContact O-CG1 3.42Å; V181-I185 PolarHBondContact O-N 3.23Å; A182-I185 PolarHBondContact O-N 3.1Å; V183-I185 PolarHBondContact O-N 3.45Å; I185-R189 WeakPolarHBondContact O-CB 3.3Å; I185-R189 PolarHBondContact O-N 3.22Å
186	L	96.4	Very high	92.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.2	-46.8	-179.2	-70.2	171	0	0	0	111.9	F131 L157 L161 A165 V169 A182 V183 D184 R189 F190 G191	F131-L186 HydrophobicContact CE2-CB 4.24Å; L157-L186 HydrophobicContact CD1-CD1 3.77Å; L157-L186 HydrophobicContact CD2-CD1 4.02Å; L157-L186 HydrophobicContact CG-CD1 4.2Å; L161-L186 HydrophobicContact CD1-CD1 3.89Å; L161-L186 HydrophobicContact CD1-CD2 4.26Å; L161-L186 HydrophobicContact CD2-CD1 3.97Å; L161-L186 HydrophobicContact CD2-CD2 4.1Å; A165-L186 HydrophobicContact CB-CD2 4.14Å; V169-L186 HydrophobicContact CG1-CD2 4.31Å; V169-L186 HydrophobicContact CG1-CG 4.13Å; A182-L186 WeakPolarHBondContact O-CG 3.46Å; A182-L186 PolarHBondContact O-N 3.14Å; A182-L186 VanDerWaalsContact O-N 3.08Å; V183-L186 PolarHBondContact O-N 3.49Å; D184-L186 VanDerWaalsContact C-N 3.32Å; D184-L186 PolarHBondContact O-N 2.91Å; L186-R189 PolarHBondContact O-N 3.29Å; L186-F190 HydrophobicContact CD2-CD2 3.99Å; L186-F190 HydrophobicContact CD2-CE2 3.96Å; L186-F190 PolarHBondContact O-N 3.28Å; L186-G191 PolarHBondContact O-N 2.97Å
187	K	94.9	Very high	92.6	Very high	74 Å²	74	47.9 Å²	47.9	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-45.9	176.9	-74.5	-173.9	175.2	-176.7	0	111.3	F131 V183 D184 G191	F131-K187 HydrophobicContact CZ-CG 4.05Å; V183-K187 HydrophobicContact CG1-CD 4.14Å; V183-K187 HydrophobicContact CG1-CG 4.45Å; V183-K187 PolarHBondContact O-N 2.93Å; D184-K187 PolarHBondContact O-N 3.43Å; K187-G191 CarbonylContact O-C 3.57Å; K187-G191 WeakPolarHBondContact O-CA 3.44Å; K187-G191 PolarHBondContact O-N 3.42Å
188	N	90.9	Very high	92.6	Very high	117 Å²	117	46.1 Å²	46.1	63%	0.626	25%	0.245	S	C	*	.	H	α-helix	trans	-70.7	-33	-179.5	-70.4	-33.8	0	0	0	113.1	D184 R192	D184-N188 WeakPolarHBondContact O-CB 3.45Å; D184-N188 PolarHBondContact O-N 3.44Å; D184-N188 PolarHBondContact O-ND2 3.05Å; N188-R192 WeakPolarHBondContact O-CD 3.37Å; N188-R192 WeakPolarHBondContact O-CG 3.35Å
189	R	91.7	Very high	92.6	Very high	119 Å²	119	47.1 Å²	47.1	45%	0.449	25%	0.25	S	S	.	.	H	α-helix	trans	-82.7	-42.9	-178.5	-173.9	169.8	174.7	175.5	-5.1	112.6	I185 L186	I185-R189 WeakPolarHBondContact O-CB 3.3Å; I185-R189 PolarHBondContact O-N 3.22Å; L186-R189 PolarHBondContact O-N 3.29Å
190	F	94.8	Very high	92.5	Very high	11 Å²	11	47 Å²	47	5%	0.048	25%	0.25	C	S	.	.	H	α-helix	trans	-117.6	-28.9	-170.1	-54.9	-76.6	0	0	0	113.8	F124 G126 V128 F131 A164 A165 A168 L186 R192	F124-F190 HydrophobicContact CE1-CB 4.19Å; F124-F190 AromaticContact CE1-CD2 3.97Å; F124-F190 HydrophobicContact CE1-CD2 3.97Å; F124-F190 HydrophobicContact CE1-CE2 4.49Å; F124-F190 AromaticContact CE1-CG 3.97Å; F124-F190 HydrophobicContact CE1-CG 3.97Å; F124-F190 HydrophobicContact CZ-CB 3.9Å; F124-F190 HydrophobicContact CZ-CD1 4.28Å; F124-F190 HydrophobicContact CZ-CD2 4.43Å; F124-F190 AromaticContact CZ-CG 3.96Å; F124-F190 HydrophobicContact CZ-CG 3.96Å; G126-F190 VanDerWaalsContact O-CD1 3.25Å; G126-F190 WeakPolarHBondContact O-CD1 3.37Å; G126-F190 WeakPolarHBondContact O-CE1 3.25Å; V128-F190 HydrophobicContact CG2-CD1 4.2Å; F131-F190 HydrophobicContact CB-CB 4.44Å; F131-F190 HydrophobicContact CD2-CB 3.57Å; F131-F190 HydrophobicContact CE2-CB 4.06Å; F131-F190 HydrophobicContact CG-CB 4.1Å; A164-F190 HydrophobicContact CB-CE1 4.45Å; A164-F190 HydrophobicContact CB-CZ 4.33Å; A165-F190 HydrophobicContact CB-CE2 4.04Å; A165-F190 HydrophobicContact CB-CZ 4.22Å; A168-F190 HydrophobicContact CB-CE2 4.12Å; L186-F190 HydrophobicContact CD2-CD2 3.99Å; L186-F190 HydrophobicContact CD2-CE2 3.96Å; L186-F190 PolarHBondContact O-N 3.28Å; F190-R192 VanDerWaalsContact C-N 3.26Å; F190-R192 PolarHBondContact O-N 3.39Å
191	G	91	Very high	92.5	Very high	20 Å²	20	44.9 Å²	44.9	21%	0.206	23%	0.231	C	C	.	.			trans	-85.9	25.1	-176.9	0	0	0	0	0	115.8	L186 K187 P193	L186-G191 PolarHBondContact O-N 2.97Å; K187-G191 CarbonylContact O-C 3.57Å; K187-G191 WeakPolarHBondContact O-CA 3.44Å; K187-G191 PolarHBondContact O-N 3.42Å; G191-P193 WeakPolarHBondContact O-CD 3.46Å
192	R	89.5	Confident	92.3	Very high	60 Å²	60	43 Å²	43	23%	0.226	22%	0.22	C	C	.	.			trans	-82.6	115.6	-177.2	-67.4	-165.2	-63.4	143.3	-3.1	110.8	N188 F190 D194 L195 I196	N188-R192 WeakPolarHBondContact O-CD 3.37Å; N188-R192 WeakPolarHBondContact O-CG 3.35Å; F190-R192 VanDerWaalsContact C-N 3.26Å; F190-R192 PolarHBondContact O-N 3.39Å; R192-D194 VanDerWaalsContact C-N 3.34Å; R192-D194 WeakPolarHBondContact CB-OD1 3.36Å; R192-D194 IonicContact NH1-OD2 2.65Å; R192-D194 PolarHBondContact O-N 2.83Å; R192-L195 HydrophobicContact CB-CB 3.91Å; R192-L195 PolarHBondContact O-N 2.76Å; R192-L195 VanDerWaalsContact O-N 3.15Å; R192-I196 WeakPolarHBondContact O-CG1 3.48Å; R192-I196 PolarHBondContact O-N 2.83Å
193	P	88.2	Confident	92.3	Very high	75 Å²	75	44.6 Å²	44.6	49%	0.487	23%	0.231	S	C	.	.	H	α-helix	trans	-58.4	-42.7	-174.8	-26.2	35.4	0	0	0	113.4	G191 L195 I196 I197 M235	G191-P193 WeakPolarHBondContact O-CD 3.46Å; P193-L195 VanDerWaalsContact C-N 3.34Å; P193-L195 PolarHBondContact O-N 2.8Å; P193-I196 PolarHBondContact O-N 3.37Å; P193-I197 WeakPolarHBondContact O-CB 3.27Å; P193-I197 WeakPolarHBondContact O-CD1 3.3Å; P193-I197 WeakPolarHBondContact O-CG1 3.33Å; P193-I197 PolarHBondContact O-N 2.86Å; P193-M235 HydrophobicContact CB-CE 3.95Å
194	D	86.3	Confident	92.2	Very high	82 Å²	82	46.4 Å²	46.4	44%	0.439	24%	0.24	S	C	.	.	H	α-helix	trans	-57.7	-44.9	176.8	59.2	-57.2	0	0	0	111.8	R192 Q198	R192-D194 VanDerWaalsContact C-N 3.34Å; R192-D194 WeakPolarHBondContact CB-OD1 3.36Å; R192-D194 IonicContact NH1-OD2 2.65Å; R192-D194 PolarHBondContact O-N 2.83Å; D194-Q198 VanDerWaalsContact O-CB 3.24Å; D194-Q198 WeakPolarHBondContact O-CB 3.5Å; D194-Q198 PolarHBondContact O-N 3.32Å
195	L	88	Confident	91.9	Very high	37 Å²	37	46.2 Å²	46.2	19%	0.194	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-43.5	178.5	-174.4	69.2	0	0	0	111.6	V128 R192 P193 Q198 N199	V128-L195 HydrophobicContact CG1-CD2 4.02Å; V128-L195 HydrophobicContact CG1-CG 4.09Å; V128-L195 HydrophobicContact CG2-CD2 3.8Å; R192-L195 HydrophobicContact CB-CB 3.91Å; R192-L195 PolarHBondContact O-N 2.76Å; R192-L195 VanDerWaalsContact O-N 3.15Å; P193-L195 VanDerWaalsContact C-N 3.34Å; P193-L195 PolarHBondContact O-N 2.8Å; L195-Q198 PolarHBondContact O-N 3.26Å; L195-N199 WeakPolarHBondContact O-CB 3.1Å; L195-N199 PolarHBondContact O-N 2.63Å; L195-N199 PolarHBondContact O-ND2 2.95Å
196	I	91.4	Very high	91.6	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-49.8	179.8	-64.9	161.4	0	0	0	110.1	V128 V132 R192 P193 Q198 N199 H200 M235	V128-I196 HydrophobicContact CG1-CB 4.14Å; V128-I196 HydrophobicContact CG1-CD1 4.49Å; V128-I196 HydrophobicContact CG1-CG1 3.31Å; V132-I196 HydrophobicContact CG2-CD1 4Å; R192-I196 WeakPolarHBondContact O-CG1 3.48Å; R192-I196 PolarHBondContact O-N 2.83Å; P193-I196 PolarHBondContact O-N 3.37Å; I196-Q198 VanDerWaalsContact C-N 3.34Å; I196-Q198 PolarHBondContact O-N 3.21Å; I196-N199 PolarHBondContact O-N 3.42Å; I196-H200 PolarHBondContact O-CD2 2.91Å; I196-H200 PolarHBondContact O-N 3.48Å; I196-M235 HydrophobicContact CB-CE 4.28Å; I196-M235 HydrophobicContact CD1-CE 4.32Å; I196-M235 HydrophobicContact CG2-CE 4.2Å
197	I	90.5	Very high	91.4	Very high	20 Å²	20	51 Å²	51	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-57.9	-48.9	177.3	-68.6	160.1	0	0	0	109.9	P193 N199 H200 I201 L232 M235 K237	P193-I197 WeakPolarHBondContact O-CB 3.27Å; P193-I197 WeakPolarHBondContact O-CD1 3.3Å; P193-I197 WeakPolarHBondContact O-CG1 3.33Å; P193-I197 PolarHBondContact O-N 2.86Å; I197-N199 VanDerWaalsContact C-N 3.35Å; I197-N199 PolarHBondContact O-N 2.87Å; I197-H200 PolarHBondContact O-N 3.04Å; I197-I201 HydrophobicContact CG2-CD1 3.89Å; I197-I201 WeakPolarHBondContact O-CG1 3.37Å; I197-I201 PolarHBondContact O-N 3.39Å; I197-L232 HydrophobicContact CB-CD2 4.42Å; I197-L232 HydrophobicContact CG2-CD2 4.01Å; I197-M235 HydrophobicContact CG1-CE 4.41Å; I197-K237 HydrophobicContact CD1-CD 4.49Å; I197-K237 HydrophobicContact CD1-CG 3.7Å; I197-K237 HydrophobicContact CG1-CG 4.19Å
198	Q	89.4	Confident	90.9	Very high	42 Å²	42	55 Å²	55	20%	0.196	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-43	178.7	-176.1	179.7	-34	0	0	111.9	D194 L195 I196 H200 I201 V202 A251	D194-Q198 VanDerWaalsContact O-CB 3.24Å; D194-Q198 WeakPolarHBondContact O-CB 3.5Å; D194-Q198 PolarHBondContact O-N 3.32Å; L195-Q198 PolarHBondContact O-N 3.26Å; I196-Q198 VanDerWaalsContact C-N 3.34Å; I196-Q198 PolarHBondContact O-N 3.21Å; Q198-H200 VanDerWaalsContact C-N 3.34Å; Q198-H200 PolarHBondContact O-N 3.07Å; Q198-I201 PolarHBondContact O-N 3.36Å; Q198-V202 HydrophobicContact CG-CG2 4.25Å; Q198-V202 VanDerWaalsContact O-CG2 3.29Å; Q198-V202 WeakPolarHBondContact O-CG2 3.34Å; Q198-V202 PolarHBondContact O-N 2.88Å; Q198-A251 HydrophobicContact CG-CB 4.43Å
199	N	92.8	Very high	90.7	Very high	59 Å²	59	54.7 Å²	54.7	32%	0.316	29%	0.289	S	S	.	.	H	α-helix	trans	-65.7	-35.4	179.3	-84.8	-96	0	0	0	112.1	L129 L195 I196 I197 S203	L129-N199 HydrophobicContact CD2-CB 3.58Å; L129-N199 HydrophobicContact CG-CB 4.44Å; L195-N199 WeakPolarHBondContact O-CB 3.1Å; L195-N199 PolarHBondContact O-N 2.63Å; L195-N199 PolarHBondContact O-ND2 2.95Å; I196-N199 PolarHBondContact O-N 3.42Å; I197-N199 VanDerWaalsContact C-N 3.35Å; I197-N199 PolarHBondContact O-N 2.87Å; N199-S203 VanDerWaalsContact O-CB 3.24Å; N199-S203 WeakPolarHBondContact O-CB 3.43Å; N199-S203 PolarHBondContact O-N 3.12Å; N199-S203 PolarHBondContact O-OG 3.32Å
200	H	94.6	Very high	90.2	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.019	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-43.5	172.1	-82.9	-54.5	0	0	0	112.5	I196 I197 Q198 S203 L204 H228 A231 L232	I196-H200 PolarHBondContact O-CD2 2.91Å; I196-H200 PolarHBondContact O-N 3.48Å; I197-H200 PolarHBondContact O-N 3.04Å; Q198-H200 VanDerWaalsContact C-N 3.34Å; Q198-H200 PolarHBondContact O-N 3.07Å; H200-S203 PolarHBondContact O-N 3.48Å; H200-L204 WeakPolarHBondContact O-CG 3.28Å; H200-L204 PolarHBondContact O-N 2.88Å; H200-H228 AromaticContact CE1-ND1 3.72Å; H200-H228 AromaticContact ND1-CE1 3.91Å; H200-H228 AromaticContact ND1-CG 3.92Å; H200-H228 AromaticContact ND1-ND1 3.03Å; H200-H228 PolarHBondContact ND1-ND1 2.88Å; H200-A231 WeakPolarHBondContact CE1-CB 3.42Å; H200-A231 VanDerWaalsContact NE2-CB 3.3Å; H200-A231 WeakPolarHBondContact NE2-CB 3.44Å; H200-L232 HydrophobicContact CB-CD1 4.26Å; H200-L232 HydrophobicContact CB-CD2 3.77Å; H200-L232 HydrophobicContact CB-CG 3.87Å
201	I	93	Very high	89.2	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-63.6	-47.5	177.2	-64.1	166.5	0	0	0	110.6	I197 Q198 S203 L204 L205 M243 V248 A251	I197-I201 HydrophobicContact CG2-CD1 3.89Å; I197-I201 WeakPolarHBondContact O-CG1 3.37Å; I197-I201 PolarHBondContact O-N 3.39Å; Q198-I201 PolarHBondContact O-N 3.36Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3.47Å; I201-L204 WeakPolarHBondContact O-CB 3.25Å; I201-L204 PolarHBondContact O-N 2.94Å; I201-L205 HydrophobicContact CG2-CD1 4.19Å; I201-L205 WeakPolarHBondContact O-CG 3.4Å; I201-L205 PolarHBondContact O-N 2.95Å; I201-M243 HydrophobicContact CD1-SD 4.24Å; I201-M243 HydrophobicContact CG1-SD 4.49Å; I201-V248 HydrophobicContact CG2-CG1 4.47Å; I201-A251 HydrophobicContact CB-CB 4.23Å; I201-A251 HydrophobicContact CD1-CB 4.43Å; I201-A251 HydrophobicContact CG2-CB 3.67Å
202	V	92.6	Very high	88.5	Confident	25 Å²	25	59 Å²	59	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-42.2	177.5	174.2	0	0	0	0	110.7	Q198 L204 L205 D206 L255	Q198-V202 HydrophobicContact CG-CG2 4.25Å; Q198-V202 VanDerWaalsContact O-CG2 3.29Å; Q198-V202 WeakPolarHBondContact O-CG2 3.34Å; Q198-V202 PolarHBondContact O-N 2.88Å; V202-L204 VanDerWaalsContact C-N 3.31Å; V202-L204 PolarHBondContact O-N 2.75Å; V202-L205 PolarHBondContact O-N 3.16Å; V202-L205 VanDerWaalsContact O-N 3.09Å; V202-D206 WeakPolarHBondContact CG1-OD2 3.44Å; V202-D206 WeakPolarHBondContact O-CB 3.43Å; V202-D206 PolarHBondContact O-N 3.16Å; V202-L255 HydrophobicContact CG1-CD1 4.45Å; V202-L255 HydrophobicContact CG2-CD1 4.24Å
203	S	94.6	Very high	87.8	Confident	32 Å²	32	59.5 Å²	59.5	22%	0.224	35%	0.354	C	S	.	.	H	α-helix	trans	-60.7	-40	176.9	-60.1	0	0	0	0	112	N199 H200 I201 D206 L207 H228	N199-S203 VanDerWaalsContact O-CB 3.24Å; N199-S203 WeakPolarHBondContact O-CB 3.43Å; N199-S203 PolarHBondContact O-N 3.12Å; N199-S203 PolarHBondContact O-OG 3.32Å; H200-S203 PolarHBondContact O-N 3.48Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3.47Å; S203-D206 PolarHBondContact O-N 3.06Å; S203-L207 WeakPolarHBondContact O-CG 3.37Å; S203-L207 PolarHBondContact O-N 2.84Å; S203-H228 VanDerWaalsContact CB-CE1 3.42Å; S203-H228 WeakPolarHBondContact CB-CE1 3.31Å; S203-H228 WeakPolarHBondContact CB-NE2 3.3Å
204	L	93	Very high	87.6	Confident	45 Å²	45	58.2 Å²	58.2	24%	0.236	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-39.9	173.7	-78	167.3	0	0	0	112.5	H200 I201 V202 L207 L225 H228 L232	H200-L204 WeakPolarHBondContact O-CG 3.28Å; H200-L204 PolarHBondContact O-N 2.88Å; I201-L204 WeakPolarHBondContact O-CB 3.25Å; I201-L204 PolarHBondContact O-N 2.94Å; V202-L204 VanDerWaalsContact C-N 3.31Å; V202-L204 PolarHBondContact O-N 2.75Å; L204-L207 HydrophobicContact CD2-CD1 4.12Å; L204-L225 HydrophobicContact CD2-CD2 3.85Å; L204-H228 HydrophobicContact CD1-CB 4.04Å; L204-H228 HydrophobicContact CD2-CB 3.69Å; L204-H228 HydrophobicContact CG-CB 3.67Å; L204-L232 HydrophobicContact CD1-CD1 3.98Å
205	L	90.3	Very high	87.6	Confident	84 Å²	84	57.6 Å²	57.6	44%	0.44	35%	0.353	S	S	.	.	H	α-helix	trans	-71	-31.2	178.4	-66.3	171.4	0	0	0	112.7	I201 V202 I252 L255	I201-L205 HydrophobicContact CG2-CD1 4.19Å; I201-L205 WeakPolarHBondContact O-CG 3.4Å; I201-L205 PolarHBondContact O-N 2.95Å; V202-L205 PolarHBondContact O-N 3.16Å; V202-L205 VanDerWaalsContact O-N 3.09Å; L205-I252 HydrophobicContact CD1-CG1 3.68Å; L205-I252 HydrophobicContact CD2-CG1 4.47Å; L205-L255 HydrophobicContact CD1-CD1 4.05Å
206	D	90.8	Very high	87.5	Confident	105 Å²	105	63.4 Å²	63.4	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-87.1	-4.8	-179	-72.7	-18.1	0	0	0	113.4	V202 S203 Q208	V202-D206 WeakPolarHBondContact CG1-OD2 3.44Å; V202-D206 WeakPolarHBondContact O-CB 3.43Å; V202-D206 PolarHBondContact O-N 3.16Å; S203-D206 PolarHBondContact O-N 3.06Å; D206-Q208 PolarHBondContact O-N 3Å; D206-Q208 PolarHBondContact O-NE2 3.17Å
207	L	91.6	Very high	87.2	Confident	48 Å²	48	69.3 Å²	69.3	25%	0.251	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-58.4	129.3	175.9	-77.5	176.4	0	0	0	111	S203 L204 K224 L225	S203-L207 WeakPolarHBondContact O-CG 3.37Å; S203-L207 PolarHBondContact O-N 2.84Å; L204-L207 HydrophobicContact CD2-CD1 4.12Å; L207-K224 HydrophobicContact CD1-CB 4.38Å; L207-K224 HydrophobicContact CD2-CB 3.96Å; L207-K224 HydrophobicContact CD2-CG 4.45Å; L207-L225 HydrophobicContact CD1-CD2 3.54Å; L207-L225 HydrophobicContact CD1-CG 4.02Å
208	Q	84.5	Confident	87.3	Confident	157 Å²	157	72.4 Å²	72.4	73%	0.734	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-68.4	137.1	-178.2	-66.5	-60	-60.6	0	0	111.7	D206 C210	D206-Q208 PolarHBondContact O-N 3Å; D206-Q208 PolarHBondContact O-NE2 3.17Å; Q208-C210 PolarHBondContact O-N 3.22Å
209	P	85.6	Confident	87.5	Confident	112 Å²	112	78.2 Å²	78.2	73%	0.727	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-59.3	131.4	174.1	-24.3	33.9	0	0	0	112.1	A211	P209-A211 PolarHBondContact O-N 2.9Å
210	C	81.4	Confident	87.3	Confident	45 Å²	45	81 Å²	81	30%	0.304	45%	0.449	S	S	.	.			trans	-79	90.1	174.2	-171.8	0	0	0	0	110.3	Q208 Q212 L221	Q208-C210 PolarHBondContact O-N 3.22Å; C210-Q212 VanDerWaalsContact C-N 3.32Å; C210-Q212 PolarHBondContact O-N 3.3Å; C210-Q212 PolarHBondContact SG-O 2.88Å; C210-L221 HydrophobicContact CB-CD2 3.68Å
211	A	74.9	Confident	87.3	Confident	100 Å²	100	83 Å²	83	83%	0.826	46%	0.459	S	S	*	.			trans	-73.2	-18.3	-177.4	0	0	0	0	0	114.6	P209	P209-A211 PolarHBondContact O-N 2.9Å
212	Q	75.2	Confident	87.3	Confident	96 Å²	96	87.6 Å²	87.6	45%	0.449	48%	0.48	S	S	.	.	S	Bend	trans	-123.7	123.6	-177.3	-67.4	178.6	3.7	0	0	110.5	C210 S214	C210-Q212 VanDerWaalsContact C-N 3.32Å; C210-Q212 PolarHBondContact O-N 3.3Å; C210-Q212 PolarHBondContact SG-O 2.88Å; Q212-S214 PolarHBondContact O-N 3.39Å
213	G	75.5	Confident	87.4	Confident	69 Å²	69	90.5 Å²	90.5	71%	0.711	50%	0.495	S	S	*	.			trans	-73.6	29.6	-175.6	0	0	0	0	0	116.4
214	S	83.9	Confident	87.4	Confident	48 Å²	48	92.7 Å²	92.7	34%	0.336	50%	0.5	S	S	.	.			trans	-67.9	138.8	174.2	62.9	0	0	0	0	110.7	Q212 E216 R217 L218	Q212-S214 PolarHBondContact O-N 3.39Å; S214-E216 VanDerWaalsContact C-N 3.26Å; S214-E216 PolarHBondContact O-N 2.79Å; S214-R217 PolarHBondContact O-N 3.37Å; S214-R217 WeakPolarHBondContact OG-CB 3.45Å; S214-R217 VanDerWaalsContact OG-CG 3.32Å; S214-R217 WeakPolarHBondContact OG-CG 3.4Å; S214-L218 PolarHBondContact O-N 2.89Å
215	A	86.5	Confident	87.5	Confident	69 Å²	69	94 Å²	94	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-56.2	-37.1	-179.3	0	0	0	0	0	113.5	R219	A215-R219 VanDerWaalsContact O-CB 3.29Å; A215-R219 WeakPolarHBondContact O-CB 3.32Å; A215-R219 PolarHBondContact O-N 3.42Å
216	E	85.2	Confident	87.7	Confident	160 Å²	160	91.5 Å²	91.5	75%	0.748	50%	0.495	S	S	*	.	H	α-helix	trans	-61.8	-48.5	177.7	-174.9	-178.1	177.5	0	0	112	S214 R219 H220	S214-E216 VanDerWaalsContact C-N 3.26Å; S214-E216 PolarHBondContact O-N 2.79Å; E216-R219 PolarHBondContact O-N 3.33Å; E216-H220 PolarHBondContact O-N 3.34Å
217	R	86	Confident	87.9	Confident	127 Å²	127	90.8 Å²	90.8	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-71.1	-37.6	179.4	-66.4	-175.7	-179.2	164.8	7.2	113.1	S214 R219 H220 L221	S214-R217 PolarHBondContact O-N 3.37Å; S214-R217 WeakPolarHBondContact OG-CB 3.45Å; S214-R217 VanDerWaalsContact OG-CG 3.32Å; S214-R217 WeakPolarHBondContact OG-CG 3.4Å; R217-R219 VanDerWaalsContact C-N 3.3Å; R217-R219 PolarHBondContact O-N 2.9Å; R217-H220 PolarHBondContact O-N 3.09Å; R217-L221 PolarHBondContact O-N 3.37Å
218	L	91.9	Very high	88	Confident	86 Å²	86	88.8 Å²	88.8	45%	0.45	47%	0.474	S	S	.	.	H	α-helix	trans	-62.7	-39.6	173.7	-71.4	174.5	0	0	0	111.2	S214 L221 H222	S214-L218 PolarHBondContact O-N 2.89Å; L218-L221 PolarHBondContact O-N 2.91Å; L218-H222 VanDerWaalsContact O-CB 3.26Å; L218-H222 WeakPolarHBondContact O-CB 3.4Å; L218-H222 PolarHBondContact O-N 3.08Å
219	R	92.8	Very high	88.5	Confident	164 Å²	164	83.8 Å²	83.8	62%	0.619	46%	0.455	S	S	*	.	H	α-helix	trans	-64.5	-44.1	173.7	-173.6	165.6	-66.8	142.4	2.4	111.8	A215 E216 R217 L221 H222 D223	A215-R219 VanDerWaalsContact O-CB 3.29Å; A215-R219 WeakPolarHBondContact O-CB 3.32Å; A215-R219 PolarHBondContact O-N 3.42Å; E216-R219 PolarHBondContact O-N 3.33Å; R217-R219 VanDerWaalsContact C-N 3.3Å; R217-R219 PolarHBondContact O-N 2.9Å; R219-L221 PolarHBondContact O-N 2.92Å; R219-H222 WeakPolarHBondContact O-CB 3.39Å; R219-H222 PolarHBondContact O-N 3.41Å; R219-D223 WeakPolarHBondContact O-CB 3.26Å; R219-D223 PolarHBondContact O-N 3.22Å
220	H	90.1	Very high	88.8	Confident	118 Å²	118	86.9 Å²	86.9	55%	0.546	45%	0.452	S	S	.	.	H	α-helix	trans	-59.5	-46.4	175.4	-176.5	75.8	0	0	0	112.6	E216 R217 D223 K224	E216-H220 PolarHBondContact O-N 3.34Å; R217-H220 PolarHBondContact O-N 3.09Å; H220-D223 PolarHBondContact O-N 3.21Å; H220-K224 WeakPolarHBondContact O-CG 3.27Å; H220-K224 PolarHBondContact O-N 3.45Å; H220-K224 VanDerWaalsContact O-N 3.07Å
221	L	93	Very high	89.3	Confident	46 Å²	46	85.8 Å²	85.8	24%	0.241	45%	0.446	C	S	.	.	H	α-helix	trans	-61.7	-46.7	176.1	176.6	63.6	0	0	0	111.2	C210 R217 L218 R219 D223 K224 L225	C210-L221 HydrophobicContact CB-CD2 3.68Å; R217-L221 PolarHBondContact O-N 3.37Å; L218-L221 PolarHBondContact O-N 2.91Å; R219-L221 PolarHBondContact O-N 2.92Å; L221-D223 PolarHBondContact O-N 3.27Å; L221-K224 PolarHBondContact O-N 3.14Å; L221-L225 HydrophobicContact CD1-CD1 3.96Å; L221-L225 HydrophobicContact CD1-CG 4.04Å; L221-L225 HydrophobicContact CD2-CD1 4.43Å; L221-L225 HydrophobicContact CG-CD1 3.83Å; L221-L225 HydrophobicContact CG-CG 4.34Å; L221-L225 WeakPolarHBondContact O-CB 3.11Å; L221-L225 VanDerWaalsContact O-CG 3.31Å; L221-L225 WeakPolarHBondContact O-CG 3.35Å; L221-L225 PolarHBondContact O-N 3.48Å
222	H	94.4	Very high	90.2	Very high	104 Å²	104	81 Å²	81	48%	0.481	41%	0.407	S	S	.	.	H	α-helix	trans	-54.4	-52.9	175.5	167.1	-86.2	0	0	0	111.1	L218 R219 K224 L225 T226	L218-H222 VanDerWaalsContact O-CB 3.26Å; L218-H222 WeakPolarHBondContact O-CB 3.4Å; L218-H222 PolarHBondContact O-N 3.08Å; R219-H222 WeakPolarHBondContact O-CB 3.39Å; R219-H222 PolarHBondContact O-N 3.41Å; H222-K224 VanDerWaalsContact C-N 3.28Å; H222-K224 PolarHBondContact O-N 3.44Å; H222-L225 PolarHBondContact O-N 3.21Å; H222-T226 VanDerWaalsContact O-CB 3.31Å; H222-T226 WeakPolarHBondContact O-CB 3.45Å; H222-T226 PolarHBondContact O-N 3.06Å; H222-T226 PolarHBondContact O-OG1 3.12Å
223	D	95	Very high	90.9	Very high	86 Å²	86	78.5 Å²	78.5	46%	0.46	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-37	-176.3	-64.3	-15.4	0	0	0	111.6	R219 H220 L221 W227	R219-D223 WeakPolarHBondContact O-CB 3.26Å; R219-D223 PolarHBondContact O-N 3.22Å; H220-D223 PolarHBondContact O-N 3.21Å; L221-D223 PolarHBondContact O-N 3.27Å; D223-W227 WeakPolarHBondContact O-CB 3Å; D223-W227 PolarHBondContact O-N 2.79Å
224	K	94.9	Very high	91.5	Very high	77 Å²	77	79.5 Å²	79.5	34%	0.335	40%	0.4	S	S	.	.	H	α-helix	trans	-69	-46.3	175.6	-73.6	-67.8	-178.2	-178.1	0	113.2	L207 H220 L221 H222 W227 H228	L207-K224 HydrophobicContact CD1-CB 4.38Å; L207-K224 HydrophobicContact CD2-CB 3.96Å; L207-K224 HydrophobicContact CD2-CG 4.45Å; H220-K224 WeakPolarHBondContact O-CG 3.27Å; H220-K224 PolarHBondContact O-N 3.45Å; H220-K224 VanDerWaalsContact O-N 3.07Å; L221-K224 PolarHBondContact O-N 3.14Å; H222-K224 VanDerWaalsContact C-N 3.28Å; H222-K224 PolarHBondContact O-N 3.44Å; K224-W227 HydrophobicContact CD-CE3 4.25Å; K224-W227 PolarHBondContact O-N 3.38Å; K224-H228 PolarHBondContact O-CD2 3.43Å; K224-H228 PolarHBondContact O-N 3.37Å
225	L	94.6	Very high	91.7	Very high	72 Å²	72	79.8 Å²	79.8	38%	0.377	40%	0.397	S	S	.	.	H	α-helix	trans	-59.4	-50	175.3	-72.3	170.3	0	0	0	110.4	L204 L207 L221 H222 W227 H228 V229	L204-L225 HydrophobicContact CD2-CD2 3.85Å; L207-L225 HydrophobicContact CD1-CD2 3.54Å; L207-L225 HydrophobicContact CD1-CG 4.02Å; L221-L225 HydrophobicContact CD1-CD1 3.96Å; L221-L225 HydrophobicContact CD1-CG 4.04Å; L221-L225 HydrophobicContact CD2-CD1 4.43Å; L221-L225 HydrophobicContact CG-CD1 3.83Å; L221-L225 HydrophobicContact CG-CG 4.34Å; L221-L225 WeakPolarHBondContact O-CB 3.11Å; L221-L225 VanDerWaalsContact O-CG 3.31Å; L221-L225 WeakPolarHBondContact O-CG 3.35Å; L221-L225 PolarHBondContact O-N 3.48Å; H222-L225 PolarHBondContact O-N 3.21Å; L225-W227 PolarHBondContact O-N 3.08Å; L225-H228 PolarHBondContact O-N 3.31Å; L225-V229 VanDerWaalsContact O-CG2 3.31Å; L225-V229 WeakPolarHBondContact O-CG2 3.37Å; L225-V229 PolarHBondContact O-N 3.37Å
226	T	94.8	Very high	91.7	Very high	32 Å²	32	78.4 Å²	78.4	20%	0.196	39%	0.39	C	S	.	.	H	α-helix	trans	-64.5	-37.9	-179.7	-57.8	0	0	0	0	112.2	H222 R230	H222-T226 VanDerWaalsContact O-CB 3.31Å; H222-T226 WeakPolarHBondContact O-CB 3.45Å; H222-T226 PolarHBondContact O-N 3.06Å; H222-T226 PolarHBondContact O-OG1 3.12Å; T226-R230 HydrophobicContact CG2-CG 4.11Å; T226-R230 VanDerWaalsContact CG2-NE 3.28Å; T226-R230 VanDerWaalsContact O-CB 3.27Å; T226-R230 WeakPolarHBondContact O-CB 3.21Å; T226-R230 WeakPolarHBondContact O-CG 3.19Å; T226-R230 PolarHBondContact O-N 2.95Å
227	W	93.6	Very high	91.9	Very high	90 Å²	90	73.6 Å²	73.6	34%	0.341	37%	0.366	S	S	.	.	H	α-helix	trans	-59.6	-51.8	176.6	172.6	53.5	0	0	0	112	L129 E130 D223 K224 L225 R230 A231	L129-W227 HydrophobicContact CD1-CH2 4.02Å; E130-W227 WeakPolarHBondContact OE1-CZ2 3.44Å; D223-W227 WeakPolarHBondContact O-CB 3Å; D223-W227 PolarHBondContact O-N 2.79Å; K224-W227 HydrophobicContact CD-CE3 4.25Å; K224-W227 PolarHBondContact O-N 3.38Å; L225-W227 PolarHBondContact O-N 3.08Å; W227-R230 PolarHBondContact O-N 3.33Å; W227-A231 WeakPolarHBondContact O-CB 3.46Å; W227-A231 PolarHBondContact O-N 2.96Å
228	H	95	Very high	91.9	Very high	6 Å²	6	70.1 Å²	70.1	3%	0.028	36%	0.357	C	S	.	.	H	α-helix	trans	-65.6	-41	179.3	-69	-47.7	0	0	0	112.7	H200 S203 L204 K224 L225 A231 L232	H200-H228 AromaticContact CE1-ND1 3.72Å; H200-H228 AromaticContact ND1-CE1 3.91Å; H200-H228 AromaticContact ND1-CG 3.92Å; H200-H228 AromaticContact ND1-ND1 3.03Å; H200-H228 PolarHBondContact ND1-ND1 2.88Å; S203-H228 VanDerWaalsContact CB-CE1 3.42Å; S203-H228 WeakPolarHBondContact CB-CE1 3.31Å; S203-H228 WeakPolarHBondContact CB-NE2 3.3Å; L204-H228 HydrophobicContact CD1-CB 4.04Å; L204-H228 HydrophobicContact CD2-CB 3.69Å; L204-H228 HydrophobicContact CG-CB 3.67Å; K224-H228 PolarHBondContact O-CD2 3.43Å; K224-H228 PolarHBondContact O-N 3.37Å; L225-H228 PolarHBondContact O-N 3.31Å; H228-A231 PolarHBondContact O-N 3.12Å; H228-L232 WeakPolarHBondContact O-CG 3.42Å; H228-L232 PolarHBondContact O-N 2.88Å
229	V	93.8	Very high	91.5	Very high	53 Å²	53	68.7 Å²	68.7	32%	0.321	35%	0.353	S	S	.	.	H	α-helix	trans	-63.2	-44.2	176.2	171.6	0	0	0	0	111.1	L225 A231 L232 C233 P239	L225-V229 VanDerWaalsContact O-CG2 3.31Å; L225-V229 WeakPolarHBondContact O-CG2 3.37Å; L225-V229 PolarHBondContact O-N 3.37Å; V229-A231 PolarHBondContact O-N 3.48Å; V229-L232 PolarHBondContact O-N 3.14Å; V229-C233 PolarHBondContact O-N 3Å; V229-C233 PolarHBondContact O-SG 2.95Å; V229-P239 HydrophobicContact CG1-CG 4.31Å
230	R	93.1	Very high	91	Very high	176 Å²	176	65.3 Å²	65.3	66%	0.664	36%	0.36	S	S	*	.	H	α-helix	trans	-62.9	-40.8	177	-76	175.5	178.5	161	2.5	112.3	T226 W227 C233 A234	T226-R230 HydrophobicContact CG2-CG 4.11Å; T226-R230 VanDerWaalsContact CG2-NE 3.28Å; T226-R230 VanDerWaalsContact O-CB 3.27Å; T226-R230 WeakPolarHBondContact O-CB 3.21Å; T226-R230 WeakPolarHBondContact O-CG 3.19Å; T226-R230 PolarHBondContact O-N 2.95Å; W227-R230 PolarHBondContact O-N 3.33Å; R230-C233 WeakPolarHBondContact O-CB 3.39Å; R230-C233 PolarHBondContact O-N 3.38Å; R230-A234 PolarHBondContact O-N 3.33Å
231	A	91.8	Very high	90.5	Very high	22 Å²	22	62.9 Å²	62.9	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-64.2	-42	177.1	0	0	0	0	0	111.8	H200 W227 H228 V229 A234 M235	H200-A231 WeakPolarHBondContact CE1-CB 3.42Å; H200-A231 VanDerWaalsContact NE2-CB 3.3Å; H200-A231 WeakPolarHBondContact NE2-CB 3.44Å; W227-A231 WeakPolarHBondContact O-CB 3.46Å; W227-A231 PolarHBondContact O-N 2.96Å; H228-A231 PolarHBondContact O-N 3.12Å; V229-A231 PolarHBondContact O-N 3.48Å; A231-A234 PolarHBondContact O-N 3.28Å; A231-M235 WeakPolarHBondContact O-CG 3.18Å; A231-M235 PolarHBondContact O-N 2.85Å; A231-M235 VanDerWaalsContact O-N 3.11Å
232	L	92.2	Very high	90.1	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-61.6	-42.8	172.5	-72.7	169.4	0	0	0	112.1	I197 H200 L204 H228 V229 A234 M235 G236 K237	I197-L232 HydrophobicContact CB-CD2 4.42Å; I197-L232 HydrophobicContact CG2-CD2 4.01Å; H200-L232 HydrophobicContact CB-CD1 4.26Å; H200-L232 HydrophobicContact CB-CD2 3.77Å; H200-L232 HydrophobicContact CB-CG 3.87Å; L204-L232 HydrophobicContact CD1-CD1 3.98Å; H228-L232 WeakPolarHBondContact O-CG 3.42Å; H228-L232 PolarHBondContact O-N 2.88Å; V229-L232 PolarHBondContact O-N 3.14Å; L232-A234 VanDerWaalsContact C-N 3.35Å; L232-A234 PolarHBondContact O-N 2.87Å; L232-M235 PolarHBondContact O-N 3.38Å; L232-G236 PolarHBondContact O-N 3.46Å; L232-K237 CarbonylContact O-C 3.58Å; L232-K237 WeakPolarHBondContact O-CA 3.15Å; L232-K237 PolarHBondContact O-N 3.13Å
233	C	91.8	Very high	89.7	Confident	42 Å²	42	62.8 Å²	62.8	28%	0.284	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-42.5	174	-65.9	0	0	0	0	112.3	V229 R230 M235 G236 N238	V229-C233 PolarHBondContact O-N 3Å; V229-C233 PolarHBondContact O-SG 2.95Å; R230-C233 WeakPolarHBondContact O-CB 3.39Å; R230-C233 PolarHBondContact O-N 3.38Å; C233-M235 PolarHBondContact O-N 3.34Å; C233-G236 PolarHBondContact O-N 3.25Å; C233-N238 HydrophobicContact CB-CB 4.39Å; C233-N238 PolarHBondContact SG-OD1 2.93Å
234	A	87.6	Confident	89.3	Confident	90 Å²	90	62 Å²	62	74%	0.744	37%	0.365	S	S	*	.	H	α-helix	trans	-63.5	-29.8	178	0	0	0	0	0	112.5	R230 A231 L232 G236	R230-A234 PolarHBondContact O-N 3.33Å; A231-A234 PolarHBondContact O-N 3.28Å; L232-A234 VanDerWaalsContact C-N 3.35Å; L232-A234 PolarHBondContact O-N 2.87Å; A234-G236 PolarHBondContact O-N 2.91Å
235	M	87.9	Confident	89	Confident	55 Å²	55	61.9 Å²	61.9	27%	0.271	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	7.2	173.9	-66.4	-73	-67.2	0	0	113.4	V132 P193 I196 I197 A231 L232 C233 K237	V132-M235 HydrophobicContact CG2-SD 3.92Å; P193-M235 HydrophobicContact CB-CE 3.95Å; I196-M235 HydrophobicContact CB-CE 4.28Å; I196-M235 HydrophobicContact CD1-CE 4.32Å; I196-M235 HydrophobicContact CG2-CE 4.2Å; I197-M235 HydrophobicContact CG1-CE 4.41Å; A231-M235 WeakPolarHBondContact O-CG 3.18Å; A231-M235 PolarHBondContact O-N 2.85Å; A231-M235 VanDerWaalsContact O-N 3.11Å; L232-M235 PolarHBondContact O-N 3.38Å; C233-M235 PolarHBondContact O-N 3.34Å; M235-K237 VanDerWaalsContact C-N 3.3Å; M235-K237 PolarHBondContact O-N 2.93Å
236	G	87.1	Confident	88.6	Confident	40 Å²	40	60 Å²	60	41%	0.412	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	16.5	-177.4	0	0	0	0	0	114.4	L232 C233 A234 Q242	L232-G236 PolarHBondContact O-N 3.46Å; C233-G236 PolarHBondContact O-N 3.25Å; A234-G236 PolarHBondContact O-N 2.91Å; G236-Q242 PolarHBondContact O-OE1 2.9Å
237	K	87.7	Confident	88.3	Confident	59 Å²	59	60.8 Å²	60.8	26%	0.257	37%	0.374	S	S	.	.			trans	-116.6	55.3	179.9	-62.8	-65.1	179.9	172.4	0	110.9	I197 L232 M235 P239 M243 E247	I197-K237 HydrophobicContact CD1-CD 4.49Å; I197-K237 HydrophobicContact CD1-CG 3.7Å; I197-K237 HydrophobicContact CG1-CG 4.19Å; L232-K237 CarbonylContact O-C 3.58Å; L232-K237 WeakPolarHBondContact O-CA 3.15Å; L232-K237 PolarHBondContact O-N 3.13Å; M235-K237 VanDerWaalsContact C-N 3.3Å; M235-K237 PolarHBondContact O-N 2.93Å; K237-P239 VanDerWaalsContact O-CD 3.32Å; K237-P239 WeakPolarHBondContact O-CD 3.35Å; K237-M243 HydrophobicContact CB-CB 4.4Å; K237-E247 WeakPolarHBondContact CD-OE1 3.45Å; K237-E247 WeakPolarHBondContact CE-OE1 3.38Å; K237-E247 IonicContact NZ-OE1 3.68Å; K237-E247 PolarHBondContact NZ-OE1 3.34Å; K237-E247 IonicContact NZ-OE2 2.81Å
238	N	87.5	Confident	88.1	Confident	54 Å²	54	58.4 Å²	58.4	29%	0.289	37%	0.37	S	S	.	.			trans	-63.6	121.4	176.5	-174	-16.4	0	0	0	111.5	C233 A240 G241 Q242 M243	C233-N238 HydrophobicContact CB-CB 4.39Å; C233-N238 PolarHBondContact SG-OD1 2.93Å; N238-A240 PolarHBondContact O-N 3.5Å; N238-A240 VanDerWaalsContact O-N 3.09Å; N238-A240 WeakPolarHBondContact OD1-CB 3.45Å; N238-A240 PolarHBondContact OD1-N 3.36Å; N238-G241 PolarHBondContact O-N 3.3Å; N238-Q242 HydrophobicContact CB-CB 4.22Å; N238-Q242 HydrophobicContact CB-CG 4.36Å; N238-Q242 VanDerWaalsContact CB-OE1 3.27Å; N238-Q242 PolarHBondContact O-N 3.14Å; N238-M243 PolarHBondContact O-N 2.88Å
239	P	83.1	Confident	88	Confident	55 Å²	55	61.2 Å²	61.2	36%	0.357	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.7	176.5	-25.1	34.8	0	0	0	115.3	V229 K237 G241 M243	V229-P239 HydrophobicContact CG1-CG 4.31Å; K237-P239 VanDerWaalsContact O-CD 3.32Å; K237-P239 WeakPolarHBondContact O-CD 3.35Å; P239-G241 PolarHBondContact O-N 2.95Å; P239-M243 HydrophobicContact CB-CE 3.79Å; P239-M243 HydrophobicContact CG-CE 3.84Å
240	A	82	Confident	87.8	Confident	93 Å²	93	59.5 Å²	59.5	77%	0.769	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.6	-179.8	0	0	0	0	0	114.4	N238	N238-A240 PolarHBondContact O-N 3.5Å; N238-A240 VanDerWaalsContact O-N 3.09Å; N238-A240 WeakPolarHBondContact OD1-CB 3.45Å; N238-A240 PolarHBondContact OD1-N 3.36Å
241	G	79.1	Confident	87.7	Confident	68 Å²	68	51.2 Å²	51.2	70%	0.701	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	171.8	-14.2	174.3	0	0	0	0	0	117.3	N238 P239	N238-G241 PolarHBondContact O-N 3.3Å; P239-G241 PolarHBondContact O-N 2.95Å
242	Q	85.2	Confident	87.7	Confident	114 Å²	114	52.5 Å²	52.5	53%	0.533	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-33.1	179	-68.3	176	-40.2	0	0	112.7	G236 N238	G236-Q242 PolarHBondContact O-OE1 2.9Å; N238-Q242 HydrophobicContact CB-CB 4.22Å; N238-Q242 HydrophobicContact CB-CG 4.36Å; N238-Q242 VanDerWaalsContact CB-OE1 3.27Å; N238-Q242 PolarHBondContact O-N 3.14Å
243	M	86.6	Confident	87.8	Confident	34 Å²	34	54.9 Å²	54.9	17%	0.167	36%	0.357	C	S	.	.	S	Bend	trans	-78.1	127.8	174.5	-168.5	175	64	0	0	109.4	I201 K237 N238 P239 E247 V248	I201-M243 HydrophobicContact CD1-SD 4.24Å; I201-M243 HydrophobicContact CG1-SD 4.49Å; K237-M243 HydrophobicContact CB-CB 4.4Å; N238-M243 PolarHBondContact O-N 2.88Å; P239-M243 HydrophobicContact CB-CE 3.79Å; P239-M243 HydrophobicContact CG-CE 3.84Å; M243-E247 HydrophobicContact CG-CB 4.46Å; M243-V248 HydrophobicContact CE-CG2 3.36Å; M243-V248 HydrophobicContact CG-CG2 4.3Å; M243-V248 HydrophobicContact SD-CG2 3.8Å
244	T	86.8	Confident	87.7	Confident	70 Å²	70	53.7 Å²	53.7	43%	0.429	35%	0.346	S	S	.	.			trans	-81.4	150.1	178.8	64.8	0	0	0	0	110.4	A246 E247	T244-A246 PolarHBondContact O-N 3.3Å; T244-E247 PolarHBondContact N-OE2 3.21Å; T244-E247 PolarHBondContact O-N 3.46Å; T244-E247 VanDerWaalsContact OG1-CG 3.32Å; T244-E247 WeakPolarHBondContact OG1-CG 3.27Å; T244-E247 PolarHBondContact OG1-N 3.46Å; T244-E247 PolarHBondContact OG1-OE2 3.38Å
245	A	87.2	Confident	87.8	Confident	74 Å²	74	52.5 Å²	52.5	61%	0.612	33%	0.327	S	S	*	.	H	α-helix	trans	-57.9	-29.9	169.7	0	0	0	0	0	111.7	E247 V248 L249	A245-E247 PolarHBondContact O-N 2.93Å; A245-V248 PolarHBondContact O-N 3.09Å; A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 WeakPolarHBondContact O-CG 3.31Å; A245-L249 PolarHBondContact O-N 3.13Å
246	A	87.6	Confident	88	Confident	33 Å²	33	58 Å²	58	27%	0.273	35%	0.35	S	S	.	.	H	α-helix	trans	-59.2	-45	177.3	0	0	0	0	0	113	T244 V248 L249 L250 L278	T244-A246 PolarHBondContact O-N 3.3Å; A246-V248 PolarHBondContact O-N 3.06Å; A246-L249 PolarHBondContact O-N 2.62Å; A246-L250 WeakPolarHBondContact O-CB 3.28Å; A246-L250 VanDerWaalsContact O-CG 3.31Å; A246-L250 WeakPolarHBondContact O-CG 3.42Å; A246-L250 PolarHBondContact O-N 3.22Å; A246-L278 HydrophobicContact CB-CD1 3.8Å; A246-L278 HydrophobicContact CB-CD2 4.48Å; A246-L278 HydrophobicContact CB-CG 3.78Å
247	E	87.1	Confident	88.1	Confident	47 Å²	47	56.9 Å²	56.9	22%	0.22	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-43.1	179.4	-71.2	162.8	128.5	0	0	112.1	K237 M243 T244 A245 A251	K237-E247 WeakPolarHBondContact CD-OE1 3.45Å; K237-E247 WeakPolarHBondContact CE-OE1 3.38Å; K237-E247 IonicContact NZ-OE1 3.68Å; K237-E247 PolarHBondContact NZ-OE1 3.34Å; K237-E247 IonicContact NZ-OE2 2.81Å; M243-E247 HydrophobicContact CG-CB 4.46Å; T244-E247 PolarHBondContact N-OE2 3.21Å; T244-E247 PolarHBondContact O-N 3.46Å; T244-E247 VanDerWaalsContact OG1-CG 3.32Å; T244-E247 WeakPolarHBondContact OG1-CG 3.27Å; T244-E247 PolarHBondContact OG1-N 3.46Å; T244-E247 PolarHBondContact OG1-OE2 3.38Å; A245-E247 PolarHBondContact O-N 2.93Å; E247-A251 PolarHBondContact O-N 2.93Å
248	V	90.3	Very high	88.1	Confident	41 Å²	41	57.3 Å²	57.3	25%	0.248	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-45.4	176.9	-178.1	0	0	0	0	110.8	I201 M243 A245 A246 L250 A251 I252	I201-V248 HydrophobicContact CG2-CG1 4.47Å; M243-V248 HydrophobicContact CE-CG2 3.36Å; M243-V248 HydrophobicContact CG-CG2 4.3Å; M243-V248 HydrophobicContact SD-CG2 3.8Å; A245-V248 PolarHBondContact O-N 3.09Å; A246-V248 PolarHBondContact O-N 3.06Å; V248-L250 PolarHBondContact O-N 2.98Å; V248-A251 PolarHBondContact O-N 3.37Å; V248-I252 HydrophobicContact CG1-CD1 3.96Å; V248-I252 WeakPolarHBondContact O-CG1 3.39Å; V248-I252 PolarHBondContact O-N 3.24Å
249	L	92.6	Very high	88.1	Confident	65 Å²	65	61.5 Å²	61.5	34%	0.34	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-41.4	179.1	-73.4	172.9	0	0	0	111.8	A245 A246 A251 I252 F253 L278	A245-L249 WeakPolarHBondContact O-CB 3.41Å; A245-L249 WeakPolarHBondContact O-CG 3.31Å; A245-L249 PolarHBondContact O-N 3.13Å; A246-L249 PolarHBondContact O-N 2.62Å; L249-A251 VanDerWaalsContact C-N 3.35Å; L249-A251 PolarHBondContact O-N 2.86Å; L249-I252 PolarHBondContact O-N 3.45Å; L249-F253 HydrophobicContact CB-CE1 4.41Å; L249-F253 HydrophobicContact CB-CE2 4.17Å; L249-F253 HydrophobicContact CB-CZ 4.04Å; L249-F253 HydrophobicContact CD2-CE1 4.11Å; L249-F253 HydrophobicContact CD2-CZ 4.13Å; L249-F253 HydrophobicContact CG-CZ 4.49Å; L249-F253 WeakPolarHBondContact O-CB 3.49Å; L249-F253 WeakPolarHBondContact O-CD1 3.35Å; L249-F253 WeakPolarHBondContact O-CG 3.18Å; L249-F253 PolarHBondContact O-N 2.93Å; L249-L278 HydrophobicContact CB-CD2 3.88Å; L249-L278 HydrophobicContact CD1-CD1 4.18Å
250	L	90.4	Very high	88.4	Confident	16 Å²	16	64.1 Å²	64.1	8%	0.084	37%	0.366	C	S	.	.	H	α-helix	trans	-58.8	-45.5	175.1	-77.9	171.5	0	0	0	111.6	A246 V248 I252 F253 K254 V276 L278 F281	A246-L250 WeakPolarHBondContact O-CB 3.28Å; A246-L250 VanDerWaalsContact O-CG 3.31Å; A246-L250 WeakPolarHBondContact O-CG 3.42Å; A246-L250 PolarHBondContact O-N 3.22Å; V248-L250 PolarHBondContact O-N 2.98Å; L250-I252 VanDerWaalsContact C-N 3.32Å; L250-I252 PolarHBondContact O-N 2.91Å; L250-F253 PolarHBondContact O-N 3.34Å; L250-K254 VanDerWaalsContact O-CG 3.28Å; L250-K254 WeakPolarHBondContact O-CG 3.32Å; L250-K254 PolarHBondContact O-N 3.32Å; L250-V276 HydrophobicContact CD1-CG1 3.96Å; L250-L278 HydrophobicContact CD2-CD2 3.97Å; L250-L278 HydrophobicContact CG-CD2 3.78Å; L250-F281 HydrophobicContact CD2-CB 3.58Å; L250-F281 HydrophobicContact CD2-CD2 3.98Å; L250-F281 HydrophobicContact CD2-CG 3.9Å
251	A	90	Very high	88.8	Confident	3 Å²	3	60.8 Å²	60.8	3%	0.025	34%	0.335	C	S	.	.	H	α-helix	trans	-59.7	-43.2	175.8	0	0	0	0	0	111.7	Q198 I201 E247 V248 L249 L255	Q198-A251 HydrophobicContact CG-CB 4.43Å; I201-A251 HydrophobicContact CB-CB 4.23Å; I201-A251 HydrophobicContact CD1-CB 4.43Å; I201-A251 HydrophobicContact CG2-CB 3.67Å; E247-A251 PolarHBondContact O-N 2.93Å; V248-A251 PolarHBondContact O-N 3.37Å; L249-A251 VanDerWaalsContact C-N 3.35Å; L249-A251 PolarHBondContact O-N 2.86Å; A251-L255 WeakPolarHBondContact O-CG 3.46Å; A251-L255 PolarHBondContact O-N 3.38Å
252	I	92.4	Very high	89.4	Confident	49 Å²	49	60.9 Å²	60.9	25%	0.251	31%	0.314	S	S	.	.	H	α-helix	trans	-64.9	-46	176.7	-66.8	167.7	0	0	0	111.3	L205 V248 L249 L250 K254 L255 K256	L205-I252 HydrophobicContact CD1-CG1 3.68Å; L205-I252 HydrophobicContact CD2-CG1 4.47Å; V248-I252 HydrophobicContact CG1-CD1 3.96Å; V248-I252 WeakPolarHBondContact O-CG1 3.39Å; V248-I252 PolarHBondContact O-N 3.24Å; L249-I252 PolarHBondContact O-N 3.45Å; L250-I252 VanDerWaalsContact C-N 3.32Å; L250-I252 PolarHBondContact O-N 2.91Å; I252-K254 VanDerWaalsContact C-N 3.34Å; I252-K254 PolarHBondContact O-N 3.05Å; I252-L255 WeakPolarHBondContact O-CB 3.28Å; I252-L255 PolarHBondContact O-N 3.31Å; I252-K256 PolarHBondContact O-N 3.5Å
253	F	93	Very high	89.6	Confident	51 Å²	51	62.7 Å²	62.7	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-64.3	-39.5	-177.1	-64.6	-12.9	0	0	0	111.7	L249 L250 L255 K256 M257 L278 F281 F282	L249-F253 HydrophobicContact CB-CE1 4.41Å; L249-F253 HydrophobicContact CB-CE2 4.17Å; L249-F253 HydrophobicContact CB-CZ 4.04Å; L249-F253 HydrophobicContact CD2-CE1 4.11Å; L249-F253 HydrophobicContact CD2-CZ 4.13Å; L249-F253 HydrophobicContact CG-CZ 4.49Å; L249-F253 WeakPolarHBondContact O-CB 3.49Å; L249-F253 WeakPolarHBondContact O-CD1 3.35Å; L249-F253 WeakPolarHBondContact O-CG 3.18Å; L249-F253 PolarHBondContact O-N 2.93Å; L250-F253 PolarHBondContact O-N 3.34Å; F253-L255 VanDerWaalsContact C-N 3.26Å; F253-L255 PolarHBondContact O-N 2.83Å; F253-K256 PolarHBondContact O-N 3Å; F253-K256 VanDerWaalsContact O-N 3.08Å; F253-M257 PolarHBondContact O-N 2.85Å; F253-L278 HydrophobicContact CD2-CD2 4.23Å; F253-L278 HydrophobicContact CE2-CD2 3.84Å; F253-F281 HydrophobicContact CB-CD1 4.24Å; F253-F281 HydrophobicContact CB-CE1 3.55Å; F253-F281 HydrophobicContact CB-CE2 4.06Å; F253-F281 HydrophobicContact CB-CZ 3.46Å; F253-F281 VanDerWaalsContact CB-CZ 3.46Å; F253-F281 AromaticContact CD2-CD1 3.83Å; F253-F281 HydrophobicContact CD2-CD1 3.83Å; F253-F281 AromaticContact CD2-CE1 3.85Å; F253-F281 HydrophobicContact CD2-CE1 3.85Å; F253-F281 HydrophobicContact CG-CD1 4.48Å; F253-F281 HydrophobicContact CG-CE1 4.07Å; F253-F281 HydrophobicContact CG-CZ 4.45Å; F253-F282 HydrophobicContact CD2-CZ 4.49Å; F253-F282 HydrophobicContact CE2-CE1 4.09Å; F253-F282 HydrophobicContact CE2-CE2 4.37Å; F253-F282 AromaticContact CE2-CZ 3.61Å; F253-F282 HydrophobicContact CE2-CZ 3.61Å; F253-F282 HydrophobicContact CZ-CZ 4.14Å
254	K	90.4	Very high	89.8	Confident	16 Å²	16	65.2 Å²	65.2	7%	0.07	33%	0.331	C	S	.	.	H	α-helix	trans	-53.5	-43.4	170.4	-72.5	175.9	-176.5	-141.7	0	111.8	L250 I252 K256 M257 R262 W265 E266	L250-K254 VanDerWaalsContact O-CG 3.28Å; L250-K254 WeakPolarHBondContact O-CG 3.32Å; L250-K254 PolarHBondContact O-N 3.32Å; I252-K254 VanDerWaalsContact C-N 3.34Å; I252-K254 PolarHBondContact O-N 3.05Å; K254-K256 VanDerWaalsContact C-N 3.31Å; K254-K256 PolarHBondContact O-N 3.07Å; K254-M257 PolarHBondContact O-N 3.33Å; K254-R262 PolarHBondContact O-NE 3.46Å; K254-R262 PolarHBondContact O-NH2 2.83Å; K254-W265 VanDerWaalsContact CE-NE1 3.27Å; K254-E266 WeakPolarHBondContact CD-OE1 3.34Å; K254-E266 WeakPolarHBondContact CE-OE1 3.38Å; K254-E266 IonicContact NZ-OE1 3.51Å; K254-E266 PolarHBondContact NZ-OE1 3.35Å; K254-E266 IonicContact NZ-OE2 2.73Å; K254-E266 PolarHBondContact NZ-OE2 3.08Å; K254-E266 VanDerWaalsContact NZ-OE2 3.15Å
255	L	89.4	Confident	90.1	Very high	66 Å²	66	61.9 Å²	61.9	35%	0.346	31%	0.31	S	S	.	.	H	α-helix	trans	-68.2	-26.8	179.7	-67.3	176.3	0	0	0	113.3	V202 L205 A251 I252 F253 R262	V202-L255 HydrophobicContact CG1-CD1 4.45Å; V202-L255 HydrophobicContact CG2-CD1 4.24Å; L205-L255 HydrophobicContact CD1-CD1 4.05Å; A251-L255 WeakPolarHBondContact O-CG 3.46Å; A251-L255 PolarHBondContact O-N 3.38Å; I252-L255 WeakPolarHBondContact O-CB 3.28Å; I252-L255 PolarHBondContact O-N 3.31Å; F253-L255 VanDerWaalsContact C-N 3.26Å; F253-L255 PolarHBondContact O-N 2.83Å; L255-R262 PolarHBondContact O-NH2 3.21Å
256	K	91.8	Very high	90.2	Very high	171 Å²	171	60.4 Å²	60.4	74%	0.743	29%	0.291	S	S	*	.	H	α-helix	trans	-80.1	-16	177.8	-60.8	-55.2	179.9	-173.5	0	114.3	I252 F253 K254	I252-K256 PolarHBondContact O-N 3.5Å; F253-K256 PolarHBondContact O-N 3Å; F253-K256 VanDerWaalsContact O-N 3.08Å; K254-K256 VanDerWaalsContact C-N 3.31Å; K254-K256 PolarHBondContact O-N 3.07Å
257	M	89.9	Confident	90.2	Very high	15 Å²	15	63.7 Å²	63.7	7%	0.074	30%	0.304	C	S	.	.	S	Bend	trans	-79.9	146.4	177.1	-70	-167.9	-68.7	0	0	112.9	F253 K254 L261 R262 W265 F281 F284 L285	F253-M257 PolarHBondContact O-N 2.85Å; K254-M257 PolarHBondContact O-N 3.33Å; M257-L261 HydrophobicContact CB-CB 4.37Å; M257-L261 HydrophobicContact SD-CB 4.28Å; M257-R262 PolarHBondContact O-NH2 2.82Å; M257-R262 VanDerWaalsContact O-NH2 3.12Å; M257-W265 HydrophobicContact CE-CB 3.85Å; M257-W265 HydrophobicContact CE-CG 4Å; M257-F281 HydrophobicContact CE-CE2 3.45Å; M257-F281 VanDerWaalsContact CE-CE2 3.45Å; M257-F281 HydrophobicContact CE-CZ 3.67Å; M257-F281 HydrophobicContact CG-CZ 4.31Å; M257-F281 HydrophobicContact SD-CE2 4.12Å; M257-F281 HydrophobicContact SD-CZ 3.8Å; M257-F284 HydrophobicContact SD-CE1 4.17Å; M257-L285 HydrophobicContact SD-CD1 4.38Å
258	P	88.7	Confident	90.2	Very high	68 Å²	68	63.5 Å²	63.5	44%	0.442	30%	0.304	S	S	.	.			trans	-54.7	146.8	164.9	-22.7	32.5	0	0	0	111.7	F260 L261 R262	P258-F260 VanDerWaalsContact C-N 3.26Å; P258-F260 HydrophobicContact CB-CD1 3.7Å; P258-F260 HydrophobicContact CB-CE1 3.52Å; P258-F260 HydrophobicContact CB-CZ 4.48Å; P258-F260 HydrophobicContact CG-CE1 4.09Å; P258-F260 PolarHBondContact O-N 3.38Å; P258-F260 VanDerWaalsContact O-N 3.12Å; P258-L261 PolarHBondContact O-N 2.78Å; P258-R262 PolarHBondContact O-N 2.87Å
259	H	86.8	Confident	90.1	Very high	142 Å²	142	63 Å²	63	66%	0.657	30%	0.301	S	S	*	.	H	α-helix	trans	-52.2	-40.5	-176.1	177.8	-92.4	0	0	0	113.7	L261 R262 K263	H259-L261 PolarHBondContact O-N 3.43Å; H259-R262 PolarHBondContact O-N 3.5Å; H259-K263 WeakPolarHBondContact O-CB 3.33Å; H259-K263 PolarHBondContact O-N 3.18Å
260	F	89.1	Confident	89.5	Confident	111 Å²	111	66 Å²	66	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-67.1	-35.6	-179.8	77.2	-87.8	0	0	0	113	P258 K264	P258-F260 VanDerWaalsContact C-N 3.26Å; P258-F260 HydrophobicContact CB-CD1 3.7Å; P258-F260 HydrophobicContact CB-CE1 3.52Å; P258-F260 HydrophobicContact CB-CZ 4.48Å; P258-F260 HydrophobicContact CG-CE1 4.09Å; P258-F260 PolarHBondContact O-N 3.38Å; P258-F260 VanDerWaalsContact O-N 3.12Å; F260-K264 PolarHBondContact O-N 3.19Å; F260-K264 VanDerWaalsContact O-N 3.13Å
261	L	91.4	Very high	89.1	Confident	22 Å²	22	69.9 Å²	69.9	12%	0.115	34%	0.336	C	S	.	.	H	α-helix	trans	-74.5	-38.5	174.4	-70.7	-173.7	0	0	0	111.3	M257 P258 H259 K263 K264 W265 Q288	M257-L261 HydrophobicContact CB-CB 4.37Å; M257-L261 HydrophobicContact SD-CB 4.28Å; P258-L261 PolarHBondContact O-N 2.78Å; H259-L261 PolarHBondContact O-N 3.43Å; L261-K263 VanDerWaalsContact C-N 3.28Å; L261-K263 PolarHBondContact O-N 3.14Å; L261-K264 HydrophobicContact CD2-CD 4.16Å; L261-K264 WeakPolarHBondContact O-CB 3.17Å; L261-K264 PolarHBondContact O-N 3.44Å; L261-K264 VanDerWaalsContact O-N 3.14Å; L261-W265 WeakPolarHBondContact O-CB 3.41Å; L261-W265 PolarHBondContact O-N 3.01Å; L261-Q288 HydrophobicContact CD2-CB 4.27Å; L261-Q288 HydrophobicContact CD2-CG 4Å
262	R	91.3	Very high	88.7	Confident	70 Å²	70	72.7 Å²	72.7	26%	0.264	35%	0.346	S	S	.	.	H	α-helix	trans	-57.6	-43.5	171.3	-166.7	-174.7	-56	153.6	5.6	110.9	K254 L255 M257 P258 H259 K264 W265 E266	K254-R262 PolarHBondContact O-NE 3.46Å; K254-R262 PolarHBondContact O-NH2 2.83Å; L255-R262 PolarHBondContact O-NH2 3.21Å; M257-R262 PolarHBondContact O-NH2 2.82Å; M257-R262 VanDerWaalsContact O-NH2 3.12Å; P258-R262 PolarHBondContact O-N 2.87Å; H259-R262 PolarHBondContact O-N 3.5Å; R262-K264 PolarHBondContact O-N 2.97Å; R262-W265 WeakPolarHBondContact O-CB 3.45Å; R262-W265 PolarHBondContact O-N 3.16Å; R262-E266 WeakPolarHBondContact O-CG 3.37Å; R262-E266 PolarHBondContact O-N 3.4Å
263	K	89.4	Confident	87.9	Confident	152 Å²	152	80.4 Å²	80.4	66%	0.661	38%	0.378	S	S	*	.	H	α-helix	trans	-60.4	-42.8	174.7	-174.2	176.7	-179.9	178.1	0	112.3	H259 L261 W265 N267	H259-K263 WeakPolarHBondContact O-CB 3.33Å; H259-K263 PolarHBondContact O-N 3.18Å; L261-K263 VanDerWaalsContact C-N 3.28Å; L261-K263 PolarHBondContact O-N 3.14Å; K263-W265 VanDerWaalsContact C-N 3.35Å; K263-N267 WeakPolarHBondContact O-CB 3.44Å; K263-N267 PolarHBondContact O-N 3.4Å
264	K	90.6	Very high	87.3	Confident	87 Å²	87	84.9 Å²	84.9	38%	0.378	40%	0.399	S	S	.	.	H	α-helix	trans	-63	-41.6	174.4	-73.6	-172.6	-173	-177.8	0	111.8	F260 L261 R262 N267 D268 F284 Q288	F260-K264 PolarHBondContact O-N 3.19Å; F260-K264 VanDerWaalsContact O-N 3.13Å; L261-K264 HydrophobicContact CD2-CD 4.16Å; L261-K264 WeakPolarHBondContact O-CB 3.17Å; L261-K264 PolarHBondContact O-N 3.44Å; L261-K264 VanDerWaalsContact O-N 3.14Å; R262-K264 PolarHBondContact O-N 2.97Å; K264-N267 WeakPolarHBondContact O-CB 3.29Å; K264-N267 PolarHBondContact O-N 3Å; K264-D268 PolarHBondContact O-N 2.84Å; K264-F284 HydrophobicContact CB-CE2 4.12Å; K264-F284 HydrophobicContact CB-CZ 3.8Å; K264-Q288 VanDerWaalsContact CD-OE1 3.25Å
265	W	92.2	Very high	86.8	Confident	0 Å²	0	92.4 Å²	92.4	0%	0	44%	0.435	C	S	.	.	H	α-helix	trans	-63.6	-49.4	177	169.9	-102.6	0	0	0	111.8	K254 M257 L261 R262 K263 N267 D268 V269 V276 F281 F284	K254-W265 VanDerWaalsContact CE-NE1 3.27Å; M257-W265 HydrophobicContact CE-CB 3.85Å; M257-W265 HydrophobicContact CE-CG 4Å; L261-W265 WeakPolarHBondContact O-CB 3.41Å; L261-W265 PolarHBondContact O-N 3.01Å; R262-W265 WeakPolarHBondContact O-CB 3.45Å; R262-W265 PolarHBondContact O-N 3.16Å; K263-W265 VanDerWaalsContact C-N 3.35Å; W265-N267 PolarHBondContact O-N 3.19Å; W265-D268 WeakPolarHBondContact O-CB 3.34Å; W265-D268 PolarHBondContact O-N 3.31Å; W265-V269 HydrophobicContact CD2-CG2 4.02Å; W265-V269 VanDerWaalsContact CE2-CG2 3.44Å; W265-V269 HydrophobicContact CH2-CG2 4.17Å; W265-V269 HydrophobicContact CZ2-CG2 3.55Å; W265-V269 WeakPolarHBondContact O-CG2 3.2Å; W265-V269 PolarHBondContact O-N 3.42Å; W265-V276 HydrophobicContact CH2-CG1 3.99Å; W265-V276 HydrophobicContact CZ2-CG1 3.62Å; W265-F281 AromaticContact CD2-CD2 3.92Å; W265-F281 HydrophobicContact CD2-CD2 3.92Å; W265-F281 HydrophobicContact CD2-CE2 4.22Å; W265-F281 AromaticContact CE2-CD2 3.66Å; W265-F281 HydrophobicContact CE3-CD2 4.17Å; W265-F281 HydrophobicContact CG-CE2 4.47Å; W265-F281 HydrophobicContact CH2-CB 3.79Å; W265-F281 AromaticContact CH2-CD2 3.9Å; W265-F281 HydrophobicContact CH2-CD2 3.9Å; W265-F281 HydrophobicContact CH2-CG 4.33Å; W265-F281 HydrophobicContact CZ2-CB 4.18Å; W265-F281 AromaticContact CZ2-CD2 3.65Å; W265-F281 HydrophobicContact CZ2-CD2 3.65Å; W265-F281 HydrophobicContact CZ2-CG 4.42Å; W265-F281 HydrophobicContact CZ3-CB 4.28Å; W265-F281 HydrophobicContact CZ3-CD2 4.17Å; W265-F284 HydrophobicContact CB-CD1 4.28Å; W265-F284 HydrophobicContact CB-CE1 3.7Å; W265-F284 HydrophobicContact CB-CE2 4.34Å; W265-F284 HydrophobicContact CB-CZ 3.74Å; W265-F284 HydrophobicContact CD2-CD1 4.33Å; W265-F284 HydrophobicContact CE3-CB 3.64Å; W265-F284 AromaticContact CE3-CD1 3.55Å; W265-F284 HydrophobicContact CE3-CD1 3.55Å; W265-F284 AromaticContact CE3-CD2 3.86Å; W265-F284 HydrophobicContact CE3-CD2 3.86Å; W265-F284 HydrophobicContact CE3-CE1 4.16Å; W265-F284 HydrophobicContact CE3-CE2 4.41Å; W265-F284 AromaticContact CE3-CG 3.4Å; W265-F284 HydrophobicContact CE3-CG 3.4Å; W265-F284 HydrophobicContact CG-CE1 4.5Å; W265-F284 HydrophobicContact CZ3-CB 3.55Å; W265-F284 HydrophobicContact CZ3-CD1 4.3Å; W265-F284 HydrophobicContact CZ3-CD2 4.46Å; W265-F284 AromaticContact CZ3-CG 3.88Å; W265-F284 HydrophobicContact CZ3-CG 3.88Å
266	E	90	Very high	86.7	Confident	44 Å²	44	91.5 Å²	91.5	21%	0.206	43%	0.432	C	S	.	.	H	α-helix	trans	-60.1	-38.8	176.9	-63.4	-52.8	151	0	0	110.4	K254 R262 D268 V269 F270	K254-E266 WeakPolarHBondContact CD-OE1 3.34Å; K254-E266 WeakPolarHBondContact CE-OE1 3.38Å; K254-E266 IonicContact NZ-OE1 3.51Å; K254-E266 PolarHBondContact NZ-OE1 3.35Å; K254-E266 IonicContact NZ-OE2 2.73Å; K254-E266 PolarHBondContact NZ-OE2 3.08Å; K254-E266 VanDerWaalsContact NZ-OE2 3.15Å; R262-E266 WeakPolarHBondContact O-CG 3.37Å; R262-E266 PolarHBondContact O-N 3.4Å; E266-D268 PolarHBondContact O-N 3.02Å; E266-V269 PolarHBondContact O-N 3.24Å; E266-F270 WeakPolarHBondContact O-CB 3.48Å; E266-F270 WeakPolarHBondContact O-CD2 3.36Å; E266-F270 PolarHBondContact O-N 2.93Å
267	N	87.9	Confident	86.6	Confident	101 Å²	101	86.2 Å²	86.2	54%	0.54	41%	0.414	S	S	.	.	H	α-helix	trans	-61.2	-43.1	173.7	-171.9	80.6	0	0	0	112.5	K263 K264 W265 F270 T271	K263-N267 WeakPolarHBondContact O-CB 3.44Å; K263-N267 PolarHBondContact O-N 3.4Å; K264-N267 WeakPolarHBondContact O-CB 3.29Å; K264-N267 PolarHBondContact O-N 3Å; W265-N267 PolarHBondContact O-N 3.19Å; N267-F270 PolarHBondContact O-N 3.06Å; N267-T271 WeakPolarHBondContact O-CG2 3.49Å; N267-T271 PolarHBondContact O-N 3.39Å; N267-T271 VanDerWaalsContact O-N 3.11Å; N267-T271 PolarHBondContact O-OG1 3.2Å
268	D	87.1	Confident	86.6	Confident	44 Å²	44	87.5 Å²	87.5	24%	0.235	42%	0.421	C	S	.	.	H	α-helix	trans	-58.2	-51.3	174.1	-173.4	77.4	0	0	0	110.8	K264 W265 E266 F270 T271 R272 F284	K264-D268 PolarHBondContact O-N 2.84Å; W265-D268 WeakPolarHBondContact O-CB 3.34Å; W265-D268 PolarHBondContact O-N 3.31Å; E266-D268 PolarHBondContact O-N 3.02Å; D268-F270 VanDerWaalsContact C-N 3.31Å; D268-F270 PolarHBondContact O-N 3.23Å; D268-T271 CarbonylContact O-C 3.59Å; D268-T271 PolarHBondContact O-N 3.13Å; D268-T271 PolarHBondContact O-OG1 3.12Å; D268-R272 VanDerWaalsContact O-CB 3.27Å; D268-R272 WeakPolarHBondContact O-CB 3.42Å; D268-R272 PolarHBondContact O-N 3.28Å; D268-R272 IonicContact OD1-NH2 2.78Å; D268-R272 IonicContact OD2-CZ 3.17Å; D268-R272 IonicContact OD2-NE 2.7Å; D268-R272 PolarHBondContact OD2-NE 3.3Å; D268-R272 VanDerWaalsContact OD2-NE 3.1Å; D268-R272 IonicContact OD2-NH2 2.76Å; D268-R272 PolarHBondContact OD2-NH2 2.85Å; D268-F284 HydrophobicContact CB-CD2 4.29Å; D268-F284 HydrophobicContact CB-CE2 4.41Å
269	V	86.7	Confident	86.8	Confident	29 Å²	29	90.1 Å²	90.1	18%	0.176	43%	0.431	C	S	.	.	H	α-helix	trans	-55.3	-43.9	176.4	171.6	0	0	0	0	111.9	W265 E266 T271 R272 V276	W265-V269 HydrophobicContact CD2-CG2 4.02Å; W265-V269 VanDerWaalsContact CE2-CG2 3.44Å; W265-V269 HydrophobicContact CH2-CG2 4.17Å; W265-V269 HydrophobicContact CZ2-CG2 3.55Å; W265-V269 WeakPolarHBondContact O-CG2 3.2Å; W265-V269 PolarHBondContact O-N 3.42Å; E266-V269 PolarHBondContact O-N 3.24Å; V269-T271 VanDerWaalsContact C-N 3.29Å; V269-T271 PolarHBondContact O-N 2.79Å; V269-R272 PolarHBondContact O-N 2.93Å; V269-V276 HydrophobicContact CB-CG2 4.49Å; V269-V276 HydrophobicContact CG1-CG2 3.96Å; V269-V276 HydrophobicContact CG2-CG2 4.04Å
270	F	81.1	Confident	87	Confident	130 Å²	130	83.7 Å²	83.7	57%	0.57	40%	0.402	S	S	*	.	H	α-helix	trans	-66.2	-29	178.2	-87.3	-68.4	0	0	0	113.8	E266 N267 D268	E266-F270 WeakPolarHBondContact O-CB 3.48Å; E266-F270 WeakPolarHBondContact O-CD2 3.36Å; E266-F270 PolarHBondContact O-N 2.93Å; N267-F270 PolarHBondContact O-N 3.06Å; D268-F270 VanDerWaalsContact C-N 3.31Å; D268-F270 PolarHBondContact O-N 3.23Å
271	T	81.4	Confident	87.3	Confident	97 Å²	97	78.6 Å²	78.6	60%	0.595	38%	0.38	S	S	*	.	H	α-helix	trans	-96.3	-14.3	-178.9	56.5	0	0	0	0	113.8	N267 D268 V269	N267-T271 WeakPolarHBondContact O-CG2 3.49Å; N267-T271 PolarHBondContact O-N 3.39Å; N267-T271 VanDerWaalsContact O-N 3.11Å; N267-T271 PolarHBondContact O-OG1 3.2Å; D268-T271 CarbonylContact O-C 3.59Å; D268-T271 PolarHBondContact O-N 3.13Å; D268-T271 PolarHBondContact O-OG1 3.12Å; V269-T271 VanDerWaalsContact C-N 3.29Å; V269-T271 PolarHBondContact O-N 2.79Å
272	R	82.7	Confident	87.5	Confident	62 Å²	62	82.4 Å²	82.4	23%	0.234	40%	0.396	C	S	.	.			trans	-73.8	141.8	-178.7	-173.5	177.5	-70.8	-97.6	2.6	110.5	D268 V269 E274	D268-R272 VanDerWaalsContact O-CB 3.27Å; D268-R272 WeakPolarHBondContact O-CB 3.42Å; D268-R272 PolarHBondContact O-N 3.28Å; D268-R272 IonicContact OD1-NH2 2.78Å; D268-R272 IonicContact OD2-CZ 3.17Å; D268-R272 IonicContact OD2-NE 2.7Å; D268-R272 PolarHBondContact OD2-NE 3.3Å; D268-R272 VanDerWaalsContact OD2-NE 3.1Å; D268-R272 IonicContact OD2-NH2 2.76Å; D268-R272 PolarHBondContact OD2-NH2 2.85Å; V269-R272 PolarHBondContact O-N 2.93Å; R272-E274 HydrophobicContact CG-CB 4.26Å
273	K	75.9	Confident	87.6	Confident	211 Å²	211	84.6 Å²	84.6	92%	0.917	41%	0.409	S	S	*	.			trans	-95.6	-25.3	175.9	-65.7	-176.3	178.9	-179.8	0	113.2
274	E	79	Confident	87.9	Confident	145 Å²	145	78 Å²	78	68%	0.678	38%	0.38	S	S	*	.	S	Bend	trans	-84.9	157.1	-179	-64.9	171.7	-178.8	0	0	111.5	R272	R272-E274 HydrophobicContact CG-CB 4.26Å
275	E	81.2	Confident	88.1	Confident	173 Å²	173	76.8 Å²	76.8	81%	0.808	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-64	139.1	175.7	-170.3	173.6	-168.2	0	0	111.1	T277	E275-T277 PolarHBondContact O-N 3.49Å
276	V	86.1	Confident	88.2	Confident	48 Å²	48	85 Å²	85	29%	0.291	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-76.9	117.1	-178.4	179.4	0	0	0	0	109.9	L250 W265 V269	L250-V276 HydrophobicContact CD1-CG1 3.96Å; W265-V276 HydrophobicContact CH2-CG1 3.99Å; W265-V276 HydrophobicContact CZ2-CG1 3.62Å; V269-V276 HydrophobicContact CB-CG2 4.49Å; V269-V276 HydrophobicContact CG1-CG2 3.96Å; V269-V276 HydrophobicContact CG2-CG2 4.04Å
277	T	89.6	Confident	88.4	Confident	60 Å²	60	85.7 Å²	85.7	37%	0.368	42%	0.416	S	S	.	.			trans	-115.1	167.7	177.1	65.5	0	0	0	0	111.7	E275 D279 S280 F281	E275-T277 PolarHBondContact O-N 3.49Å; T277-D279 PolarHBondContact O-N 3.22Å; T277-S280 PolarHBondContact N-OG 3.43Å; T277-S280 VanDerWaalsContact N-OG 3.09Å; T277-S280 PolarHBondContact O-N 3.25Å; T277-S280 PolarHBondContact O-OG 3.29Å; T277-S280 PolarHBondContact OG1-N 2.84Å; T277-F281 PolarHBondContact O-N 2.96Å
278	L	91.1	Very high	88.6	Confident	41 Å²	41	82 Å²	82	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-59.6	-37.6	171.4	-70.1	174.7	0	0	0	112	A246 L249 L250 F253 S280 F281 F282	A246-L278 HydrophobicContact CB-CD1 3.8Å; A246-L278 HydrophobicContact CB-CD2 4.48Å; A246-L278 HydrophobicContact CB-CG 3.78Å; L249-L278 HydrophobicContact CB-CD2 3.88Å; L249-L278 HydrophobicContact CD1-CD1 4.18Å; L250-L278 HydrophobicContact CD2-CD2 3.97Å; L250-L278 HydrophobicContact CG-CD2 3.78Å; F253-L278 HydrophobicContact CD2-CD2 4.23Å; F253-L278 HydrophobicContact CE2-CD2 3.84Å; L278-S280 PolarHBondContact O-N 2.75Å; L278-F281 WeakPolarHBondContact O-CB 3.45Å; L278-F281 PolarHBondContact O-N 3.07Å; L278-F281 VanDerWaalsContact O-N 3.16Å; L278-F282 HydrophobicContact CB-CD2 4.48Å; L278-F282 HydrophobicContact CB-CE2 4.22Å; L278-F282 WeakPolarHBondContact O-CD2 3.26Å; L278-F282 PolarHBondContact O-N 3.41Å
279	D	92.9	Very high	88.9	Confident	123 Å²	123	83.3 Å²	83.3	66%	0.658	41%	0.405	S	S	*	.	H	α-helix	trans	-63.9	-42.5	178.9	-62.8	-49.5	0	0	0	111.3	T277 F281 F282 E283	T277-D279 PolarHBondContact O-N 3.22Å; D279-F281 PolarHBondContact O-N 3.33Å; D279-F282 PolarHBondContact O-N 3.03Å; D279-E283 WeakPolarHBondContact O-CB 3.47Å; D279-E283 PolarHBondContact O-N 3.45Å
280	S	91.4	Very high	89.2	Confident	7 Å²	7	86.7 Å²	86.7	5%	0.049	42%	0.419	C	S	.	.	H	α-helix	trans	-61	-34.6	174.9	74.8	0	0	0	0	112.5	T277 L278 F284	T277-S280 PolarHBondContact N-OG 3.43Å; T277-S280 VanDerWaalsContact N-OG 3.09Å; T277-S280 PolarHBondContact O-N 3.25Å; T277-S280 PolarHBondContact O-OG 3.29Å; T277-S280 PolarHBondContact OG1-N 2.84Å; L278-S280 PolarHBondContact O-N 2.75Å; S280-F284 WeakPolarHBondContact O-CB 3.31Å; S280-F284 PolarHBondContact O-N 3.44Å
281	F	94	Very high	89.6	Confident	5 Å²	5	83.4 Å²	83.4	2%	0.022	41%	0.409	C	S	.	.	H	α-helix	trans	-69.1	-44	175.7	-178	-85.9	0	0	0	112	L250 F253 M257 W265 T277 L278 D279 F284 L285	L250-F281 HydrophobicContact CD2-CB 3.58Å; L250-F281 HydrophobicContact CD2-CD2 3.98Å; L250-F281 HydrophobicContact CD2-CG 3.9Å; F253-F281 HydrophobicContact CB-CD1 4.24Å; F253-F281 HydrophobicContact CB-CE1 3.55Å; F253-F281 HydrophobicContact CB-CE2 4.06Å; F253-F281 HydrophobicContact CB-CZ 3.46Å; F253-F281 VanDerWaalsContact CB-CZ 3.46Å; F253-F281 AromaticContact CD2-CD1 3.83Å; F253-F281 HydrophobicContact CD2-CD1 3.83Å; F253-F281 AromaticContact CD2-CE1 3.85Å; F253-F281 HydrophobicContact CD2-CE1 3.85Å; F253-F281 HydrophobicContact CG-CD1 4.48Å; F253-F281 HydrophobicContact CG-CE1 4.07Å; F253-F281 HydrophobicContact CG-CZ 4.45Å; M257-F281 HydrophobicContact CE-CE2 3.45Å; M257-F281 VanDerWaalsContact CE-CE2 3.45Å; M257-F281 HydrophobicContact CE-CZ 3.67Å; M257-F281 HydrophobicContact CG-CZ 4.31Å; M257-F281 HydrophobicContact SD-CE2 4.12Å; M257-F281 HydrophobicContact SD-CZ 3.8Å; W265-F281 AromaticContact CD2-CD2 3.92Å; W265-F281 HydrophobicContact CD2-CD2 3.92Å; W265-F281 HydrophobicContact CD2-CE2 4.22Å; W265-F281 AromaticContact CE2-CD2 3.66Å; W265-F281 HydrophobicContact CE3-CD2 4.17Å; W265-F281 HydrophobicContact CG-CE2 4.47Å; W265-F281 HydrophobicContact CH2-CB 3.79Å; W265-F281 AromaticContact CH2-CD2 3.9Å; W265-F281 HydrophobicContact CH2-CD2 3.9Å; W265-F281 HydrophobicContact CH2-CG 4.33Å; W265-F281 HydrophobicContact CZ2-CB 4.18Å; W265-F281 AromaticContact CZ2-CD2 3.65Å; W265-F281 HydrophobicContact CZ2-CD2 3.65Å; W265-F281 HydrophobicContact CZ2-CG 4.42Å; W265-F281 HydrophobicContact CZ3-CB 4.28Å; W265-F281 HydrophobicContact CZ3-CD2 4.17Å; T277-F281 PolarHBondContact O-N 2.96Å; L278-F281 WeakPolarHBondContact O-CB 3.45Å; L278-F281 PolarHBondContact O-N 3.07Å; L278-F281 VanDerWaalsContact O-N 3.16Å; D279-F281 PolarHBondContact O-N 3.33Å; F281-F284 PolarHBondContact O-N 2.87Å; F281-L285 PolarHBondContact O-N 3.4Å
282	F	95.8	Very high	89.8	Confident	101 Å²	101	82.8 Å²	82.8	44%	0.443	40%	0.4	S	S	.	.	H	α-helix	trans	-67.9	-37	177.4	-70.7	-55.1	0	0	0	112.4	F253 L278 D279 L285 R286	F253-F282 HydrophobicContact CD2-CZ 4.49Å; F253-F282 HydrophobicContact CE2-CE1 4.09Å; F253-F282 HydrophobicContact CE2-CE2 4.37Å; F253-F282 AromaticContact CE2-CZ 3.61Å; F253-F282 HydrophobicContact CE2-CZ 3.61Å; F253-F282 HydrophobicContact CZ-CZ 4.14Å; L278-F282 HydrophobicContact CB-CD2 4.48Å; L278-F282 HydrophobicContact CB-CE2 4.22Å; L278-F282 WeakPolarHBondContact O-CD2 3.26Å; L278-F282 PolarHBondContact O-N 3.41Å; D279-F282 PolarHBondContact O-N 3.03Å; F282-L285 PolarHBondContact O-N 3.28Å; F282-R286 WeakPolarHBondContact O-CB 3.29Å; F282-R286 PolarHBondContact O-N 2.88Å
283	E	93.8	Very high	90.1	Very high	116 Å²	116	85.8 Å²	85.8	54%	0.542	42%	0.416	S	S	.	.	H	α-helix	trans	-59.7	-51	171.7	-171.6	-170.4	-176.2	0	0	110.4	D279 L285 R286 T287	D279-E283 WeakPolarHBondContact O-CB 3.47Å; D279-E283 PolarHBondContact O-N 3.45Å; E283-L285 VanDerWaalsContact C-N 3.31Å; E283-L285 PolarHBondContact O-N 2.67Å; E283-R286 WeakPolarHBondContact O-CB 3.4Å; E283-R286 PolarHBondContact O-N 3.05Å; E283-R286 VanDerWaalsContact O-N 3.14Å; E283-T287 PolarHBondContact O-N 3.24Å; E283-T287 PolarHBondContact O-OG1 3.03Å; E283-T287 VanDerWaalsContact O-OG1 3.06Å
284	F	95	Very high	90.4	Very high	14 Å²	14	79.5 Å²	79.5	6%	0.061	40%	0.399	C	S	.	.	H	α-helix	trans	-54.6	-47.8	175.5	168.6	-92.8	0	0	0	111.9	M257 K264 W265 D268 S280 F281 R286 T287 Q288	M257-F284 HydrophobicContact SD-CE1 4.17Å; K264-F284 HydrophobicContact CB-CE2 4.12Å; K264-F284 HydrophobicContact CB-CZ 3.8Å; W265-F284 HydrophobicContact CB-CD1 4.28Å; W265-F284 HydrophobicContact CB-CE1 3.7Å; W265-F284 HydrophobicContact CB-CE2 4.34Å; W265-F284 HydrophobicContact CB-CZ 3.74Å; W265-F284 HydrophobicContact CD2-CD1 4.33Å; W265-F284 HydrophobicContact CE3-CB 3.64Å; W265-F284 AromaticContact CE3-CD1 3.55Å; W265-F284 HydrophobicContact CE3-CD1 3.55Å; W265-F284 AromaticContact CE3-CD2 3.86Å; W265-F284 HydrophobicContact CE3-CD2 3.86Å; W265-F284 HydrophobicContact CE3-CE1 4.16Å; W265-F284 HydrophobicContact CE3-CE2 4.41Å; W265-F284 AromaticContact CE3-CG 3.4Å; W265-F284 HydrophobicContact CE3-CG 3.4Å; W265-F284 HydrophobicContact CG-CE1 4.5Å; W265-F284 HydrophobicContact CZ3-CB 3.55Å; W265-F284 HydrophobicContact CZ3-CD1 4.3Å; W265-F284 HydrophobicContact CZ3-CD2 4.46Å; W265-F284 AromaticContact CZ3-CG 3.88Å; W265-F284 HydrophobicContact CZ3-CG 3.88Å; D268-F284 HydrophobicContact CB-CD2 4.29Å; D268-F284 HydrophobicContact CB-CE2 4.41Å; S280-F284 WeakPolarHBondContact O-CB 3.31Å; S280-F284 PolarHBondContact O-N 3.44Å; F281-F284 PolarHBondContact O-N 2.87Å; F284-R286 VanDerWaalsContact C-N 3.33Å; F284-R286 PolarHBondContact O-N 3.26Å; F284-T287 PolarHBondContact O-N 3.03Å; F284-Q288 HydrophobicContact CD1-CG 4.29Å; F284-Q288 HydrophobicContact CE1-CG 3.81Å; F284-Q288 HydrophobicContact CE2-CG 4.1Å; F284-Q288 HydrophobicContact CZ-CG 3.7Å; F284-Q288 WeakPolarHBondContact O-CG 3.48Å; F284-Q288 PolarHBondContact O-N 3.46Å
285	L	94.5	Very high	90.4	Very high	62 Å²	62	76.4 Å²	76.4	33%	0.325	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-40.6	-179.4	-169.9	66.4	0	0	0	111.3	M257 F281 F282 E283 Q288 V289	M257-L285 HydrophobicContact SD-CD1 4.38Å; F281-L285 PolarHBondContact O-N 3.4Å; F282-L285 PolarHBondContact O-N 3.28Å; E283-L285 VanDerWaalsContact C-N 3.31Å; E283-L285 PolarHBondContact O-N 2.67Å; L285-Q288 PolarHBondContact O-N 3.4Å; L285-V289 WeakPolarHBondContact O-CG2 3.36Å; L285-V289 PolarHBondContact O-N 3.26Å
286	R	94.6	Very high	89.7	Confident	171 Å²	171	75.4 Å²	75.4	65%	0.645	38%	0.383	S	S	*	.	H	α-helix	trans	-60.2	-47.8	174.1	-176.3	-174.7	-62.8	-167.2	1.3	111.1	F282 E283 F284 Q288 V289 E290	F282-R286 WeakPolarHBondContact O-CB 3.29Å; F282-R286 PolarHBondContact O-N 2.88Å; E283-R286 WeakPolarHBondContact O-CB 3.4Å; E283-R286 PolarHBondContact O-N 3.05Å; E283-R286 VanDerWaalsContact O-N 3.14Å; F284-R286 VanDerWaalsContact C-N 3.33Å; F284-R286 PolarHBondContact O-N 3.26Å; R286-Q288 VanDerWaalsContact C-N 3.28Å; R286-Q288 PolarHBondContact O-N 3.47Å; R286-V289 WeakPolarHBondContact O-CA 3.47Å; R286-V289 WeakPolarHBondContact O-CB 3.35Å; R286-V289 PolarHBondContact O-N 3.2Å; R286-E290 WeakPolarHBondContact O-CG 3.43Å; R286-E290 PolarHBondContact O-N 2.67Å
287	T	94.1	Very high	88.2	Confident	60 Å²	60	75.6 Å²	75.6	37%	0.368	39%	0.394	S	S	.	.	H	α-helix	trans	-58.3	-41.2	175.8	-52.9	0	0	0	0	111.3	E283 F284 V289 E290 V291	E283-T287 PolarHBondContact O-N 3.24Å; E283-T287 PolarHBondContact O-OG1 3.03Å; E283-T287 VanDerWaalsContact O-OG1 3.06Å; F284-T287 PolarHBondContact O-N 3.03Å; T287-V289 VanDerWaalsContact C-N 3.34Å; T287-V289 PolarHBondContact O-N 3.34Å; T287-E290 PolarHBondContact O-N 2.79Å; T287-V291 HydrophobicContact CG2-CG2 4.47Å; T287-V291 WeakPolarHBondContact O-CB 3.37Å; T287-V291 WeakPolarHBondContact O-CG2 3.29Å; T287-V291 PolarHBondContact O-N 2.82Å
288	Q	93.1	Very high	86.5	Confident	22 Å²	22	77.6 Å²	77.6	10%	0.103	41%	0.407	C	S	.	.	H	α-helix	trans	-65.2	-36.8	175.6	-63.4	-51.1	-61	0	0	112.3	L261 K264 F284 L285 R286 E292	L261-Q288 HydrophobicContact CD2-CB 4.27Å; L261-Q288 HydrophobicContact CD2-CG 4Å; K264-Q288 VanDerWaalsContact CD-OE1 3.25Å; F284-Q288 HydrophobicContact CD1-CG 4.29Å; F284-Q288 HydrophobicContact CE1-CG 3.81Å; F284-Q288 HydrophobicContact CE2-CG 4.1Å; F284-Q288 HydrophobicContact CZ-CG 3.7Å; F284-Q288 WeakPolarHBondContact O-CG 3.48Å; F284-Q288 PolarHBondContact O-N 3.46Å; L285-Q288 PolarHBondContact O-N 3.4Å; R286-Q288 VanDerWaalsContact C-N 3.28Å; R286-Q288 PolarHBondContact O-N 3.47Å; Q288-E292 VanDerWaalsContact O-CG 3.27Å; Q288-E292 WeakPolarHBondContact O-CG 3.28Å; Q288-E292 PolarHBondContact O-N 3.5Å
289	V	92.4	Very high	84.4	Confident	72 Å²	72	80.6 Å²	80.6	44%	0.436	43%	0.431	S	S	.	.	H	α-helix	trans	-62.9	-49.6	173.5	171.5	0	0	0	0	110.9	L285 R286 T287 V291 E292 E293	L285-V289 WeakPolarHBondContact O-CG2 3.36Å; L285-V289 PolarHBondContact O-N 3.26Å; R286-V289 WeakPolarHBondContact O-CA 3.47Å; R286-V289 WeakPolarHBondContact O-CB 3.35Å; R286-V289 PolarHBondContact O-N 3.2Å; T287-V289 VanDerWaalsContact C-N 3.34Å; T287-V289 PolarHBondContact O-N 3.34Å; V289-V291 VanDerWaalsContact C-N 3.3Å; V289-V291 PolarHBondContact O-N 3.23Å; V289-E292 PolarHBondContact O-N 2.88Å; V289-E292 VanDerWaalsContact O-N 3.12Å; V289-E293 HydrophobicContact CG1-CG 4.35Å; V289-E293 WeakPolarHBondContact O-CG 3.1Å; V289-E293 PolarHBondContact O-N 2.81Å
290	E	93	Very high	82	Confident	101 Å²	101	77.8 Å²	77.8	47%	0.472	43%	0.431	S	S	.	.	H	α-helix	trans	-60.4	-38.7	179.1	-70.4	173.1	-171.3	0	0	112.3	R286 T287 E293 S294	R286-E290 WeakPolarHBondContact O-CG 3.43Å; R286-E290 PolarHBondContact O-N 2.67Å; T287-E290 PolarHBondContact O-N 2.79Å; E290-E293 PolarHBondContact O-N 2.68Å; E290-S294 VanDerWaalsContact O-CB 3.28Å; E290-S294 WeakPolarHBondContact O-CB 3.21Å; E290-S294 PolarHBondContact O-N 3.33Å; E290-S294 PolarHBondContact O-OG 2.9Å
291	V	89.4	Confident	79.6	Confident	60 Å²	60	82.8 Å²	82.8	36%	0.364	46%	0.462	S	S	.	.	H	α-helix	trans	-61.5	-48.4	173.5	167.9	0	0	0	0	110.7	T287 V289 E293 S294 V295	T287-V291 HydrophobicContact CG2-CG2 4.47Å; T287-V291 WeakPolarHBondContact O-CB 3.37Å; T287-V291 WeakPolarHBondContact O-CG2 3.29Å; T287-V291 PolarHBondContact O-N 2.82Å; V289-V291 VanDerWaalsContact C-N 3.3Å; V289-V291 PolarHBondContact O-N 3.23Å; V291-E293 PolarHBondContact O-N 3.32Å; V291-S294 PolarHBondContact O-N 3.15Å; V291-V295 VanDerWaalsContact O-CG2 3.31Å; V291-V295 WeakPolarHBondContact O-CG2 3.49Å; V291-V295 PolarHBondContact O-N 3.39Å
292	E	86.4	Confident	76.9	Confident	85 Å²	85	93.1 Å²	93.1	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-66.1	-36.1	179.8	-69.2	-66.6	161.1	0	0	112.3	Q288 V289 K296	Q288-E292 VanDerWaalsContact O-CG 3.27Å; Q288-E292 WeakPolarHBondContact O-CG 3.28Å; Q288-E292 PolarHBondContact O-N 3.5Å; V289-E292 PolarHBondContact O-N 2.88Å; V289-E292 VanDerWaalsContact O-N 3.12Å; E292-K296 WeakPolarHBondContact O-CG 3.33Å; E292-K296 PolarHBondContact O-N 3.2Å
293	E	89.3	Confident	74.3	Confident	124 Å²	124	96.5 Å²	96.5	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-68.3	-40.2	174.1	-71.2	-176.5	154.7	0	0	112.3	V289 E290 V291 V295 K296 G297	V289-E293 HydrophobicContact CG1-CG 4.35Å; V289-E293 WeakPolarHBondContact O-CG 3.1Å; V289-E293 PolarHBondContact O-N 2.81Å; E290-E293 PolarHBondContact O-N 2.68Å; V291-E293 PolarHBondContact O-N 3.32Å; E293-V295 VanDerWaalsContact C-N 3.35Å; E293-V295 PolarHBondContact O-N 3.21Å; E293-K296 WeakPolarHBondContact O-CB 3.41Å; E293-K296 PolarHBondContact O-N 3.35Å; E293-G297 PolarHBondContact O-N 3.09Å; E293-G297 VanDerWaalsContact O-N 3.1Å
294	S	82	Confident	71.5	Confident	79 Å²	79	100.5 Å²	100.5	55%	0.552	54%	0.535	S	S	*	.	H	α-helix	trans	-63	-40	176.7	-62.9	0	0	0	0	112.3	E290 V291 K296 G297 T298	E290-S294 VanDerWaalsContact O-CB 3.28Å; E290-S294 WeakPolarHBondContact O-CB 3.21Å; E290-S294 PolarHBondContact O-N 3.33Å; E290-S294 PolarHBondContact O-OG 2.9Å; V291-S294 PolarHBondContact O-N 3.15Å; S294-K296 VanDerWaalsContact C-N 3.34Å; S294-G297 PolarHBondContact O-N 2.9Å; S294-T298 PolarHBondContact O-N 3.06Å; S294-T298 PolarHBondContact O-OG1 3.31Å
295	V	79.4	Confident	68.6	Low	80 Å²	80	104.8 Å²	104.8	49%	0.485	56%	0.564	S	S	.	*	H	α-helix	trans	-66.2	-35.8	176.4	171.8	0	0	0	0	111.7	V291 E293 S299	V291-V295 VanDerWaalsContact O-CG2 3.31Å; V291-V295 WeakPolarHBondContact O-CG2 3.49Å; V291-V295 PolarHBondContact O-N 3.39Å; E293-V295 VanDerWaalsContact C-N 3.35Å; E293-V295 PolarHBondContact O-N 3.21Å; V295-S299 PolarHBondContact O-OG 3.04Å
296	K	65.5	Low	65.8	Low	152 Å²	152	110.7 Å²	110.7	66%	0.661	59%	0.587	S	S	*	*	H	α-helix	trans	-64.4	-42.2	173.6	-73.6	174.8	-175.3	170.9	0	111.5	E292 E293 S294 T298 S299	E292-K296 WeakPolarHBondContact O-CG 3.33Å; E292-K296 PolarHBondContact O-N 3.2Å; E293-K296 WeakPolarHBondContact O-CB 3.41Å; E293-K296 PolarHBondContact O-N 3.35Å; S294-K296 VanDerWaalsContact C-N 3.34Å; K296-T298 VanDerWaalsContact C-N 3.31Å; K296-T298 PolarHBondContact O-N 2.88Å; K296-S299 PolarHBondContact O-N 3.49Å
297	G	55.9	Low	62.8	Low	52 Å²	52	110.7 Å²	110.7	54%	0.536	60%	0.6	S	S	.	*	H	α-helix	trans	-61.4	-34.7	179.6	0	0	0	0	0	113.8	E293 S294 S299	E293-G297 PolarHBondContact O-N 3.09Å; E293-G297 VanDerWaalsContact O-N 3.1Å; S294-G297 PolarHBondContact O-N 2.9Å; G297-S299 VanDerWaalsContact C-N 3.34Å; G297-S299 PolarHBondContact O-N 3.1Å
298	T	53.2	Low	60.1	Low	102 Å²	102	113.1 Å²	113.1	63%	0.626	62%	0.615	S	S	*	*	H	α-helix	trans	-77.8	-18.4	179.7	-0.9	0	0	0	0	113.7	S294 K296 G300	S294-T298 PolarHBondContact O-N 3.06Å; S294-T298 PolarHBondContact O-OG1 3.31Å; K296-T298 VanDerWaalsContact C-N 3.31Å; K296-T298 PolarHBondContact O-N 2.88Å; T298-G300 VanDerWaalsContact C-N 3.3Å; T298-G300 PolarHBondContact O-N 3.03Å
299	S	46.4	Very low	57.2	Low	104 Å²	104	118 Å²	118	73%	0.727	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-7	-177.7	-61.7	0	0	0	0	113.5	V295 K296 G297	V295-S299 PolarHBondContact O-OG 3.04Å; K296-S299 PolarHBondContact O-N 3.49Å; G297-S299 VanDerWaalsContact C-N 3.34Å; G297-S299 PolarHBondContact O-N 3.1Å
300	G	43.3	Very low	54.2	Low	64 Å²	64	122.8 Å²	122.8	66%	0.66	66%	0.66	S	S	*	*	S	Bend	trans	-104.6	-15.1	-168.5	0	0	0	0	0	118.2	T298	T298-G300 VanDerWaalsContact C-N 3.3Å; T298-G300 PolarHBondContact O-N 3.03Å
301	T	40.1	Very low	51.4	Low	112 Å²	112	124.3 Å²	124.3	69%	0.687	67%	0.67	S	S	*	*			trans	-131.7	7.5	-162.7	39.9	0	0	0	0	117.1	Q303	T301-Q303 PolarHBondContact O-N 3.32Å
302	Y	38.8	Very low	48.7	Very low	222 Å²	222	131.5 Å²	131.5	87%	0.871	70%	0.697	S	S	*	*			trans	-74.5	75.2	163.3	-104.1	-90.5	0	0	0	110.1	K304	Y302-K304 PolarHBondContact O-N 2.84Å
303	Q	39.5	Very low	46.2	Very low	173 Å²	173	133.7 Å²	133.7	81%	0.808	71%	0.707	S	S	*	*			trans	-56.4	105.2	158.7	-68.9	-177.6	-9.2	0	0	106.3	T301 P305	T301-Q303 PolarHBondContact O-N 3.32Å; Q303-P305 WeakPolarHBondContact O-CD 3.38Å
304	K	36	Very low	43.5	Very low	200 Å²	200	135.9 Å²	135.9	87%	0.87	72%	0.722	S	S	*	*			trans	-57.1	109.9	171.8	-90.3	-178.5	173.4	179.2	0	108	Y302	Y302-K304 PolarHBondContact O-N 2.84Å
305	P	34.6	Very low	41.2	Very low	103 Å²	103	137.5 Å²	137.5	67%	0.669	73%	0.729	S	S	*	*			trans	-74.1	135.9	174.8	-5.5	24.9	0	0	0	107.6	Q303	Q303-P305 WeakPolarHBondContact O-CD 3.38Å
306	F	35.3	Very low	39	Very low	186 Å²	186	137.2 Å²	137.2	82%	0.816	74%	0.743	S	S	*	*			trans	55.4	109.2	159	-67.3	-86.1	0	0	0	117.7	V308	F306-V308 HydrophobicContact CB-CG2 4.17Å; F306-V308 PolarHBondContact O-N 3.02Å
307	N	31.8	Very low	37.5	Very low	172 Å²	172	141.3 Å²	141.3	92%	0.92	75%	0.754	S	S	*	*			trans	-66.9	69.9	170.3	-151.6	2.5	0	0	0	109.8
308	V	35.8	Very low	36.6	Very low	111 Å²	111	147.6 Å²	147.6	67%	0.673	77%	0.769	S	S	*	*			trans	-88.5	121.9	171.4	-158.1	0	0	0	0	107.3	F306 Y310	F306-V308 HydrophobicContact CB-CG2 4.17Å; F306-V308 PolarHBondContact O-N 3.02Å; V308-Y310 PolarHBondContact O-N 3.11Å
309	P	32.9	Very low	35.7	Very low	123 Å²	123	154 Å²	154	80%	0.799	78%	0.782	S	S	*	*			trans	-76.1	74.5	-174.1	30.7	-33.2	0	0	0	109.8	L311	P309-L311 PolarHBondContact O-N 3.35Å
310	Y	30.3	Very low	35.2	Very low	174 Å²	174	156.6 Å²	156.6	68%	0.682	79%	0.786	S	S	*	*			trans	-82.6	106.2	173.8	-161.3	-99.5	0	0	0	109.5	V308	V308-Y310 PolarHBondContact O-N 3.11Å
311	L	34.2	Very low	34.8	Very low	133 Å²	133	157.2 Å²	157.2	70%	0.696	79%	0.785	S	S	*	*			trans	-4	119.8	154.4	-67.6	156.9	0	0	0	114.1	P309 Q313	P309-L311 PolarHBondContact O-N 3.35Å; L311-Q313 PolarHBondContact O-N 2.74Å
312	K	32	Very low	34.6	Very low	210 Å²	210	157.7 Å²	157.7	91%	0.913	79%	0.788	S	S	*	*			trans	-55.4	85.4	168.9	-74.9	177.3	175	176	0	110.1	N314	K312-N314 PolarHBondContact O-N 3.26Å
313	Q	34.7	Very low	34.4	Very low	131 Å²	131	152.5 Å²	152.5	61%	0.612	78%	0.78	S	S	*	*			trans	-84.8	108.5	158.7	-73	-170.1	-15.6	0	0	106.8	L311 T315	L311-Q313 PolarHBondContact O-N 2.74Å; Q313-T315 PolarHBondContact O-N 3.26Å
314	N	31.3	Very low	34.1	Very low	170 Å²	170	149.5 Å²	149.5	91%	0.909	78%	0.778	S	S	*	*			trans	-59.6	80.7	164.8	-93.1	-13.7	0	0	0	108.3	K312	K312-N314 PolarHBondContact O-N 3.26Å
315	T	33.7	Very low	34.1	Very low	113 Å²	113	147.6 Å²	147.6	69%	0.693	77%	0.774	S	S	*	*			trans	-98.9	112.4	162.2	52.2	0	0	0	0	106.8	Q313 R317	Q313-T315 PolarHBondContact O-N 3.26Å; T315-R317 PolarHBondContact O-N 2.96Å
316	G	33.8	Very low	34	Very low	75 Å²	75	149.5 Å²	149.5	77%	0.773	78%	0.778	S	S	*	*			trans	-51.6	109	179.8	0	0	0	0	0	109.6	E318	G316-E318 PolarHBondContact O-N 3.43Å
317	R	34	Very low	33.9	Very low	238 Å²	238	149.3 Å²	149.3	90%	0.898	78%	0.779	S	S	*	*			trans	-71.5	90.3	161	-81.8	-179.6	172.1	176.6	-3.8	106.3	T315 R319	T315-R317 PolarHBondContact O-N 2.96Å; R317-R319 PolarHBondContact O-N 3.35Å
318	E	36.1	Very low	34	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	77%	0.766	S	S	*	*			trans	-54.7	90.8	159.4	-76.6	-178.5	148.5	0	0	107.7	G316 I320	G316-E318 PolarHBondContact O-N 3.43Å; E318-I320 PolarHBondContact O-N 2.87Å; E318-I320 VanDerWaalsContact O-N 3.16Å
319	R	35.5	Very low	33.7	Very low	238 Å²	238	146.3 Å²	146.3	90%	0.898	77%	0.773	S	S	*	*			trans	-82.3	97.1	172.7	-130	179.3	-179.6	176.6	-0.4	106	R317 A321	R317-R319 PolarHBondContact O-N 3.35Å; R319-A321 PolarHBondContact O-N 3.3Å
320	I	35.8	Very low	33.9	Very low	157 Å²	157	144.6 Å²	144.6	81%	0.805	76%	0.76	S	S	*	*			trans	-40.8	106	175.1	-59.7	165.5	0	0	0	108.7	E318 T322	E318-I320 PolarHBondContact O-N 2.87Å; E318-I320 VanDerWaalsContact O-N 3.16Å; I320-T322 PolarHBondContact O-N 3.11Å; I320-T322 VanDerWaalsContact O-N 3.16Å
321	A	35	Very low	34.1	Very low	78 Å²	78	139.9 Å²	139.9	65%	0.645	75%	0.752	S	S	*	*			trans	-66.8	112.3	175.3	0	0	0	0	0	107.4	R319 T323	R319-A321 PolarHBondContact O-N 3.3Å; A321-T323 PolarHBondContact O-N 3.43Å; A321-T323 VanDerWaalsContact O-N 3.14Å
322	T	35.8	Very low	34.4	Very low	121 Å²	121	139.7 Å²	139.7	74%	0.742	76%	0.759	S	S	*	*			trans	-62.5	117.5	177.5	-23.1	0	0	0	0	107.7	I320 S324	I320-T322 PolarHBondContact O-N 3.11Å; I320-T322 VanDerWaalsContact O-N 3.16Å; T322-S324 PolarHBondContact O-N 3.09Å
323	T	34.2	Very low	34.9	Very low	114 Å²	114	136.5 Å²	136.5	70%	0.699	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-63.5	0.5	-170.5	28.7	0	0	0	0	115.2	A321 M325	A321-T323 PolarHBondContact O-N 3.43Å; A321-T323 VanDerWaalsContact O-N 3.14Å; T323-M325 VanDerWaalsContact C-N 3.33Å; T323-M325 PolarHBondContact O-N 3.5Å
324	S	33.7	Very low	35.5	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-86.1	15.7	-178.4	-56.3	0	0	0	0	115.7	T322	T322-S324 PolarHBondContact O-N 3.09Å
325	M	34.8	Very low	36.6	Very low	160 Å²	160	135.2 Å²	135.2	79%	0.788	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-132	7.5	169.4	-73.3	-159.4	75.4	0	0	115.2	T323 Q327	T323-M325 VanDerWaalsContact C-N 3.33Å; T323-M325 PolarHBondContact O-N 3.5Å; M325-Q327 VanDerWaalsContact C-N 3.26Å; M325-Q327 PolarHBondContact O-N 2.89Å
326	L	32.7	Very low	38.1	Very low	142 Å²	142	134.5 Å²	134.5	74%	0.743	73%	0.729	S	S	*	*	S	Bend	trans	-83.7	7.4	177.2	-76.3	170.5	0	0	0	114.4
327	Q	33.1	Very low	40	Very low	183 Å²	183	131.1 Å²	131.1	86%	0.855	69%	0.694	S	S	*	*			trans	-118.3	59.5	174.1	-68.9	-171.9	-28.6	0	0	111	M325	M325-Q327 VanDerWaalsContact C-N 3.26Å; M325-Q327 PolarHBondContact O-N 2.89Å
328	T	33.9	Very low	41.8	Very low	105 Å²	105	121.8 Å²	121.8	64%	0.644	66%	0.664	S	S	*	*			trans	-118.6	80.2	145.9	48.8	0	0	0	0	106.3	V330	T328-V330 PolarHBondContact O-N 3.36Å
329	S	31.1	Very low	43.6	Very low	115 Å²	115	114.5 Å²	114.5	80%	0.804	63%	0.631	S	S	*	*			trans	-61	83.7	150.9	44.1	0	0	0	0	105.8	S331	S329-S331 VanDerWaalsContact C-N 3.28Å; S329-S331 PolarHBondContact O-N 2.87Å
330	V	36.3	Very low	45.7	Very low	87 Å²	87	104.8 Å²	104.8	53%	0.527	60%	0.599	S	S	.	*			trans	-68.1	97.3	175.3	179.1	0	0	0	0	105.1	T328	T328-V330 PolarHBondContact O-N 3.36Å
331	S	34.2	Very low	47.3	Very low	75 Å²	75	101 Å²	101	52%	0.524	59%	0.586	S	S	.	*			trans	-42.5	145.1	154.2	36.3	0	0	0	0	108.6	S329 E333	S329-S331 VanDerWaalsContact C-N 3.28Å; S329-S331 PolarHBondContact O-N 2.87Å; S331-E333 PolarHBondContact O-N 2.86Å
332	P	40.6	Very low	49.1	Very low	128 Å²	128	100.6 Å²	100.6	83%	0.831	58%	0.576	S	S	*	*			trans	-71.3	68.2	-174.1	31.2	-34.5	0	0	0	110.4	I334	P332-I334 PolarHBondContact O-N 3.49Å
333	E	42.7	Very low	50.9	Low	144 Å²	144	99.5 Å²	99.5	67%	0.673	57%	0.566	S	S	*	*			trans	-63.5	118.8	161.8	-80.8	-177.6	167.2	0	0	106.1	S331 H335	S331-E333 PolarHBondContact O-N 2.86Å; E333-H335 PolarHBondContact O-N 3.36Å
334	I	46.6	Very low	52.7	Low	123 Å²	123	98 Å²	98	63%	0.631	57%	0.573	S	S	*	*			trans	-49.3	103.6	-178.3	-60.8	162.6	0	0	0	108.2	P332 L336 D343	P332-I334 PolarHBondContact O-N 3.49Å; I334-L336 VanDerWaalsContact C-N 3.3Å; I334-L336 HydrophobicContact CG2-CG 4.45Å; I334-L336 PolarHBondContact O-N 3.16Å; I334-D343 HydrophobicContact CG2-CB 3.64Å
335	H	55.3	Low	54.8	Low	150 Å²	150	95 Å²	95	69%	0.694	55%	0.546	S	S	*	.			trans	-72.4	88	-179.7	-79.4	-63	0	0	0	109.4	E333	E333-H335 PolarHBondContact O-N 3.36Å
336	L	65.3	Low	56.8	Low	98 Å²	98	90.6 Å²	90.6	51%	0.513	52%	0.524	S	S	.	.			trans	-64.6	131.1	169	-63.9	155	0	0	0	108.8	I334 P338 S341 D343	I334-L336 VanDerWaalsContact C-N 3.3Å; I334-L336 HydrophobicContact CG2-CG 4.45Å; I334-L336 PolarHBondContact O-N 3.16Å; L336-P338 WeakPolarHBondContact O-CD 3.1Å; L336-S341 VanDerWaalsContact CD2-O 3.27Å; L336-S341 WeakPolarHBondContact CD2-O 3.45Å; L336-D343 HydrophobicContact CD2-CB 4.3Å
337	C	74.1	Confident	58.8	Low	4 Å²	4	84.3 Å²	84.3	3%	0.027	49%	0.49	C	S	.	.			trans	-61.6	122.3	175.5	177	0	0	0	0	109.5	I339 C340 S341 T342 H345	C337-I339 PolarHBondContact O-N 3.35Å; C337-C340 PolarHBondContact O-N 3.13Å; C337-S341 WeakPolarHBondContact O-CA 3.37Å; C337-S341 PolarHBondContact O-N 3.37Å; C337-T342 WeakPolarHBondContact CB-O 3.48Å; C337-T342 PolarHBondContact N-O 3.24Å; C337-H345 WeakPolarHBondContact CB-NE2 3.48Å; C337-H345 PolarHBondContact SG-NE2 3.3Å
338	P	70.1	Confident	61	Low	42 Å²	42	76.7 Å²	76.7	27%	0.273	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-7.2	-173.8	-18.5	28.9	0	0	0	115.4	L336 F347 Q368	L336-P338 WeakPolarHBondContact O-CD 3.1Å; P338-F347 HydrophobicContact CB-CE2 4.06Å; P338-F347 HydrophobicContact CG-CD2 4.18Å; P338-F347 HydrophobicContact CG-CE2 3.85Å; P338-Q368 HydrophobicContact CB-CG 4.28Å
339	I	75.2	Confident	63.2	Low	30 Å²	30	77.6 Å²	77.6	15%	0.154	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-46.2	-178.5	-62.2	-178.5	0	0	0	111.5	C337 F347 V352 F353 M356 T364	C337-I339 PolarHBondContact O-N 3.35Å; I339-F347 HydrophobicContact CD1-CD1 3.77Å; I339-F347 HydrophobicContact CD1-CD2 4.42Å; I339-F347 HydrophobicContact CD1-CE1 3.2Å; I339-F347 HydrophobicContact CD1-CE2 3.92Å; I339-F347 HydrophobicContact CD1-CG 4.36Å; I339-F347 HydrophobicContact CD1-CZ 3.28Å; I339-F347 HydrophobicContact CG1-CE1 3.98Å; I339-F347 HydrophobicContact CG1-CE2 3.8Å; I339-F347 HydrophobicContact CG1-CZ 3.5Å; I339-F347 VanDerWaalsContact CG1-CZ 3.5Å; I339-V352 HydrophobicContact CG2-CB 3.79Å; I339-V352 HydrophobicContact CG2-CG1 3.73Å; I339-F353 HydrophobicContact CD1-CB 3.51Å; I339-F353 HydrophobicContact CD1-CD2 3.28Å; I339-F353 HydrophobicContact CD1-CE2 4.16Å; I339-F353 HydrophobicContact CD1-CG 3.61Å; I339-M356 HydrophobicContact CG2-CE 3.93Å; I339-T364 HydrophobicContact CD1-CG2 3.68Å; I339-T364 HydrophobicContact CG1-CG2 3.78Å
340	C	79.4	Confident	65.9	Low	35 Å²	35	72.1 Å²	72.1	24%	0.236	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-1	-176.7	61.5	0	0	0	0	113.2	C337 T342 H345 C350 V352	C337-C340 PolarHBondContact O-N 3.13Å; C340-T342 PolarHBondContact O-N 3.32Å; C340-T342 VanDerWaalsContact O-N 3.1Å; C340-T342 PolarHBondContact SG-OG1 3.1Å; C340-H345 PolarHBondContact SG-CE1 3.46Å; C340-H345 PolarHBondContact SG-NE2 3.08Å; C340-C350 VanDerWaalsContact SG-SG 3.62Å; C340-V352 HydrophobicContact CB-CB 4.35Å; C340-V352 HydrophobicContact CB-CG2 3.67Å
341	S	70.2	Confident	68.2	Low	77 Å²	77	71.6 Å²	71.6	54%	0.538	42%	0.415	S	S	.	.			trans	54.3	27.6	179.8	-53.1	0	0	0	0	113.8	L336 C337	L336-S341 VanDerWaalsContact CD2-O 3.27Å; L336-S341 WeakPolarHBondContact CD2-O 3.45Å; C337-S341 WeakPolarHBondContact O-CA 3.37Å; C337-S341 PolarHBondContact O-N 3.37Å
342	T	72.4	Confident	70.6	Confident	69 Å²	69	71.1 Å²	71.1	42%	0.423	41%	0.41	S	S	.	.			trans	-109.7	149.5	171.6	65	0	0	0	0	109.6	C337 C340 H345	C337-T342 WeakPolarHBondContact CB-O 3.48Å; C337-T342 PolarHBondContact N-O 3.24Å; C340-T342 PolarHBondContact O-N 3.32Å; C340-T342 VanDerWaalsContact O-N 3.1Å; C340-T342 PolarHBondContact SG-OG1 3.1Å; T342-H345 PolarHBondContact OG1-CE1 2.92Å
343	D	72.6	Confident	72.8	Confident	99 Å²	99	65 Å²	65	53%	0.529	37%	0.37	S	S	.	.	S	Bend	trans	-81.6	179.1	177.6	61.2	-21.8	0	0	0	112.4	I334 L336 H345	I334-D343 HydrophobicContact CG2-CB 3.64Å; L336-D343 HydrophobicContact CD2-CB 4.3Å; D343-H345 PolarHBondContact O-N 3.5Å; D343-H345 PolarHBondContact O-ND1 3.03Å
344	G	72.5	Confident	75	Confident	82 Å²	82	61.8 Å²	61.8	85%	0.845	36%	0.357	S	S	*	.	S	Bend	trans	84	3.3	167	0	0	0	0	0	117.6
345	H	78.4	Confident	76.9	Confident	46 Å²	46	64.9 Å²	64.9	21%	0.213	37%	0.366	C	S	.	.	S	Bend	trans	-147.3	156.9	177.8	68	-89.2	0	0	0	114.8	C337 C340 T342 D343 Q349 C350	C337-H345 WeakPolarHBondContact CB-NE2 3.48Å; C337-H345 PolarHBondContact SG-NE2 3.3Å; C340-H345 PolarHBondContact SG-CE1 3.46Å; C340-H345 PolarHBondContact SG-NE2 3.08Å; T342-H345 PolarHBondContact OG1-CE1 2.92Å; D343-H345 PolarHBondContact O-N 3.5Å; D343-H345 PolarHBondContact O-ND1 3.03Å; H345-Q349 HydrophobicContact CB-CB 4.22Å; H345-C350 VanDerWaalsContact CD2-CA 3.45Å; H345-C350 WeakPolarHBondContact CD2-CA 3.44Å; H345-C350 WeakPolarHBondContact NE2-CA 3.34Å; H345-C350 WeakPolarHBondContact NE2-CB 3.35Å
346	H	75.8	Confident	78.5	Confident	68 Å²	68	59.6 Å²	59.6	32%	0.315	34%	0.342	S	S	.	.			trans	-80.2	153.1	177.9	-170.6	-88.2	0	0	0	111.6	A348 Q349 C350 C374 Q376	H346-A348 PolarHBondContact ND1-N 2.95Å; H346-A348 PolarHBondContact O-N 3.07Å; H346-Q349 HydrophobicContact CB-CG 4.42Å; H346-Q349 WeakPolarHBondContact O-CA 3.41Å; H346-Q349 WeakPolarHBondContact O-CB 3.46Å; H346-Q349 PolarHBondContact O-N 3.18Å; H346-C350 PolarHBondContact O-N 3.39Å; H346-C374 PolarHBondContact CE1-O 3.23Å; H346-Q376 PolarHBondContact CD2-NE2 3.4Å; H346-Q376 PolarHBondContact CE1-NE2 3.33Å; H346-Q376 VanDerWaalsContact CE1-NE2 3.32Å; H346-Q376 VanDerWaalsContact NE2-CG 3.3Å; H346-Q376 WeakPolarHBondContact NE2-CG 3.44Å; H346-Q376 PolarHBondContact NE2-NE2 2.95Å
347	F	75.5	Confident	79.7	Confident	11 Å²	11	59.1 Å²	59.1	5%	0.048	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-50.6	-36.9	-179.6	-147.5	-86.5	0	0	0	113.8	P338 I339 Q349 C350 F353 T364 V365 Q368 V370 L375	P338-F347 HydrophobicContact CB-CE2 4.06Å; P338-F347 HydrophobicContact CG-CD2 4.18Å; P338-F347 HydrophobicContact CG-CE2 3.85Å; I339-F347 HydrophobicContact CD1-CD1 3.77Å; I339-F347 HydrophobicContact CD1-CD2 4.42Å; I339-F347 HydrophobicContact CD1-CE1 3.2Å; I339-F347 HydrophobicContact CD1-CE2 3.92Å; I339-F347 HydrophobicContact CD1-CG 4.36Å; I339-F347 HydrophobicContact CD1-CZ 3.28Å; I339-F347 HydrophobicContact CG1-CE1 3.98Å; I339-F347 HydrophobicContact CG1-CE2 3.8Å; I339-F347 HydrophobicContact CG1-CZ 3.5Å; I339-F347 VanDerWaalsContact CG1-CZ 3.5Å; F347-Q349 VanDerWaalsContact C-N 3.29Å; F347-Q349 PolarHBondContact O-N 3.21Å; F347-C350 WeakPolarHBondContact O-CB 3.5Å; F347-C350 PolarHBondContact O-N 2.89Å; F347-F353 HydrophobicContact CD1-CD1 4.49Å; F347-F353 HydrophobicContact CD1-CD2 4.49Å; F347-F353 HydrophobicContact CD1-CE2 4.46Å; F347-F353 HydrophobicContact CD1-CG 4.48Å; F347-F353 HydrophobicContact CD1-CZ 4.47Å; F347-F353 HydrophobicContact CE1-CD2 4.09Å; F347-F353 AromaticContact CE1-CE2 3.96Å; F347-F353 HydrophobicContact CE1-CE2 3.96Å; F347-F353 HydrophobicContact CE1-CZ 4.32Å; F347-T364 HydrophobicContact CZ-CG2 4.31Å; F347-V365 HydrophobicContact CE1-CG2 4.13Å; F347-Q368 HydrophobicContact CE2-CB 4.12Å; F347-Q368 HydrophobicContact CE2-CG 4.25Å; F347-Q368 HydrophobicContact CZ-CB 3.89Å; F347-Q368 HydrophobicContact CZ-CG 3.94Å; F347-V370 HydrophobicContact CD2-CG1 4.21Å; F347-V370 HydrophobicContact CE1-CG2 4.13Å; F347-V370 HydrophobicContact CE2-CG1 4.06Å; F347-V370 HydrophobicContact CZ-CG1 4.43Å; F347-V370 HydrophobicContact CZ-CG2 4.13Å; F347-L375 HydrophobicContact CB-CB 4.21Å; F347-L375 VanDerWaalsContact CB-O 3.32Å; F347-L375 WeakPolarHBondContact CB-O 3.4Å; F347-L375 HydrophobicContact CD1-CB 4.32Å
348	A	77.7	Confident	80.4	Confident	22 Å²	22	60.4 Å²	60.4	18%	0.182	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-70.1	-19.2	176.3	0	0	0	0	0	114.6	H346 L375 L403	H346-A348 PolarHBondContact ND1-N 2.95Å; H346-A348 PolarHBondContact O-N 3.07Å; A348-L375 HydrophobicContact CB-CD1 4.16Å; A348-L403 HydrophobicContact CB-CD1 4.3Å
349	Q	81.5	Confident	81.3	Confident	124 Å²	124	65.1 Å²	65.1	58%	0.579	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-100.1	-2.7	178.5	-64.6	166.9	-18	0	0	112.3	H345 H346 F347 P351	H345-Q349 HydrophobicContact CB-CB 4.22Å; H346-Q349 HydrophobicContact CB-CG 4.42Å; H346-Q349 WeakPolarHBondContact O-CA 3.41Å; H346-Q349 WeakPolarHBondContact O-CB 3.46Å; H346-Q349 PolarHBondContact O-N 3.18Å; F347-Q349 VanDerWaalsContact C-N 3.29Å; F347-Q349 PolarHBondContact O-N 3.21Å; Q349-P351 WeakPolarHBondContact O-CD 3.44Å
350	C	86.6	Confident	82	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.374	C	S	.	.			trans	-63.1	121.1	-177.6	178.2	0	0	0	0	111	C340 H345 H346 F347 V352 F353 L354	C340-C350 VanDerWaalsContact SG-SG 3.62Å; H345-C350 VanDerWaalsContact CD2-CA 3.45Å; H345-C350 WeakPolarHBondContact CD2-CA 3.44Å; H345-C350 WeakPolarHBondContact NE2-CA 3.34Å; H345-C350 WeakPolarHBondContact NE2-CB 3.35Å; H346-C350 PolarHBondContact O-N 3.39Å; F347-C350 WeakPolarHBondContact O-CB 3.5Å; F347-C350 PolarHBondContact O-N 2.89Å; C350-V352 PolarHBondContact O-N 2.94Å; C350-F353 HydrophobicContact CB-CB 3.74Å; C350-F353 PolarHBondContact O-N 3.18Å; C350-F353 VanDerWaalsContact O-N 3.14Å; C350-L354 WeakPolarHBondContact O-CG 3.47Å; C350-L354 PolarHBondContact O-N 3.29Å
351	P	84.7	Confident	82.6	Confident	76 Å²	76	67.8 Å²	67.8	49%	0.494	37%	0.37	S	S	.	.	H	α-helix	trans	-59.5	-37.5	-178.5	-20.6	29.9	0	0	0	112.1	Q349 K355	Q349-P351 WeakPolarHBondContact O-CD 3.44Å; P351-K355 WeakPolarHBondContact O-CG 3.31Å; P351-K355 PolarHBondContact O-N 2.93Å; P351-K355 VanDerWaalsContact O-N 3.12Å
352	V	85.1	Confident	83.7	Confident	66 Å²	66	66.5 Å²	66.5	40%	0.4	35%	0.354	S	S	.	.	H	α-helix	trans	-67.6	-44.6	178.9	-175.6	0	0	0	0	110.3	I339 C340 C350 L354 K355 M356	I339-V352 HydrophobicContact CG2-CB 3.79Å; I339-V352 HydrophobicContact CG2-CG1 3.73Å; C340-V352 HydrophobicContact CB-CB 4.35Å; C340-V352 HydrophobicContact CB-CG2 3.67Å; C350-V352 PolarHBondContact O-N 2.94Å; V352-L354 VanDerWaalsContact C-N 3.35Å; V352-L354 PolarHBondContact O-N 3.11Å; V352-K355 PolarHBondContact O-N 3.41Å; V352-M356 HydrophobicContact CG1-CE 4.13Å; V352-M356 WeakPolarHBondContact O-CG 3.39Å; V352-M356 PolarHBondContact O-N 3.12Å
353	F	88	Confident	84.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-40.1	177	-169.5	-115.8	0	0	0	112.9	I339 F347 C350 K355 M356 R361 T364 V365 L375 L403 L404	I339-F353 HydrophobicContact CD1-CB 3.51Å; I339-F353 HydrophobicContact CD1-CD2 3.28Å; I339-F353 HydrophobicContact CD1-CE2 4.16Å; I339-F353 HydrophobicContact CD1-CG 3.61Å; F347-F353 HydrophobicContact CD1-CD1 4.49Å; F347-F353 HydrophobicContact CD1-CD2 4.49Å; F347-F353 HydrophobicContact CD1-CE2 4.46Å; F347-F353 HydrophobicContact CD1-CG 4.48Å; F347-F353 HydrophobicContact CD1-CZ 4.47Å; F347-F353 HydrophobicContact CE1-CD2 4.09Å; F347-F353 AromaticContact CE1-CE2 3.96Å; F347-F353 HydrophobicContact CE1-CE2 3.96Å; F347-F353 HydrophobicContact CE1-CZ 4.32Å; C350-F353 HydrophobicContact CB-CB 3.74Å; C350-F353 PolarHBondContact O-N 3.18Å; C350-F353 VanDerWaalsContact O-N 3.14Å; F353-K355 VanDerWaalsContact C-N 3.3Å; F353-K355 PolarHBondContact O-N 3.41Å; F353-M356 HydrophobicContact CD2-SD 4.12Å; F353-M356 WeakPolarHBondContact O-CB 3.46Å; F353-M356 PolarHBondContact O-N 3.35Å; F353-R361 HydrophobicContact CD2-CB 4.48Å; F353-R361 HydrophobicContact CD2-CG 4.13Å; F353-R361 HydrophobicContact CE1-CG 4.36Å; F353-R361 HydrophobicContact CE2-CB 3.66Å; F353-R361 HydrophobicContact CE2-CG 3.75Å; F353-R361 HydrophobicContact CZ-CB 3.72Å; F353-R361 HydrophobicContact CZ-CG 3.88Å; F353-R361 PolarHBondContact O-NE 3.47Å; F353-R361 VanDerWaalsContact O-NE 3.15Å; F353-T364 HydrophobicContact CD2-CG2 4.43Å; F353-V365 HydrophobicContact CE2-CG2 3.78Å; F353-V365 HydrophobicContact CZ-CG2 3.61Å; F353-L375 HydrophobicContact CE1-CD1 3.76Å; F353-L375 HydrophobicContact CZ-CD1 4.27Å; F353-L403 HydrophobicContact CD1-CD1 4.16Å; F353-L403 HydrophobicContact CE1-CB 4.22Å; F353-L403 HydrophobicContact CE1-CD1 3.94Å; F353-L404 HydrophobicContact CZ-CD2 4.31Å
354	L	87.3	Confident	85.2	Confident	76 Å²	76	65.6 Å²	65.6	40%	0.398	34%	0.337	S	S	.	.	H	α-helix	trans	-67.1	-32.1	178.5	-69.9	172.4	0	0	0	111.8	C350 V352 M356 R361 L403	C350-L354 WeakPolarHBondContact O-CG 3.47Å; C350-L354 PolarHBondContact O-N 3.29Å; V352-L354 VanDerWaalsContact C-N 3.35Å; V352-L354 PolarHBondContact O-N 3.11Å; L354-M356 VanDerWaalsContact C-N 3.35Å; L354-R361 PolarHBondContact O-NH2 2.86Å; L354-L403 HydrophobicContact CD2-CD1 3.76Å; L354-L403 HydrophobicContact CD2-CD2 3.7Å; L354-L403 HydrophobicContact CD2-CG 4.4Å
355	K	86.9	Confident	85.9	Confident	187 Å²	187	61.7 Å²	61.7	81%	0.813	30%	0.297	S	S	*	.	H	α-helix	trans	-74.3	-19.6	174.5	-74	178	-178.7	-178.9	0	114.2	P351 V352 F353	P351-K355 WeakPolarHBondContact O-CG 3.31Å; P351-K355 PolarHBondContact O-N 2.93Å; P351-K355 VanDerWaalsContact O-N 3.12Å; V352-K355 PolarHBondContact O-N 3.41Å; F353-K355 VanDerWaalsContact C-N 3.3Å; F353-K355 PolarHBondContact O-N 3.41Å
356	M	89.5	Confident	86.3	Confident	39 Å²	39	65.7 Å²	65.7	19%	0.192	31%	0.313	C	S	.	.	S	Bend	trans	-68.2	146.3	178	-70.3	177.6	-177.9	0	0	112.2	I339 V352 F353 L354 Q360 R361 T364	I339-M356 HydrophobicContact CG2-CE 3.93Å; V352-M356 HydrophobicContact CG1-CE 4.13Å; V352-M356 WeakPolarHBondContact O-CG 3.39Å; V352-M356 PolarHBondContact O-N 3.12Å; F353-M356 HydrophobicContact CD2-SD 4.12Å; F353-M356 WeakPolarHBondContact O-CB 3.46Å; F353-M356 PolarHBondContact O-N 3.35Å; L354-M356 VanDerWaalsContact C-N 3.35Å; M356-Q360 HydrophobicContact CB-CB 3.85Å; M356-Q360 HydrophobicContact CG-CB 4.17Å; M356-Q360 HydrophobicContact SD-CB 4.32Å; M356-R361 HydrophobicContact CB-CG 3.75Å; M356-R361 VanDerWaalsContact O-CZ 3.29Å; M356-R361 PolarHBondContact O-NE 2.93Å; M356-R361 PolarHBondContact O-NH2 3.37Å; M356-T364 HydrophobicContact CE-CG2 4.43Å; M356-T364 HydrophobicContact SD-CG2 4.45Å; M356-T364 PolarHBondContact SD-OG1 3.46Å
357	N	89.5	Confident	86.7	Confident	89 Å²	89	68.6 Å²	68.6	48%	0.476	33%	0.327	S	S	.	.			trans	-71.4	162.6	168.6	70.2	47.8	0	0	0	111.4	K359 Q360 R361	N357-K359 VanDerWaalsContact C-N 3.25Å; N357-K359 PolarHBondContact O-N 2.88Å; N357-K359 VanDerWaalsContact O-N 3.16Å; N357-K359 WeakPolarHBondContact OD1-CB 3.48Å; N357-K359 PolarHBondContact OD1-N 3.09Å; N357-K359 VanDerWaalsContact OD1-N 3.16Å; N357-Q360 VanDerWaalsContact CG-OE1 3.3Å; N357-Q360 PolarHBondContact ND2-OE1 2.92Å; N357-Q360 WeakPolarHBondContact O-CB 3.37Å; N357-Q360 PolarHBondContact O-N 2.9Å; N357-Q360 WeakPolarHBondContact OD1-CG 3.15Å; N357-Q360 PolarHBondContact OD1-N 3.49Å; N357-R361 WeakPolarHBondContact O-CG 3.42Å; N357-R361 PolarHBondContact O-N 3.38Å
358	V	88.8	Confident	87.1	Confident	31 Å²	31	70.9 Å²	70.9	19%	0.188	34%	0.338	C	S	.	.	H	α-helix	trans	-56.8	-37.1	-174.5	-178.2	0	0	0	0	112.5	R361 W362 H405 Y406	V358-R361 PolarHBondContact O-N 3Å; V358-W362 VanDerWaalsContact O-CD1 3.3Å; V358-W362 PolarHBondContact O-N 2.94Å; V358-H405 WeakPolarHBondContact CG2-O 3.31Å; V358-Y406 HydrophobicContact CB-CD1 4.07Å; V358-Y406 HydrophobicContact CB-CE1 4.07Å; V358-Y406 HydrophobicContact CG1-CD1 3.6Å; V358-Y406 HydrophobicContact CG1-CD2 4.21Å; V358-Y406 HydrophobicContact CG1-CE1 3.62Å; V358-Y406 HydrophobicContact CG1-CE2 4.23Å; V358-Y406 HydrophobicContact CG1-CG 3.91Å
359	K	89.7	Confident	87.3	Confident	141 Å²	141	80 Å²	80	61%	0.613	37%	0.368	S	S	*	.	H	α-helix	trans	-65.8	-42.5	177.8	-172.1	178.8	-178.4	179.8	0	111.6	N357 R363	N357-K359 VanDerWaalsContact C-N 3.25Å; N357-K359 PolarHBondContact O-N 2.88Å; N357-K359 VanDerWaalsContact O-N 3.16Å; N357-K359 WeakPolarHBondContact OD1-CB 3.48Å; N357-K359 PolarHBondContact OD1-N 3.09Å; N357-K359 VanDerWaalsContact OD1-N 3.16Å; K359-R363 PolarHBondContact O-N 3.45Å; K359-R363 VanDerWaalsContact O-N 3.16Å
360	Q	90	Very high	87.5	Confident	80 Å²	80	74.4 Å²	74.4	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-66	-40.9	174.5	-73.5	169	-34.5	0	0	111.8	M356 N357 W362 R363 T364	M356-Q360 HydrophobicContact CB-CB 3.85Å; M356-Q360 HydrophobicContact CG-CB 4.17Å; M356-Q360 HydrophobicContact SD-CB 4.32Å; N357-Q360 VanDerWaalsContact CG-OE1 3.3Å; N357-Q360 PolarHBondContact ND2-OE1 2.92Å; N357-Q360 WeakPolarHBondContact O-CB 3.37Å; N357-Q360 PolarHBondContact O-N 2.9Å; N357-Q360 WeakPolarHBondContact OD1-CG 3.15Å; N357-Q360 PolarHBondContact OD1-N 3.49Å; Q360-W362 PolarHBondContact O-N 2.97Å; Q360-R363 PolarHBondContact O-N 3.33Å; Q360-T364 WeakPolarHBondContact O-CB 3.28Å; Q360-T364 PolarHBondContact O-N 3.08Å; Q360-T364 PolarHBondContact O-OG1 2.81Å
361	R	92.8	Very high	87.6	Confident	41 Å²	41	74.5 Å²	74.5	16%	0.155	34%	0.342	C	S	.	.	H	α-helix	trans	-60.7	-45.2	175.9	-67.1	179.4	-170.4	157.8	4.9	111.7	F353 L354 M356 N357 V358 R363 T364 V365 L403 L404	F353-R361 HydrophobicContact CD2-CB 4.48Å; F353-R361 HydrophobicContact CD2-CG 4.13Å; F353-R361 HydrophobicContact CE1-CG 4.36Å; F353-R361 HydrophobicContact CE2-CB 3.66Å; F353-R361 HydrophobicContact CE2-CG 3.75Å; F353-R361 HydrophobicContact CZ-CB 3.72Å; F353-R361 HydrophobicContact CZ-CG 3.88Å; F353-R361 PolarHBondContact O-NE 3.47Å; F353-R361 VanDerWaalsContact O-NE 3.15Å; L354-R361 PolarHBondContact O-NH2 2.86Å; M356-R361 HydrophobicContact CB-CG 3.75Å; M356-R361 VanDerWaalsContact O-CZ 3.29Å; M356-R361 PolarHBondContact O-NE 2.93Å; M356-R361 PolarHBondContact O-NH2 3.37Å; N357-R361 WeakPolarHBondContact O-CG 3.42Å; N357-R361 PolarHBondContact O-N 3.38Å; V358-R361 PolarHBondContact O-N 3Å; R361-R363 VanDerWaalsContact C-N 3.34Å; R361-R363 PolarHBondContact O-N 3.2Å; R361-T364 PolarHBondContact O-N 3.47Å; R361-V365 WeakPolarHBondContact O-CB 3.31Å; R361-V365 VanDerWaalsContact O-CG2 3.3Å; R361-V365 WeakPolarHBondContact O-CG2 3.24Å; R361-V365 PolarHBondContact O-N 3.27Å; R361-L403 WeakPolarHBondContact CD-O 3.43Å; R361-L403 PolarHBondContact NH1-O 3.4Å; R361-L404 HydrophobicContact CB-CD2 3.72Å
362	W	92.1	Very high	87.8	Confident	50 Å²	50	74.1 Å²	74.1	19%	0.189	33%	0.333	C	S	.	.	H	α-helix	trans	-59.7	-41.7	175.2	-90.8	106.6	0	0	0	113.2	V358 Q360 K366 F372 H400 L404 Y406	V358-W362 VanDerWaalsContact O-CD1 3.3Å; V358-W362 PolarHBondContact O-N 2.94Å; Q360-W362 PolarHBondContact O-N 2.97Å; W362-K366 WeakPolarHBondContact O-CG 3.4Å; W362-K366 PolarHBondContact O-N 3.34Å; W362-F372 HydrophobicContact CZ3-CD2 4.23Å; W362-F372 HydrophobicContact CZ3-CG 4.32Å; W362-H400 HydrophobicContact CH2-CB 4.16Å; W362-H400 HydrophobicContact CZ2-CB 4.27Å; W362-H400 AromaticContact CZ2-ND1 3.58Å; W362-L404 HydrophobicContact CD2-CB 4.44Å; W362-L404 HydrophobicContact CD2-CD2 4.33Å; W362-L404 HydrophobicContact CE3-CD1 4.45Å; W362-L404 HydrophobicContact CG-CD2 4.28Å; W362-L404 HydrophobicContact CH2-CD1 4.41Å; W362-L404 HydrophobicContact CZ2-CB 3.98Å; W362-L404 HydrophobicContact CZ2-CD1 4.48Å; W362-L404 HydrophobicContact CZ3-CD1 4.39Å; W362-L404 PolarHBondContact NE1-O 3.43Å; W362-Y406 AromaticContact CD1-CE2 3.65Å; W362-Y406 AromaticContact CD1-CZ 3.67Å; W362-Y406 AromaticContact NE1-CE2 3.42Å; W362-Y406 AromaticContact NE1-CZ 3.95Å
363	R	88.2	Confident	87.9	Confident	131 Å²	131	71.5 Å²	71.5	49%	0.494	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-50.7	176.3	-174.6	-173.5	-61	149.3	-4.4	110.7	K359 Q360 R361 V365 K366 E367	K359-R363 PolarHBondContact O-N 3.45Å; K359-R363 VanDerWaalsContact O-N 3.16Å; Q360-R363 PolarHBondContact O-N 3.33Å; R361-R363 VanDerWaalsContact C-N 3.34Å; R361-R363 PolarHBondContact O-N 3.2Å; R363-V365 PolarHBondContact O-N 2.93Å; R363-K366 PolarHBondContact O-N 3.5Å; R363-K366 VanDerWaalsContact O-N 3.17Å; R363-E367 WeakPolarHBondContact CD-OE1 3.49Å; R363-E367 HydrophobicContact CG-CG 4.42Å; R363-E367 WeakPolarHBondContact CG-OE1 3.35Å; R363-E367 WeakPolarHBondContact O-CG 3.44Å; R363-E367 PolarHBondContact O-N 3.26Å
364	T	87.7	Confident	87.9	Confident	17 Å²	17	72.9 Å²	72.9	10%	0.104	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-45.2	-178.1	-52	0	0	0	0	112	I339 F347 F353 M356 Q360 R361 K366 E367 Q368	I339-T364 HydrophobicContact CD1-CG2 3.68Å; I339-T364 HydrophobicContact CG1-CG2 3.78Å; F347-T364 HydrophobicContact CZ-CG2 4.31Å; F353-T364 HydrophobicContact CD2-CG2 4.43Å; M356-T364 HydrophobicContact CE-CG2 4.43Å; M356-T364 HydrophobicContact SD-CG2 4.45Å; M356-T364 PolarHBondContact SD-OG1 3.46Å; Q360-T364 WeakPolarHBondContact O-CB 3.28Å; Q360-T364 PolarHBondContact O-N 3.08Å; Q360-T364 PolarHBondContact O-OG1 2.81Å; R361-T364 PolarHBondContact O-N 3.47Å; T364-K366 VanDerWaalsContact C-N 3.33Å; T364-K366 PolarHBondContact O-N 3.08Å; T364-E367 PolarHBondContact O-N 3.5Å; T364-Q368 HydrophobicContact CG2-CG 4.22Å; T364-Q368 VanDerWaalsContact O-CB 3.28Å; T364-Q368 WeakPolarHBondContact O-CB 3.46Å; T364-Q368 VanDerWaalsContact O-CG 3.25Å; T364-Q368 WeakPolarHBondContact O-CG 3.24Å; T364-Q368 PolarHBondContact O-N 3.45Å
365	V	88.7	Confident	87.8	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.5	-37.8	178.8	167.4	0	0	0	0	111.7	F347 F353 R361 R363 R369 V370 F372 L375 L404	F347-V365 HydrophobicContact CE1-CG2 4.13Å; F353-V365 HydrophobicContact CE2-CG2 3.78Å; F353-V365 HydrophobicContact CZ-CG2 3.61Å; R361-V365 WeakPolarHBondContact O-CB 3.31Å; R361-V365 VanDerWaalsContact O-CG2 3.3Å; R361-V365 WeakPolarHBondContact O-CG2 3.24Å; R361-V365 PolarHBondContact O-N 3.27Å; R363-V365 PolarHBondContact O-N 2.93Å; V365-R369 PolarHBondContact O-N 2.86Å; V365-V370 HydrophobicContact CB-CG2 4.01Å; V365-V370 HydrophobicContact CG1-CG2 3.67Å; V365-V370 HydrophobicContact CG2-CG2 4.06Å; V365-V370 PolarHBondContact O-N 3.23Å; V365-F372 HydrophobicContact CG1-CD1 3.28Å; V365-F372 HydrophobicContact CG1-CE1 3.67Å; V365-F372 HydrophobicContact CG1-CG 4.38Å; V365-L375 HydrophobicContact CG1-CD2 4.14Å; V365-L375 HydrophobicContact CG2-CD2 3.75Å; V365-L404 HydrophobicContact CG1-CD1 4.1Å; V365-L404 HydrophobicContact CG2-CD1 4.35Å; V365-L404 HydrophobicContact CG2-CD2 4.02Å
366	K	86.1	Confident	87.5	Confident	130 Å²	130	64 Å²	64	57%	0.565	29%	0.286	S	S	*	.	H	α-helix	trans	-68.9	-45.7	175.6	-74.9	178	179.9	-176	0	112.2	W362 R363 T364 R369 F372	W362-K366 WeakPolarHBondContact O-CG 3.4Å; W362-K366 PolarHBondContact O-N 3.34Å; R363-K366 PolarHBondContact O-N 3.5Å; R363-K366 VanDerWaalsContact O-N 3.17Å; T364-K366 VanDerWaalsContact C-N 3.33Å; T364-K366 PolarHBondContact O-N 3.08Å; K366-R369 PolarHBondContact O-N 3.45Å; K366-F372 HydrophobicContact CG-CE1 4.25Å; K366-F372 HydrophobicContact CG-CZ 4.07Å
367	E	84.6	Confident	87	Confident	130 Å²	130	67.7 Å²	67.7	61%	0.607	30%	0.3	S	S	*	.	H	α-helix	trans	-63.5	-43.1	179	-74.6	167.2	-179.7	0	0	111.4	R363 T364 R369	R363-E367 WeakPolarHBondContact CD-OE1 3.49Å; R363-E367 HydrophobicContact CG-CG 4.42Å; R363-E367 WeakPolarHBondContact CG-OE1 3.35Å; R363-E367 WeakPolarHBondContact O-CG 3.44Å; R363-E367 PolarHBondContact O-N 3.26Å; T364-E367 PolarHBondContact O-N 3.5Å; E367-R369 PolarHBondContact O-N 3.4Å
368	Q	82.8	Confident	86.4	Confident	58 Å²	58	67.4 Å²	67.4	27%	0.271	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-3.2	179.8	-64	-60.9	-26.9	0	0	114.1	P338 F347 T364 V370 K377	P338-Q368 HydrophobicContact CB-CG 4.28Å; F347-Q368 HydrophobicContact CE2-CB 4.12Å; F347-Q368 HydrophobicContact CE2-CG 4.25Å; F347-Q368 HydrophobicContact CZ-CB 3.89Å; F347-Q368 HydrophobicContact CZ-CG 3.94Å; T364-Q368 HydrophobicContact CG2-CG 4.22Å; T364-Q368 VanDerWaalsContact O-CB 3.28Å; T364-Q368 WeakPolarHBondContact O-CB 3.46Å; T364-Q368 VanDerWaalsContact O-CG 3.25Å; T364-Q368 WeakPolarHBondContact O-CG 3.24Å; T364-Q368 PolarHBondContact O-N 3.45Å; Q368-V370 VanDerWaalsContact C-N 3.25Å; Q368-V370 HydrophobicContact CB-CG1 4.49Å; Q368-V370 PolarHBondContact O-N 3.23Å; Q368-K377 VanDerWaalsContact O-CE 3.31Å; Q368-K377 WeakPolarHBondContact O-CE 3.36Å
369	R	82.9	Confident	86.1	Confident	215 Å²	215	69 Å²	69	81%	0.811	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	41.3	179	-59.5	-174.6	179.1	-174.7	0.7	113.8	V365 K366 E367	V365-R369 PolarHBondContact O-N 2.86Å; K366-R369 PolarHBondContact O-N 3.45Å; E367-R369 PolarHBondContact O-N 3.4Å
370	V	86.6	Confident	85.7	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.03	32%	0.315	C	S	.	.			trans	-90.4	153.4	173.9	-71.1	0	0	0	0	110.9	F347 V365 Q368 F372 K377	F347-V370 HydrophobicContact CD2-CG1 4.21Å; F347-V370 HydrophobicContact CE1-CG2 4.13Å; F347-V370 HydrophobicContact CE2-CG1 4.06Å; F347-V370 HydrophobicContact CZ-CG1 4.43Å; F347-V370 HydrophobicContact CZ-CG2 4.13Å; V365-V370 HydrophobicContact CB-CG2 4.01Å; V365-V370 HydrophobicContact CG1-CG2 3.67Å; V365-V370 HydrophobicContact CG2-CG2 4.06Å; V365-V370 PolarHBondContact O-N 3.23Å; Q368-V370 VanDerWaalsContact C-N 3.25Å; Q368-V370 HydrophobicContact CB-CG1 4.49Å; Q368-V370 PolarHBondContact O-N 3.23Å; V370-F372 WeakPolarHBondContact O-CD1 3.41Å; V370-F372 PolarHBondContact O-N 2.92Å; V370-K377 HydrophobicContact CG1-CG 3.52Å
371	C	87.3	Confident	85	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.014	31%	0.307	C	S	.	.			trans	-58.3	129.6	175.9	176.3	0	0	0	0	110.7	I373 C374 L375 Q376 H379 C384	C371-I373 PolarHBondContact O-N 2.82Å; C371-I373 PolarHBondContact SG-N 3.14Å; C371-C374 VanDerWaalsContact CB-SG 3.58Å; C371-L375 WeakPolarHBondContact O-CA 3.08Å; C371-L375 PolarHBondContact O-N 3.1Å; C371-Q376 WeakPolarHBondContact CB-O 3.49Å; C371-Q376 PolarHBondContact N-O 2.96Å; C371-H379 PolarHBondContact SG-NE2 3.28Å; C371-C384 VanDerWaalsContact SG-SG 3.68Å
372	F	89.3	Confident	84.2	Confident	69 Å²	69	65.1 Å²	65.1	30%	0.303	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-14.8	-176.7	-52	-26.2	0	0	0	113	W362 V365 K366 V370 S381 H400 H401 L404	W362-F372 HydrophobicContact CZ3-CD2 4.23Å; W362-F372 HydrophobicContact CZ3-CG 4.32Å; V365-F372 HydrophobicContact CG1-CD1 3.28Å; V365-F372 HydrophobicContact CG1-CE1 3.67Å; V365-F372 HydrophobicContact CG1-CG 4.38Å; K366-F372 HydrophobicContact CG-CE1 4.25Å; K366-F372 HydrophobicContact CG-CZ 4.07Å; V370-F372 WeakPolarHBondContact O-CD1 3.41Å; V370-F372 PolarHBondContact O-N 2.92Å; F372-S381 VanDerWaalsContact CB-OG 3.3Å; F372-S381 WeakPolarHBondContact CB-OG 3.43Å; F372-S381 PolarHBondContact N-OG 3.11Å; F372-H400 CarbonylContact O-C 3.57Å; F372-H400 VanDerWaalsContact O-CA 3.27Å; F372-H400 WeakPolarHBondContact O-CA 3.31Å; F372-H401 WeakPolarHBondContact O-CB 3.4Å; F372-H401 PolarHBondContact O-N 3.24Å; F372-L404 HydrophobicContact CB-CD1 4.43Å
373	I	87.6	Confident	83.4	Confident	11 Å²	11	72.5 Å²	72.5	6%	0.056	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-51.7	-176.9	-64	174.7	0	0	0	110.8	C371 S381 C384 A386 G389 L399 H401	C371-I373 PolarHBondContact O-N 2.82Å; C371-I373 PolarHBondContact SG-N 3.14Å; I373-S381 VanDerWaalsContact CD1-O 3.26Å; I373-S381 WeakPolarHBondContact CD1-O 3.27Å; I373-C384 HydrophobicContact CB-CB 4.3Å; I373-C384 HydrophobicContact CD1-CB 4.05Å; I373-A386 HydrophobicContact CG2-CB 4.47Å; I373-G389 WeakPolarHBondContact CG2-O 3.42Å; I373-L399 HydrophobicContact CD1-CB 4.17Å; I373-L399 HydrophobicContact CG1-CB 4.38Å; I373-H401 WeakPolarHBondContact O-CB 3.07Å; I373-H401 PolarHBondContact O-CD2 3.13Å; I373-H401 VanDerWaalsContact O-CD2 3.29Å
374	C	86.9	Confident	83.1	Confident	28 Å²	28	66.5 Å²	66.5	19%	0.189	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-3.1	-176.4	64.8	0	0	0	0	114.4	H346 C371 Q376 H379 C384	H346-C374 PolarHBondContact CE1-O 3.23Å; C371-C374 VanDerWaalsContact CB-SG 3.58Å; C374-Q376 PolarHBondContact O-N 3.44Å; C374-H379 PolarHBondContact SG-CE1 2.91Å; C374-H379 PolarHBondContact SG-NE2 3.29Å; C374-C384 VanDerWaalsContact SG-SG 3.64Å
375	L	85.9	Confident	82.5	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.378	C	S	.	.			trans	59	26.6	-177.4	-52.3	179.8	0	0	0	114.3	F347 A348 F353 V365 C371 H401 L403 L404	F347-L375 HydrophobicContact CB-CB 4.21Å; F347-L375 VanDerWaalsContact CB-O 3.32Å; F347-L375 WeakPolarHBondContact CB-O 3.4Å; F347-L375 HydrophobicContact CD1-CB 4.32Å; A348-L375 HydrophobicContact CB-CD1 4.16Å; F353-L375 HydrophobicContact CE1-CD1 3.76Å; F353-L375 HydrophobicContact CZ-CD1 4.27Å; V365-L375 HydrophobicContact CG1-CD2 4.14Å; V365-L375 HydrophobicContact CG2-CD2 3.75Å; C371-L375 WeakPolarHBondContact O-CA 3.08Å; C371-L375 PolarHBondContact O-N 3.1Å; L375-H401 HydrophobicContact CD1-CB 4.1Å; L375-H401 HydrophobicContact CD2-CB 4.01Å; L375-H401 HydrophobicContact CG-CB 3.85Å; L375-L403 HydrophobicContact CD1-CD1 4.29Å; L375-L404 HydrophobicContact CD2-CD1 4.03Å
376	Q	81.1	Confident	81.5	Confident	78 Å²	78	77.3 Å²	77.3	36%	0.364	40%	0.399	S	S	.	.			trans	-103	150.2	176.6	-74.2	-69.1	-68.7	0	0	112.9	H346 C371 C374	H346-Q376 PolarHBondContact CD2-NE2 3.4Å; H346-Q376 PolarHBondContact CE1-NE2 3.33Å; H346-Q376 VanDerWaalsContact CE1-NE2 3.32Å; H346-Q376 VanDerWaalsContact NE2-CG 3.3Å; H346-Q376 WeakPolarHBondContact NE2-CG 3.44Å; H346-Q376 PolarHBondContact NE2-NE2 2.95Å; C371-Q376 WeakPolarHBondContact CB-O 3.49Å; C371-Q376 PolarHBondContact N-O 2.96Å; C374-Q376 PolarHBondContact O-N 3.44Å
377	K	79.4	Confident	80	Confident	115 Å²	115	78.4 Å²	78.4	50%	0.5	41%	0.406	S	S	.	.	S	Bend	trans	-77.7	167.3	170.2	-71	-167.7	174.6	179.2	0	110.7	Q368 V370	Q368-K377 VanDerWaalsContact O-CE 3.31Å; Q368-K377 WeakPolarHBondContact O-CE 3.36Å; V370-K377 HydrophobicContact CG1-CG 3.52Å
378	G	75.7	Confident	78.7	Confident	83 Å²	83	80 Å²	80	86%	0.856	42%	0.419	S	S	*	.	S	Bend	trans	96.2	-16.9	172.2	0	0	0	0	0	115.7
379	H	82.1	Confident	77.4	Confident	66 Å²	66	78.2 Å²	78.2	31%	0.306	42%	0.415	S	S	.	.	S	Bend	trans	-147.8	162.3	177.6	64.9	-84	0	0	0	112.6	C371 C374 C384	C371-H379 PolarHBondContact SG-NE2 3.28Å; C374-H379 PolarHBondContact SG-CE1 2.91Å; C374-H379 PolarHBondContact SG-NE2 3.29Å; H379-C384 PolarHBondContact NE2-SG 3.22Å
380	S	81.4	Confident	76.7	Confident	60 Å²	60	76 Å²	76	42%	0.42	41%	0.407	S	S	.	.			trans	-93.7	161.6	175.2	70.4	0	0	0	0	111.6	A382 R383 C384	S380-A382 PolarHBondContact O-N 3.03Å; S380-A382 VanDerWaalsContact O-N 3.07Å; S380-R383 CarbonylContact O-C 3.51Å; S380-R383 PolarHBondContact O-N 3.17Å; S380-C384 PolarHBondContact O-N 3.01Å; S380-C384 VanDerWaalsContact O-N 3.14Å
381	S	77	Confident	76.3	Confident	30 Å²	30	76.2 Å²	76.2	21%	0.21	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-54.5	-29.2	174.7	-58.5	0	0	0	0	113.5	F372 I373 R383	F372-S381 VanDerWaalsContact CB-OG 3.3Å; F372-S381 WeakPolarHBondContact CB-OG 3.43Å; F372-S381 PolarHBondContact N-OG 3.11Å; I373-S381 VanDerWaalsContact CD1-O 3.26Å; I373-S381 WeakPolarHBondContact CD1-O 3.27Å; S381-R383 VanDerWaalsContact C-N 3.28Å; S381-R383 PolarHBondContact O-N 2.65Å
382	A	75	Confident	75.8	Confident	90 Å²	90	81 Å²	81	74%	0.744	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-72.2	-20.4	177.6	0	0	0	0	0	113.6	S380	S380-A382 PolarHBondContact O-N 3.03Å; S380-A382 VanDerWaalsContact O-N 3.07Å
383	R	76.4	Confident	75.2	Confident	205 Å²	205	81 Å²	81	77%	0.774	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-115	12.9	-180	-61.6	-173.3	-177.5	-178.4	0.5	112.4	S380 S381 E385	S380-R383 CarbonylContact O-C 3.51Å; S380-R383 PolarHBondContact O-N 3.17Å; S381-R383 VanDerWaalsContact C-N 3.28Å; S381-R383 PolarHBondContact O-N 2.65Å; R383-E385 PolarHBondContact O-N 3.02Å
384	C	80.2	Confident	74.7	Confident	4 Å²	4	87.4 Å²	87.4	3%	0.027	48%	0.48	C	S	.	.			trans	-74.3	118.8	179.6	-167.4	0	0	0	0	109.5	C371 I373 C374 H379 S380 A386 Q387	C371-C384 VanDerWaalsContact SG-SG 3.68Å; I373-C384 HydrophobicContact CB-CB 4.3Å; I373-C384 HydrophobicContact CD1-CB 4.05Å; C374-C384 VanDerWaalsContact SG-SG 3.64Å; H379-C384 PolarHBondContact NE2-SG 3.22Å; S380-C384 PolarHBondContact O-N 3.01Å; S380-C384 VanDerWaalsContact O-N 3.14Å; C384-A386 PolarHBondContact O-N 3.28Å; C384-Q387 WeakPolarHBondContact O-CG 3.45Å; C384-Q387 PolarHBondContact O-N 3.4Å
385	E	75.1	Confident	74	Confident	193 Å²	193	89.9 Å²	89.9	90%	0.902	51%	0.511	S	S	*	.	S	Bend	trans	-68.3	-18.6	176.8	-67.2	-177.6	172.6	0	0	112.8	R383 Q387	R383-E385 PolarHBondContact O-N 3.02Å; E385-Q387 PolarHBondContact O-N 3.49Å
386	A	68.3	Low	73.6	Confident	51 Å²	51	91 Å²	91	42%	0.421	52%	0.518	S	S	.	.			trans	-70.4	49.8	164.5	0	0	0	0	0	110.7	I373 C384 N388 G389	I373-A386 HydrophobicContact CG2-CB 4.47Å; C384-A386 PolarHBondContact O-N 3.28Å; A386-N388 PolarHBondContact O-N 3.15Å; A386-N388 VanDerWaalsContact O-N 3.08Å; A386-G389 WeakPolarHBondContact O-CA 3.42Å; A386-G389 PolarHBondContact O-N 3.06Å
387	Q	55.5	Low	73.3	Confident	153 Å²	153	96.5 Å²	96.5	72%	0.715	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-20	-179.7	-84.2	-171.1	-9.4	0	0	113	C384 E385 G389	C384-Q387 WeakPolarHBondContact O-CG 3.45Å; C384-Q387 PolarHBondContact O-N 3.4Å; E385-Q387 PolarHBondContact O-N 3.49Å; Q387-G389 PolarHBondContact O-N 2.92Å
388	N	56.6	Low	73.3	Confident	164 Å²	164	97.4 Å²	97.4	88%	0.877	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-5.1	168.9	-72.2	-11.8	0	0	0	113.4	A386 R390	A386-N388 PolarHBondContact O-N 3.15Å; A386-N388 VanDerWaalsContact O-N 3.08Å; N388-R390 PolarHBondContact O-N 2.87Å
389	G	55.8	Low	73.6	Confident	20 Å²	20	98.2 Å²	98.2	21%	0.206	53%	0.531	C	S	.	.			trans	-76.8	40.3	-178.1	0	0	0	0	0	114.6	I373 A386 Q387	I373-G389 WeakPolarHBondContact CG2-O 3.42Å; A386-G389 WeakPolarHBondContact O-CA 3.42Å; A386-G389 PolarHBondContact O-N 3.06Å; Q387-G389 PolarHBondContact O-N 2.92Å
390	R	68.1	Low	73.9	Confident	170 Å²	170	95.7 Å²	95.7	64%	0.642	52%	0.519	S	S	*	.	S	Bend	trans	-59.6	149.4	154.7	-61.6	178.9	-174.1	179.4	2.6	107.3	N388 T392 L399	N388-R390 PolarHBondContact O-N 2.87Å; R390-T392 PolarHBondContact O-N 3.07Å; R390-T392 VanDerWaalsContact O-N 3.12Å; R390-L399 HydrophobicContact CG-CD2 3.88Å
391	C	78.8	Confident	74.2	Confident	8 Å²	8	94.5 Å²	94.5	5%	0.054	51%	0.507	C	S	.	.			trans	-53	125.9	173	-173.1	0	0	0	0	109.6	I393 C396 Q398 H400 H405	C391-I393 PolarHBondContact O-N 3.36Å; C391-C396 HydrophobicContact CB-CB 3.71Å; C391-C396 WeakPolarHBondContact CB-SG 3.42Å; C391-Q398 PolarHBondContact N-O 3.23Å; C391-H400 WeakPolarHBondContact CA-O 3.38Å; C391-H400 WeakPolarHBondContact CB-NE2 3.38Å; C391-H405 PolarHBondContact SG-ND1 3.47Å
392	T	75.5	Confident	74.7	Confident	102 Å²	102	98 Å²	98	63%	0.626	52%	0.52	S	S	*	.			trans	-72.4	-8.1	-178.1	45.5	0	0	0	0	113	R390 Q402	R390-T392 PolarHBondContact O-N 3.07Å; R390-T392 VanDerWaalsContact O-N 3.12Å; T392-Q402 PolarHBondContact OG1-OE1 3.05Å; T392-Q402 VanDerWaalsContact OG1-OE1 3.09Å
393	I	77.9	Confident	75.3	Confident	70 Å²	70	95.2 Å²	95.2	36%	0.359	49%	0.493	S	S	.	.	S	Bend	trans	-76.4	127.3	179.3	-66.4	175.4	0	0	0	110.2	C391 G395 C396 H405	C391-I393 PolarHBondContact O-N 3.36Å; I393-G395 PolarHBondContact O-N 3.35Å; I393-C396 VanDerWaalsContact O-CB 3.3Å; I393-C396 WeakPolarHBondContact O-CB 3.41Å; I393-C396 PolarHBondContact O-N 3.22Å; I393-H405 HydrophobicContact CD1-CB 3.55Å; I393-H405 VanDerWaalsContact CD1-CD2 3.44Å; I393-H405 WeakPolarHBondContact CD1-CD2 3.45Å
394	T	76.1	Confident	75.9	Confident	145 Å²	145	85.5 Å²	85.5	89%	0.89	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	124	-177.7	-19.1	0	0	0	0	111.4
395	G	71.8	Confident	76.2	Confident	81 Å²	81	87.1 Å²	87.1	84%	0.835	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	-9.1	-178.5	0	0	0	0	0	115.1	I393	I393-G395 PolarHBondContact O-N 3.35Å
396	C	78.7	Confident	76.6	Confident	22 Å²	22	84.6 Å²	84.6	15%	0.149	45%	0.446	C	S	.	.			trans	-87.7	121.6	172.2	-164	0	0	0	0	111.5	C391 I393 H400 H405	C391-C396 HydrophobicContact CB-CB 3.71Å; C391-C396 WeakPolarHBondContact CB-SG 3.42Å; I393-C396 VanDerWaalsContact O-CB 3.3Å; I393-C396 WeakPolarHBondContact O-CB 3.41Å; I393-C396 PolarHBondContact O-N 3.22Å; C396-H400 PolarHBondContact SG-NE2 3.03Å; C396-H400 VanDerWaalsContact SG-NE2 3.37Å; C396-H405 WeakPolarHBondContact CB-CE1 3.47Å; C396-H405 PolarHBondContact SG-CE1 3.25Å; C396-H405 PolarHBondContact SG-ND1 3.35Å; C396-H405 VanDerWaalsContact SG-ND1 3.41Å
397	K	74.4	Confident	76.3	Confident	194 Å²	194	84.6 Å²	84.6	84%	0.843	45%	0.452	S	S	*	.			trans	-103.8	9.8	174.8	-60.8	-175.6	-178.3	179.9	0	113.2
398	Q	79.3	Confident	75.9	Confident	134 Å²	134	87.1 Å²	87.1	63%	0.626	46%	0.46	S	S	*	.	S	Bend	trans	-85.1	152.4	-174.8	-62.3	-64.1	-33.9	0	0	111.8	C391 H400	C391-Q398 PolarHBondContact N-O 3.23Å; Q398-H400 PolarHBondContact O-N 3.3Å
399	L	82.2	Confident	74.9	Confident	100 Å²	100	85.1 Å²	85.1	52%	0.524	45%	0.453	S	S	.	.	S	Bend	trans	-92.7	84.2	179.8	-66.5	174.2	0	0	0	110.7	I373 R390	I373-L399 HydrophobicContact CD1-CB 4.17Å; I373-L399 HydrophobicContact CG1-CB 4.38Å; R390-L399 HydrophobicContact CG-CD2 3.88Å
400	H	87.5	Confident	73.7	Confident	13 Å²	13	91.4 Å²	91.4	6%	0.06	48%	0.482	C	S	.	.	S	Bend	trans	-159.2	158.1	178	67.1	146.3	0	0	0	111.1	W362 F372 C391 C396 Q398 L404 H405	W362-H400 HydrophobicContact CH2-CB 4.16Å; W362-H400 HydrophobicContact CZ2-CB 4.27Å; W362-H400 AromaticContact CZ2-ND1 3.58Å; F372-H400 CarbonylContact O-C 3.57Å; F372-H400 VanDerWaalsContact O-CA 3.27Å; F372-H400 WeakPolarHBondContact O-CA 3.31Å; C391-H400 WeakPolarHBondContact CA-O 3.38Å; C391-H400 WeakPolarHBondContact CB-NE2 3.38Å; C396-H400 PolarHBondContact SG-NE2 3.03Å; C396-H400 VanDerWaalsContact SG-NE2 3.37Å; Q398-H400 PolarHBondContact O-N 3.3Å; H400-L404 HydrophobicContact CB-CB 4.47Å; H400-L404 PolarHBondContact ND1-O 2.9Å; H400-H405 AromaticContact CE1-ND1 3.79Å; H400-H405 AromaticContact NE2-ND1 3.7Å
401	H	88	Confident	71.8	Confident	35 Å²	35	92.5 Å²	92.5	16%	0.162	49%	0.492	C	S	.	.			trans	-65	143.7	176.3	-166.7	-93.2	0	0	0	110.5	F372 I373 L375 L403 L404	F372-H401 WeakPolarHBondContact O-CB 3.4Å; F372-H401 PolarHBondContact O-N 3.24Å; I373-H401 WeakPolarHBondContact O-CB 3.07Å; I373-H401 PolarHBondContact O-CD2 3.13Å; I373-H401 VanDerWaalsContact O-CD2 3.29Å; L375-H401 HydrophobicContact CD1-CB 4.1Å; L375-H401 HydrophobicContact CD2-CB 4.01Å; L375-H401 HydrophobicContact CG-CB 3.85Å; H401-L403 PolarHBondContact ND1-N 3.46Å; H401-L403 PolarHBondContact O-N 3.38Å; H401-L403 VanDerWaalsContact O-N 3.13Å; H401-L404 WeakPolarHBondContact O-CA 3.34Å; H401-L404 WeakPolarHBondContact O-CB 3.49Å; H401-L404 PolarHBondContact O-N 3.11Å
402	Q	87	Confident	69.3	Low	104 Å²	104	102.9 Å²	102.9	49%	0.486	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-53.5	-35.1	-179.3	60.7	-176.1	-9.5	0	0	114.2	T392 L404 H405	T392-Q402 PolarHBondContact OG1-OE1 3.05Å; T392-Q402 VanDerWaalsContact OG1-OE1 3.09Å; Q402-L404 PolarHBondContact O-N 3.02Å; Q402-L404 VanDerWaalsContact O-N 3.14Å; Q402-H405 VanDerWaalsContact O-CB 3.22Å; Q402-H405 WeakPolarHBondContact O-CB 3.36Å; Q402-H405 PolarHBondContact O-N 2.92Å
403	L	87.6	Confident	66.9	Low	32 Å²	32	103.4 Å²	103.4	17%	0.168	54%	0.537	C	S	.	.	G	3₁₀ helix	trans	-64.6	-16.9	177.2	-64.8	175	0	0	0	113.6	A348 F353 L354 R361 L375 H401	A348-L403 HydrophobicContact CB-CD1 4.3Å; F353-L403 HydrophobicContact CD1-CD1 4.16Å; F353-L403 HydrophobicContact CE1-CB 4.22Å; F353-L403 HydrophobicContact CE1-CD1 3.94Å; L354-L403 HydrophobicContact CD2-CD1 3.76Å; L354-L403 HydrophobicContact CD2-CD2 3.7Å; L354-L403 HydrophobicContact CD2-CG 4.4Å; R361-L403 WeakPolarHBondContact CD-O 3.43Å; R361-L403 PolarHBondContact NH1-O 3.4Å; L375-L403 HydrophobicContact CD1-CD1 4.29Å; H401-L403 PolarHBondContact ND1-N 3.46Å; H401-L403 PolarHBondContact O-N 3.38Å; H401-L403 VanDerWaalsContact O-N 3.13Å
404	L	88.9	Confident	64.3	Low	0 Å²	0	108.4 Å²	108.4	0%	0	55%	0.553	C	S	.	*	G	3₁₀ helix	trans	-95.9	4.5	176.2	-61.5	179	0	0	0	112.6	F353 R361 W362 V365 F372 L375 H400 H401 Q402	F353-L404 HydrophobicContact CZ-CD2 4.31Å; R361-L404 HydrophobicContact CB-CD2 3.72Å; W362-L404 HydrophobicContact CD2-CB 4.44Å; W362-L404 HydrophobicContact CD2-CD2 4.33Å; W362-L404 HydrophobicContact CE3-CD1 4.45Å; W362-L404 HydrophobicContact CG-CD2 4.28Å; W362-L404 HydrophobicContact CH2-CD1 4.41Å; W362-L404 HydrophobicContact CZ2-CB 3.98Å; W362-L404 HydrophobicContact CZ2-CD1 4.48Å; W362-L404 HydrophobicContact CZ3-CD1 4.39Å; W362-L404 PolarHBondContact NE1-O 3.43Å; V365-L404 HydrophobicContact CG1-CD1 4.1Å; V365-L404 HydrophobicContact CG2-CD1 4.35Å; V365-L404 HydrophobicContact CG2-CD2 4.02Å; F372-L404 HydrophobicContact CB-CD1 4.43Å; L375-L404 HydrophobicContact CD2-CD1 4.03Å; H400-L404 HydrophobicContact CB-CB 4.47Å; H400-L404 PolarHBondContact ND1-O 2.9Å; H401-L404 WeakPolarHBondContact O-CA 3.34Å; H401-L404 WeakPolarHBondContact O-CB 3.49Å; H401-L404 PolarHBondContact O-N 3.11Å; Q402-L404 PolarHBondContact O-N 3.02Å; Q402-L404 VanDerWaalsContact O-N 3.14Å
405	H	88.2	Confident	61.8	Low	39 Å²	39	108.9 Å²	108.9	18%	0.181	55%	0.55	C	S	.	*			trans	-76.6	127.5	179.3	-166.2	82.3	0	0	0	111.8	V358 C391 I393 C396 H400 Q402 G407	V358-H405 WeakPolarHBondContact CG2-O 3.31Å; C391-H405 PolarHBondContact SG-ND1 3.47Å; I393-H405 HydrophobicContact CD1-CB 3.55Å; I393-H405 VanDerWaalsContact CD1-CD2 3.44Å; I393-H405 WeakPolarHBondContact CD1-CD2 3.45Å; C396-H405 WeakPolarHBondContact CB-CE1 3.47Å; C396-H405 PolarHBondContact SG-CE1 3.25Å; C396-H405 PolarHBondContact SG-ND1 3.35Å; C396-H405 VanDerWaalsContact SG-ND1 3.41Å; H400-H405 AromaticContact CE1-ND1 3.79Å; H400-H405 AromaticContact NE2-ND1 3.7Å; Q402-H405 VanDerWaalsContact O-CB 3.22Å; Q402-H405 WeakPolarHBondContact O-CB 3.36Å; Q402-H405 PolarHBondContact O-N 2.92Å; H405-G407 PolarHBondContact O-N 2.83Å; H405-G407 VanDerWaalsContact O-N 3.07Å
406	Y	82.1	Confident	59.5	Low	139 Å²	139	108.4 Å²	108.4	55%	0.545	55%	0.545	S	S	.	.			trans	-74.3	96.5	166.9	-69.2	-79.9	0	0	0	107.6	V358 W362 K408	V358-Y406 HydrophobicContact CB-CD1 4.07Å; V358-Y406 HydrophobicContact CB-CE1 4.07Å; V358-Y406 HydrophobicContact CG1-CD1 3.6Å; V358-Y406 HydrophobicContact CG1-CD2 4.21Å; V358-Y406 HydrophobicContact CG1-CE1 3.62Å; V358-Y406 HydrophobicContact CG1-CE2 4.23Å; V358-Y406 HydrophobicContact CG1-CG 3.91Å; W362-Y406 AromaticContact CD1-CE2 3.65Å; W362-Y406 AromaticContact CD1-CZ 3.67Å; W362-Y406 AromaticContact NE1-CE2 3.42Å; W362-Y406 AromaticContact NE1-CZ 3.95Å; Y406-K408 PolarHBondContact O-N 2.87Å
407	G	62.7	Low	57	Low	52 Å²	52	112 Å²	112	54%	0.536	57%	0.566	S	S	.	*			trans	-52.9	133.5	168	0	0	0	0	0	109.4	H405 V409	H405-G407 PolarHBondContact O-N 2.83Å; H405-G407 VanDerWaalsContact O-N 3.07Å; G407-V409 PolarHBondContact O-N 2.59Å
408	K	45.6	Very low	54.6	Low	205 Å²	205	108.1 Å²	108.1	89%	0.891	56%	0.564	S	S	*	*			trans	-57.1	113.7	167.3	-85.3	-176.4	176	179	0	106.3	Y406 D410	Y406-K408 PolarHBondContact O-N 2.87Å; K408-D410 PolarHBondContact O-N 2.82Å
409	V	37	Very low	52.3	Low	122 Å²	122	107.7 Å²	107.7	74%	0.739	57%	0.572	S	S	*	*			trans	-44.4	107.7	-178.4	-179	0	0	0	0	109.8	G407 K411	G407-V409 PolarHBondContact O-N 2.59Å; V409-K411 VanDerWaalsContact C-N 3.33Å; V409-K411 HydrophobicContact CG1-CG 4.09Å; V409-K411 PolarHBondContact O-N 3.28Å
410	D	30.5	Very low	49.6	Very low	152 Å²	152	112.3 Å²	112.3	81%	0.813	59%	0.588	S	S	*	*			trans	-62.6	100.3	162.2	-87	-40.7	0	0	0	106.9	K408 R412	K408-D410 PolarHBondContact O-N 2.82Å; D410-R412 PolarHBondContact O-N 3.46Å
411	K	28	Very low	46.6	Very low	194 Å²	194	121.5 Å²	121.5	84%	0.843	63%	0.628	S	S	*	*			trans	-74.3	22.3	177.7	-81.3	-171.1	173.4	-176.9	0	112.9	V409	V409-K411 VanDerWaalsContact C-N 3.33Å; V409-K411 HydrophobicContact CG1-CG 4.09Å; V409-K411 PolarHBondContact O-N 3.28Å
412	R	26.1	Very low	43.8	Very low	226 Å²	226	128.5 Å²	128.5	85%	0.853	66%	0.661	S	S	*	*			trans	-142.2	124.2	-174.8	-67.4	-175.9	175.6	178.4	-2.2	109.9	D410	D410-R412 PolarHBondContact O-N 3.46Å
413	S	24.5	Very low	40.8	Very low	112 Å²	112	129.4 Å²	129.4	78%	0.783	68%	0.679	S	S	*	*			trans	84	112.3	-174.5	-164.7	0	0	0	0	112
414	Y	23	Very low	38	Very low	175 Å²	175	135.6 Å²	135.6	69%	0.686	71%	0.711	S	S	*	*				-151.2	115.6	55.2	-165.1	-107.4	0	0	0	110.6	V417	Y414-V417 HydrophobicContact CE1-CB 4.34Å; Y414-V417 HydrophobicContact CE1-CG2 4.39Å
415	N	25.4	Very low	35	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	75%	0.751	S	S	*	*			trans	-64.9	149.3	156.4	-89.9	-22.8	0	0	0	108.8
416	G	23.2	Very low	32.2	Very low	70 Å²	70	145.1 Å²	145.1	72%	0.722	77%	0.773	S	S	*	*			trans	-56.2	145.4	-162.3	0	0	0	0	0	116.7
417	V	26.2	Very low	29.6	Very low	99 Å²	99	146.2 Å²	146.2	60%	0.6	79%	0.788	S	S	*	*			trans	-140.4	110.8	140.6	-178	0	0	0	0	105.8	Y414 P419	Y414-V417 HydrophobicContact CE1-CB 4.34Å; Y414-V417 HydrophobicContact CE1-CG2 4.39Å; V417-P419 VanDerWaalsContact O-CD 3.24Å; V417-P419 WeakPolarHBondContact O-CD 3.41Å
418	S	23.5	Very low	28.2	Very low	112 Å²	112	150.7 Å²	150.7	78%	0.783	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-62.7	118	169.2	-61.3	0	0	0	0	109.2	K420	S418-K420 PolarHBondContact O-N 2.91Å
419	P	30.1	Very low	27.4	Very low	124 Å²	124	150 Å²	150	81%	0.805	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-76	124.8	170.4	-9	27.2	0	0	0	108.4	V417	V417-P419 VanDerWaalsContact O-CD 3.24Å; V417-P419 WeakPolarHBondContact O-CD 3.41Å
420	K	25.9	Very low	27.2	Very low	197 Å²	197	153.8 Å²	153.8	86%	0.857	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-56.2	142.7	171.5	-76.8	173	173.3	176.5	0	110.2	S418 E422	S418-K420 PolarHBondContact O-N 2.91Å; K420-E422 PolarHBondContact O-N 3.37Å
421	K	25.1	Very low	27.2	Very low	207 Å²	207	152.2 Å²	152.2	90%	0.9	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-57.3	117.9	169.8	-71.6	173.3	174.3	177.4	0	109.6
422	E	28.7	Very low	27.4	Very low	181 Å²	181	147.7 Å²	147.7	85%	0.846	79%	0.791	S	S	*	*			trans	-118.5	126.9	156.4	-81.6	-177.6	175.3	0	0	108.9	K420 L424	K420-E422 PolarHBondContact O-N 3.37Å; E422-L424 PolarHBondContact O-N 3.46Å
423	S	24.8	Very low	27.6	Very low	124 Å²	124	143.4 Å²	143.4	87%	0.867	78%	0.784	S	S	*	*			trans	-71.6	109.8	-176.2	-46.2	0	0	0	0	109.5
424	L	28	Very low	28.2	Very low	162 Å²	162	147.2 Å²	147.2	85%	0.848	78%	0.782	S	S	*	*			trans	-119.1	108.8	163.5	-76.8	164.8	0	0	0	107.9	E422 D426	E422-L424 PolarHBondContact O-N 3.46Å; L424-D426 PolarHBondContact O-N 3.39Å
425	S	25.7	Very low	28.6	Very low	120 Å²	120	144.3 Å²	144.3	84%	0.839	77%	0.774	S	S	*	*			trans	-59.3	105.5	165.7	48.8	0	0	0	0	108.7
426	D	29	Very low	29	Very low	119 Å²	119	143.6 Å²	143.6	64%	0.636	77%	0.77	S	S	*	*			trans	-125.2	103.4	177.8	-142.8	11.4	0	0	0	109.5	L424 Q428	L424-D426 PolarHBondContact O-N 3.39Å; D426-Q428 HydrophobicContact CB-CG 4.33Å; D426-Q428 PolarHBondContact O-N 3.13Å; D426-Q428 PolarHBondContact OD2-NE2 3.43Å
427	N	27.8	Very low	29.4	Very low	162 Å²	162	147 Å²	147	87%	0.866	77%	0.767	S	S	*	*			trans	-66.6	82.3	170.2	-85.4	-24	0	0	0	108.4
428	Q	34.1	Very low	29.9	Very low	146 Å²	146	146.3 Å²	146.3	68%	0.682	76%	0.759	S	S	*	*			trans	-95.5	108.3	174.6	-68.3	-169.6	6	0	0	110.2	D426 R430	D426-Q428 HydrophobicContact CB-CG 4.33Å; D426-Q428 PolarHBondContact O-N 3.13Å; D426-Q428 PolarHBondContact OD2-NE2 3.43Å; Q428-R430 PolarHBondContact O-N 3.11Å
429	H	28	Very low	30.3	Very low	191 Å²	191	142.5 Å²	142.5	88%	0.884	74%	0.737	S	S	*	*			trans	-39.4	101.1	162.9	-77.5	-89.5	0	0	0	111.1	T431	H429-T431 PolarHBondContact O-N 3.18Å
430	R	32.7	Very low	30.7	Very low	200 Å²	200	140.5 Å²	140.5	76%	0.755	72%	0.723	S	S	*	*			trans	-78.9	110.3	168.3	-73.7	-173.9	176.5	-163.7	-0.5	108.3	Q428 A432 E435	Q428-R430 PolarHBondContact O-N 3.11Å; R430-A432 PolarHBondContact O-N 3.34Å; R430-E435 IonicContact NH1-OE2 2.67Å
431	T	30.3	Very low	31.3	Very low	120 Å²	120	133.1 Å²	133.1	74%	0.736	70%	0.698	S	S	*	*			trans	-44.5	124.2	156.7	47.9	0	0	0	0	108.8	H429 D433	H429-T431 PolarHBondContact O-N 3.18Å; T431-D433 PolarHBondContact O-N 3.21Å
432	A	32.3	Very low	32	Very low	99 Å²	99	131.4 Å²	131.4	82%	0.818	69%	0.691	S	S	*	*			trans	-71	67.5	-177.9	0	0	0	0	0	111.4	R430 R434	R430-A432 PolarHBondContact O-N 3.34Å; A432-R434 PolarHBondContact O-N 3.26Å
433	D	32.2	Very low	32.8	Very low	135 Å²	135	125.1 Å²	125.1	72%	0.722	67%	0.665	S	S	*	*			trans	-68.5	120.7	148.5	-155.9	6.6	0	0	0	104.8	T431 E435	T431-D433 PolarHBondContact O-N 3.21Å; D433-E435 PolarHBondContact O-N 2.91Å
434	R	35.5	Very low	34	Very low	192 Å²	192	126.8 Å²	126.8	73%	0.725	66%	0.664	S	S	*	*			trans	-70	74.5	-173.2	-77.6	176.4	156.4	161.3	-5.8	109.2	A432 L436	A432-R434 PolarHBondContact O-N 3.26Å; R434-L436 PolarHBondContact O-N 3.47Å
435	E	31.4	Very low	35.2	Very low	114 Å²	114	123.6 Å²	123.6	53%	0.533	65%	0.648	S	S	.	*			trans	-66.2	117.6	170.9	-72.2	-175	160.9	0	0	107.1	R430 D433 H437	R430-E435 IonicContact NH1-OE2 2.67Å; D433-E435 PolarHBondContact O-N 2.91Å; E435-H437 VanDerWaalsContact C-N 3.28Å; E435-H437 PolarHBondContact O-N 3.3Å
436	L	34.2	Very low	36.9	Very low	141 Å²	141	118.5 Å²	118.5	74%	0.738	62%	0.615	S	S	*	*			trans	-50.3	100.3	158.5	-179.7	76.9	0	0	0	106.6	R434 I438	R434-L436 PolarHBondContact O-N 3.47Å; L436-I438 HydrophobicContact CD2-CD1 4Å; L436-I438 HydrophobicContact CD2-CG1 3.77Å; L436-I438 HydrophobicContact CG-CG1 4Å; L436-I438 PolarHBondContact O-N 3Å
437	H	32.4	Very low	39	Very low	142 Å²	142	114 Å²	114	66%	0.657	59%	0.589	S	S	*	*			trans	-70.7	86.8	172.4	-75.6	-40	0	0	0	107.4	E435 G439	E435-H437 VanDerWaalsContact C-N 3.28Å; E435-H437 PolarHBondContact O-N 3.3Å; H437-G439 PolarHBondContact O-N 2.89Å
438	I	35.9	Very low	41.5	Very low	84 Å²	84	109.7 Å²	109.7	43%	0.431	57%	0.568	S	S	.	*			trans	-66.6	87.7	157.8	-57.8	174.5	0	0	0	104.8	L436 V440 L623	L436-I438 HydrophobicContact CD2-CD1 4Å; L436-I438 HydrophobicContact CD2-CG1 3.77Å; L436-I438 HydrophobicContact CG-CG1 4Å; L436-I438 PolarHBondContact O-N 3Å; I438-V440 PolarHBondContact O-N 3.46Å; I438-L623 HydrophobicContact CD1-CD2 3.95Å; I438-L623 HydrophobicContact CG1-CD2 4.42Å; I438-L623 HydrophobicContact CG2-CD2 3.75Å
439	G	33	Very low	44	Very low	32 Å²	32	103 Å²	103	33%	0.33	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	110.4	169.8	0	0	0	0	0	107.5	H437 A441 T624	H437-G439 PolarHBondContact O-N 2.89Å; G439-A441 VanDerWaalsContact C-N 3.31Å; G439-A441 PolarHBondContact O-N 3.38Å; G439-T624 PolarHBondContact O-OG1 3.18Å
440	V	37.2	Very low	47	Very low	83 Å²	83	98.6 Å²	98.6	50%	0.503	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	91.6	170.6	-179.4	0	0	0	0	106.7	I438 K442 T621	I438-V440 PolarHBondContact O-N 3.46Å; V440-K442 PolarHBondContact O-N 3.13Å; V440-T621 HydrophobicContact CG1-CG2 4.27Å; V440-T621 HydrophobicContact CG2-CG2 4.27Å
441	A	38.5	Very low	50	Low	42 Å²	42	90.7 Å²	90.7	35%	0.347	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	111.6	165.4	0	0	0	0	0	107.4	G439 T443 T624	G439-A441 VanDerWaalsContact C-N 3.31Å; G439-A441 PolarHBondContact O-N 3.38Å; A441-T443 VanDerWaalsContact C-N 3.3Å; A441-T443 HydrophobicContact CB-CG2 4.48Å; A441-T443 PolarHBondContact O-N 3.46Å; A441-T624 HydrophobicContact CB-CG2 4.29Å
442	K	41.5	Very low	53.1	Low	171 Å²	171	85.2 Å²	85.2	74%	0.743	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	95.3	166.8	-78.4	-178.1	176.9	179.6	0	107.6	V440 V619	V440-K442 PolarHBondContact O-N 3.13Å; K442-V619 HydrophobicContact CG-CG1 4.44Å
443	T	45.1	Very low	56.1	Low	49 Å²	49	80.5 Å²	80.5	30%	0.301	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	141.7	166.3	61.3	0	0	0	0	107.5	A441 D445 T622	A441-T443 VanDerWaalsContact C-N 3.3Å; A441-T443 HydrophobicContact CB-CG2 4.48Å; A441-T443 PolarHBondContact O-N 3.46Å; T443-D445 PolarHBondContact O-N 2.99Å; T443-T622 PolarHBondContact OG1-OG1 3.25Å
444	N	50	Low	59.1	Low	158 Å²	158	75.1 Å²	75.1	85%	0.845	39%	0.39	S	S	*	.	S	Bend	trans	-77.5	10	165.5	-77.1	-11.2	0	0	0	111.4
445	D	53.1	Low	62	Low	95 Å²	95	66 Å²	66	51%	0.508	36%	0.355	S	S	.	.	S	Bend	trans	-75.5	124.6	169.7	-90.8	5	0	0	0	107	T443 S620	T443-D445 PolarHBondContact O-N 2.99Å; D445-S620 WeakPolarHBondContact O-CB 3.49Å
446	G	61.1	Low	65.2	Low	14 Å²	14	64.2 Å²	64.2	14%	0.144	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-51.8	169.7	-174.1	0	0	0	0	0	114.8	V448 G613 S620	G446-V448 PolarHBondContact O-N 3.42Å; G446-G613 WeakPolarHBondContact CA-O 3.4Å; G446-S620 PolarHBondContact O-OG 3.38Å
447	K	72.3	Confident	68.3	Low	24 Å²	24	57.5 Å²	57.5	10%	0.104	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-61.2	134.7	-177.3	-167.8	170.8	-167.8	156.2	0	112.3	A545 T612 S620	K447-A545 VanDerWaalsContact CE-O 3.28Å; K447-A545 WeakPolarHBondContact CE-O 3.15Å; K447-A545 PolarHBondContact NZ-O 2.79Å; K447-T612 WeakPolarHBondContact CB-OG1 3.44Å; K447-T612 PolarHBondContact N-OG1 2.97Å; K447-T612 PolarHBondContact O-N 3.49Å; K447-T612 PolarHBondContact O-OG1 3.22Å; K447-S620 VanDerWaalsContact CA-OG 3.27Å; K447-S620 WeakPolarHBondContact CA-OG 3.4Å
448	V	81	Confident	71.3	Confident	71 Å²	71	51.7 Å²	51.7	43%	0.43	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	123.4	169.8	-178.6	0	0	0	0	109.4	G446 G610 K611	G446-V448 PolarHBondContact O-N 3.42Å; V448-G610 WeakPolarHBondContact CA-O 3.48Å; V448-K611 HydrophobicContact CG2-CG 4.32Å
449	I	86.9	Confident	74.2	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.036	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128	175.2	-58.7	161	0	0	0	108.8	P547 F565 L608 C609 G610 T612	I449-P547 HydrophobicContact CD1-CG 4.44Å; I449-F565 HydrophobicContact CD1-CE1 3.69Å; I449-F565 HydrophobicContact CD1-CZ 4.36Å; I449-F565 HydrophobicContact CG1-CE1 4.49Å; I449-F565 HydrophobicContact CG2-CE1 4.37Å; I449-F565 HydrophobicContact CG2-CZ 4.16Å; I449-L608 VanDerWaalsContact CG2-O 3.27Å; I449-L608 WeakPolarHBondContact CG2-O 3.41Å; I449-C609 CarbonylContact O-C 3.11Å; I449-C609 VanDerWaalsContact O-CA 3.3Å; I449-C609 WeakPolarHBondContact O-CA 3.44Å; I449-G610 PolarHBondContact N-O 2.91Å; I449-G610 PolarHBondContact O-N 3.45Å; I449-T612 HydrophobicContact CD1-CG2 3.16Å; I449-T612 HydrophobicContact CG1-CG2 3.66Å
450	L	91.1	Very high	77	Confident	98 Å²	98	50.7 Å²	50.7	51%	0.513	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-78.9	160.5	171.5	-59.5	-178.9	0	0	0	110.9	T452 L470 L543	L450-T452 PolarHBondContact O-N 3.45Å; L450-L470 HydrophobicContact CB-CD1 3.88Å; L450-L470 HydrophobicContact CD1-CD1 4.16Å; L450-L543 HydrophobicContact CD1-CD2 4.32Å
451	Q	94.4	Very high	79.5	Confident	34 Å²	34	51.2 Å²	51.2	16%	0.159	28%	0.278	C	S	.	.			trans	-72.1	98.7	177.5	-70.5	-169.5	15.8	0	0	111.6	L471 Y581 I607 C609	Q451-L471 HydrophobicContact CB-CB 3.99Å; Q451-L471 PolarHBondContact O-N 3.28Å; Q451-Y581 PolarHBondContact NE2-OH 3.29Å; Q451-Y581 PolarHBondContact OE1-OH 3.04Å; Q451-I607 HydrophobicContact CB-CG2 3.8Å; Q451-I607 HydrophobicContact CG-CG2 3.93Å; Q451-C609 HydrophobicContact CB-CB 4.47Å; Q451-C609 HydrophobicContact CG-CB 3.53Å
452	T	95.4	Very high	82	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.025	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.6	-178.7	57.8	0	0	0	0	112	L450 C469 L470 L543 S562 D563	L450-T452 PolarHBondContact O-N 3.45Å; T452-C469 WeakPolarHBondContact CA-O 3.41Å; T452-L470 HydrophobicContact CG2-CD1 4.1Å; T452-L543 HydrophobicContact CG2-CD1 3.57Å; T452-S562 PolarHBondContact O-OG 3.08Å; T452-S562 VanDerWaalsContact O-OG 3.12Å; T452-D563 PolarHBondContact OG1-OD2 3.42Å
453	A	95.5	Very high	84.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	138.7	178.6	0	0	0	0	0	111.3	C469 L471 S562 F604	A453-C469 PolarHBondContact N-O 3.31Å; A453-C469 WeakPolarHBondContact O-CB 3.47Å; A453-C469 PolarHBondContact O-N 3.27Å; A453-L471 HydrophobicContact CB-CD1 4.13Å; A453-S562 CarbonylContact C-O 3.42Å; A453-F604 HydrophobicContact CB-CB 4.14Å; A453-F604 HydrophobicContact CB-CD2 3.67Å; A453-F604 HydrophobicContact CB-CE2 4.43Å; A453-F604 HydrophobicContact CB-CG 4.19Å
454	Q	96.1	Very high	87	Confident	23 Å²	23	48.4 Å²	48.4	11%	0.107	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	129.4	164	-62.6	-169.9	-2.9	0	0	109	V467 M468 V522 S562	Q454-V467 WeakPolarHBondContact CA-O 3.44Å; Q454-M468 HydrophobicContact CG-CE 3.75Å; Q454-V522 HydrophobicContact CB-CG2 4.06Å; Q454-V522 WeakPolarHBondContact O-CG2 3.4Å; Q454-S562 PolarHBondContact N-O 3.19Å
455	A	96.9	Very high	89.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	162.4	176.8	0	0	0	0	0	110.2	V467 L519 F604	A455-V467 HydrophobicContact CB-CG2 4.06Å; A455-V467 PolarHBondContact N-O 3.21Å; A455-V467 WeakPolarHBondContact O-CG2 3.33Å; A455-V467 PolarHBondContact O-N 2.76Å; A455-L519 HydrophobicContact CB-CD2 4.25Å; A455-F604 HydrophobicContact CB-CD1 3.84Å; A455-F604 HydrophobicContact CB-CE1 3.44Å; A455-F604 VanDerWaalsContact CB-CE1 3.44Å; A455-F604 HydrophobicContact CB-CE2 4.43Å; A455-F604 HydrophobicContact CB-CG 4.5Å; A455-F604 HydrophobicContact CB-CZ 3.75Å
456	K	97.8	Very high	91.3	Very high	76 Å²	76	41.8 Å²	41.8	33%	0.33	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	116.4	168.4	-174.9	174.3	-171.5	168.6	0	109	I458 A465 T520	K456-I458 HydrophobicContact CG-CG1 4.48Å; K456-A465 CarbonylContact C-O 3.39Å; K456-A465 WeakPolarHBondContact CA-O 3.21Å; K456-T520 PolarHBondContact N-O 3.41Å; K456-T520 PolarHBondContact O-N 2.73Å; K456-T520 PolarHBondContact O-OG1 2.82Å
457	L	98.3	Very high	93	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.5	174	-171.3	163.5	0	0	0	109.2	K464 A465 V467 L484 L488 F517 C518 L519 V574	L457-K464 CarbonylContact O-C 3.56Å; L457-K464 VanDerWaalsContact O-CA 3.23Å; L457-K464 WeakPolarHBondContact O-CA 3.48Å; L457-A465 PolarHBondContact N-O 3.08Å; L457-A465 PolarHBondContact O-N 3.05Å; L457-V467 HydrophobicContact CB-CG1 3.78Å; L457-V467 HydrophobicContact CB-CG2 3.96Å; L457-V467 HydrophobicContact CD1-CG1 4.07Å; L457-L484 HydrophobicContact CD1-CD2 4.41Å; L457-L488 HydrophobicContact CD1-CD1 4.34Å; L457-L488 HydrophobicContact CD2-CD1 3.5Å; L457-L488 VanDerWaalsContact CD2-CD1 3.5Å; L457-L488 HydrophobicContact CG-CD1 4.46Å; L457-F517 HydrophobicContact CD1-CD1 4.26Å; L457-F517 HydrophobicContact CD1-CD2 3.6Å; L457-F517 HydrophobicContact CD1-CE1 4.3Å; L457-F517 HydrophobicContact CD1-CE2 3.65Å; L457-F517 HydrophobicContact CD1-CG 3.91Å; L457-F517 HydrophobicContact CD1-CZ 4.01Å; L457-F517 HydrophobicContact CD2-CB 3.83Å; L457-F517 HydrophobicContact CD2-CD2 4.17Å; L457-F517 HydrophobicContact CD2-CG 4.04Å; L457-F517 HydrophobicContact CG-CB 4.14Å; L457-F517 HydrophobicContact CG-CD2 3.51Å; L457-F517 HydrophobicContact CG-CE2 4.02Å; L457-F517 HydrophobicContact CG-CG 3.87Å; L457-C518 CarbonylContact C-O 3.05Å; L457-C518 WeakPolarHBondContact CA-O 3.48Å; L457-L519 HydrophobicContact CB-CD2 3.92Å; L457-L519 HydrophobicContact CG-CD2 4.17Å; L457-V574 HydrophobicContact CD1-CG2 4.1Å
458	I	97.2	Very high	94.2	Very high	20 Å²	20	40 Å²	40	10%	0.103	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	116.5	177.6	-48.5	-178.1	0	0	0	108.7	K456 S463 K464 C518 T520	K456-I458 HydrophobicContact CG-CG1 4.48Å; I458-S463 CarbonylContact C-O 3.52Å; I458-S463 VanDerWaalsContact CA-O 3.31Å; I458-S463 WeakPolarHBondContact CA-O 3.33Å; I458-K464 HydrophobicContact CG1-CG 4.21Å; I458-K464 HydrophobicContact CG2-CG 4.21Å; I458-C518 HydrophobicContact CB-CB 4.34Å; I458-C518 PolarHBondContact N-O 3.39Å; I458-C518 PolarHBondContact O-N 3.39Å; I458-T520 HydrophobicContact CD1-CG2 3.91Å
459	G	95.7	Very high	95	Very high	3 Å²	3	36.6 Å²	36.6	3%	0.031	20%	0.204	C	C	.	.			trans	-76.5	163	175.4	0	0	0	0	0	112.8	N461 G462 S463	G459-N461 PolarHBondContact O-N 2.79Å; G459-G462 PolarHBondContact O-N 2.88Å; G459-S463 PolarHBondContact N-O 3.15Å
460	P	92.4	Very high	95.5	Very high	92 Å²	92	37 Å²	37	60%	0.597	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.1	177.2	26.5	-33.4	0	0	0	113.1	G462 W530	P460-G462 PolarHBondContact O-N 3.24Å; P460-W530 HydrophobicContact CB-CH2 4.13Å; P460-W530 HydrophobicContact CB-CZ3 4.39Å
461	N	90	Very high	95.8	Very high	95 Å²	95	32.8 Å²	32.8	51%	0.508	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	3.7	171.8	63.6	-1.2	0	0	0	113.7	G459 S463 L488	G459-N461 PolarHBondContact O-N 2.79Å; N461-S463 VanDerWaalsContact C-N 3.29Å; N461-S463 PolarHBondContact O-N 3.34Å; N461-S463 WeakPolarHBondContact OD1-CB 3.27Å; N461-S463 PolarHBondContact OD1-N 3.43Å; N461-S463 PolarHBondContact OD1-OG 2.83Å; N461-L488 PolarHBondContact ND2-O 3.36Å
462	G	91.1	Very high	95.7	Very high	45 Å²	45	34 Å²	34	46%	0.464	19%	0.192	S	C	.	.	S	Bend	trans	81	0.1	-177.7	0	0	0	0	0	115.2	G459 P460	G459-G462 PolarHBondContact O-N 2.88Å; P460-G462 PolarHBondContact O-N 3.24Å
463	S	95.1	Very high	95.5	Very high	27 Å²	27	37.5 Å²	37.5	19%	0.189	21%	0.213	C	C	.	.			trans	-60	148	172.4	65.3	0	0	0	0	111	I458 G459 N461 L488	I458-S463 CarbonylContact C-O 3.52Å; I458-S463 VanDerWaalsContact CA-O 3.31Å; I458-S463 WeakPolarHBondContact CA-O 3.33Å; G459-S463 PolarHBondContact N-O 3.15Å; N461-S463 VanDerWaalsContact C-N 3.29Å; N461-S463 PolarHBondContact O-N 3.34Å; N461-S463 WeakPolarHBondContact OD1-CB 3.27Å; N461-S463 PolarHBondContact OD1-N 3.43Å; N461-S463 PolarHBondContact OD1-OG 2.83Å; S463-L488 PolarHBondContact OG-O 2.87Å
464	K	95.3	Very high	95	Very high	131 Å²	131	40.6 Å²	40.6	57%	0.57	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.2	-173.8	-63.9	171	-175	170.8	0	110.9	L457 I458	L457-K464 CarbonylContact O-C 3.56Å; L457-K464 VanDerWaalsContact O-CA 3.23Å; L457-K464 WeakPolarHBondContact O-CA 3.48Å; I458-K464 HydrophobicContact CG1-CG 4.21Å; I458-K464 HydrophobicContact CG2-CG 4.21Å
465	A	97.2	Very high	94.7	Very high	20 Å²	20	40.4 Å²	40.4	17%	0.165	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	147.8	171.5	0	0	0	0	0	111	K456 L457 V467 L484 L488	K456-A465 CarbonylContact C-O 3.39Å; K456-A465 WeakPolarHBondContact CA-O 3.21Å; L457-A465 PolarHBondContact N-O 3.08Å; L457-A465 PolarHBondContact O-N 3.05Å; A465-V467 HydrophobicContact CB-CG1 4.18Å; A465-L484 HydrophobicContact CB-CD1 3.96Å; A465-L488 HydrophobicContact CB-CD1 4.07Å; A465-L488 HydrophobicContact CB-CD2 4.1Å
466	L	96.6	Very high	94.1	Very high	94 Å²	94	48.6 Å²	48.6	49%	0.492	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.5	164.8	-174	73.6	0	0	0	107.8	V522	L466-V522 HydrophobicContact CD1-CB 4.4Å; L466-V522 HydrophobicContact CD1-CG1 3.89Å; L466-V522 HydrophobicContact CD1-CG2 3.61Å
467	V	97.6	Very high	93.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.4	-172.3	-63.6	0	0	0	0	111.1	Q454 A455 L457 A465 L484 L519 D573 V574	Q454-V467 WeakPolarHBondContact CA-O 3.44Å; A455-V467 HydrophobicContact CB-CG2 4.06Å; A455-V467 PolarHBondContact N-O 3.21Å; A455-V467 WeakPolarHBondContact O-CG2 3.33Å; A455-V467 PolarHBondContact O-N 2.76Å; L457-V467 HydrophobicContact CB-CG1 3.78Å; L457-V467 HydrophobicContact CB-CG2 3.96Å; L457-V467 HydrophobicContact CD1-CG1 4.07Å; A465-V467 HydrophobicContact CB-CG1 4.18Å; V467-L484 HydrophobicContact CG1-CD2 3.64Å; V467-L519 HydrophobicContact CG2-CD2 3.99Å; V467-D573 WeakPolarHBondContact CA-OD2 3.42Å; V467-D573 HydrophobicContact CB-CB 3.73Å; V467-D573 HydrophobicContact CG1-CB 4.01Å; V467-V574 HydrophobicContact CB-CG2 4.38Å; V467-V574 HydrophobicContact CG2-CG2 4.33Å
468	M	97.1	Very high	93.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.7	166.1	-177.6	54.8	71.4	0	0	109.5	Q454 L543 D563 K570 D573 V574	Q454-M468 HydrophobicContact CG-CE 3.75Å; M468-L543 HydrophobicContact CG-CD1 4.21Å; M468-D563 WeakPolarHBondContact CE-OD1 3.41Å; M468-K570 HydrophobicContact CB-CD 4.22Å; M468-K570 HydrophobicContact CE-CD 3.79Å; M468-K570 HydrophobicContact CG-CD 4.48Å; M468-D573 PolarHBondContact N-OD2 3.41Å; M468-D573 PolarHBondContact O-N 3.42Å; M468-V574 PolarHBondContact O-N 3.43Å
469	C	97.7	Very high	93.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.6	177.2	-60.8	0	0	0	0	110.6	T452 A453 V574 I576	T452-C469 WeakPolarHBondContact CA-O 3.41Å; A453-C469 PolarHBondContact N-O 3.31Å; A453-C469 WeakPolarHBondContact O-CB 3.47Å; A453-C469 PolarHBondContact O-N 3.27Å; C469-V574 CarbonylContact C-O 3.57Å; C469-V574 VanDerWaalsContact CA-O 3.22Å; C469-V574 WeakPolarHBondContact CA-O 3.45Å; C469-I576 HydrophobicContact CB-CD1 4.16Å
470	L	97.2	Very high	94	Very high	15 Å²	15	51 Å²	51	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.1	164.8	178.3	64.9	0	0	0	108.4	L450 T452 V572 V574 L575 I576	L450-L470 HydrophobicContact CB-CD1 3.88Å; L450-L470 HydrophobicContact CD1-CD1 4.16Å; T452-L470 HydrophobicContact CG2-CD1 4.1Å; L470-V572 HydrophobicContact CB-CG1 3.72Å; L470-V572 HydrophobicContact CB-CG2 4.04Å; L470-V572 HydrophobicContact CD2-CG2 4.43Å; L470-V574 PolarHBondContact N-O 2.89Å; L470-L575 HydrophobicContact CD2-CD1 4.3Å; L470-L575 CarbonylContact O-C 3.57Å; L470-L575 WeakPolarHBondContact O-CA 3.32Å; L470-I576 PolarHBondContact O-N 3.26Å
471	L	97.2	Very high	94.2	Very high	9 Å²	9	48.1 Å²	48.1	5%	0.047	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	114.4	176.1	-68.9	81.7	0	0	0	108.6	Q451 A453 I576 Y581 F584 V585 I607	Q451-L471 HydrophobicContact CB-CB 3.99Å; Q451-L471 PolarHBondContact O-N 3.28Å; A453-L471 HydrophobicContact CB-CD1 4.13Å; L471-I576 HydrophobicContact CG-CB 4.36Å; L471-I576 HydrophobicContact CG-CD1 4.3Å; L471-Y581 HydrophobicContact CB-CD2 3.9Å; L471-Y581 HydrophobicContact CB-CE2 3.84Å; L471-Y581 HydrophobicContact CD2-CD2 4.33Å; L471-Y581 HydrophobicContact CD2-CE2 4.31Å; L471-F584 HydrophobicContact CD2-CB 4.41Å; L471-V585 HydrophobicContact CD2-CG2 3.78Å; L471-I607 HydrophobicContact CD1-CD1 4.09Å; L471-I607 HydrophobicContact CD2-CD1 3.72Å
472	D	92.7	Very high	94.5	Very high	60 Å²	60	48 Å²	48	32%	0.321	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	101.6	-171.6	-176.5	8.6	0	0	0	111.5	G474 S475 L575 I576 G577	D472-G474 PolarHBondContact O-N 2.89Å; D472-G474 WeakPolarHBondContact OD1-CA 3.4Å; D472-G474 PolarHBondContact OD1-N 2.89Å; D472-S475 PolarHBondContact O-N 3.08Å; D472-L575 HydrophobicContact CB-CD1 4.26Å; D472-L575 HydrophobicContact CB-CD2 4.25Å; D472-L575 HydrophobicContact CB-CG 4.23Å; D472-I576 PolarHBondContact N-O 3.42Å; D472-G577 WeakPolarHBondContact O-CA 3.3Å
473	V	90.6	Very high	94.8	Very high	77 Å²	77	49.3 Å²	49.3	47%	0.467	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.1	174	-65.6	0	0	0	0	113.4	S475 Y581	V473-S475 VanDerWaalsContact C-N 3.29Å; V473-Y581 HydrophobicContact CG1-CD1 3.57Å; V473-Y581 HydrophobicContact CG1-CD2 3.45Å; V473-Y581 VanDerWaalsContact CG1-CD2 3.45Å; V473-Y581 HydrophobicContact CG1-CE1 3.7Å; V473-Y581 HydrophobicContact CG1-CE2 3.56Å; V473-Y581 HydrophobicContact CG1-CG 3.45Å; V473-Y581 VanDerWaalsContact CG1-CG 3.45Å
474	G	85	Confident	95	Very high	66 Å²	66	48.9 Å²	48.9	68%	0.68	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.9	173.5	0	0	0	0	0	113.3	D472	D472-G474 PolarHBondContact O-N 2.89Å; D472-G474 WeakPolarHBondContact OD1-CA 3.4Å; D472-G474 PolarHBondContact OD1-N 2.89Å
475	S	89.3	Confident	95.1	Very high	19 Å²	19	42.6 Å²	42.6	13%	0.133	23%	0.227	C	C	.	.			trans	-94.2	123.6	173.3	-174.5	0	0	0	0	110.8	D472 V473 R477 F479 L575 G577 A578	D472-S475 PolarHBondContact O-N 3.08Å; V473-S475 VanDerWaalsContact C-N 3.29Å; S475-R477 PolarHBondContact O-N 3.22Å; S475-R477 PolarHBondContact OG-O 2.91Å; S475-F479 WeakPolarHBondContact OG-CE2 3.32Å; S475-L575 VanDerWaalsContact CB-CD2 3.42Å; S475-G577 CarbonylContact O-C 3.33Å; S475-G577 WeakPolarHBondContact O-CA 3.37Å; S475-A578 PolarHBondContact O-N 3.3Å
476	Q	85.4	Confident	95.1	Very high	172 Å²	172	45.1 Å²	45.1	80%	0.804	24%	0.238	S	C	*	.	S	Bend	trans	-70	-19.4	176.9	-65.6	178.5	-40	0	0	113.5
477	R	93.4	Very high	95.1	Very high	119 Å²	119	47.1 Å²	47.1	45%	0.449	25%	0.249	S	C	.	.	S	Bend	trans	-130	153.9	-175.5	-70.6	-72.6	-110.1	-88.6	-2	110.9	S475 F479 E495 L534 D579	S475-R477 PolarHBondContact O-N 3.22Å; S475-R477 PolarHBondContact OG-O 2.91Å; R477-F479 HydrophobicContact CB-CE2 3.96Å; R477-F479 HydrophobicContact CB-CZ 4.12Å; R477-F479 VanDerWaalsContact O-CD2 3.28Å; R477-F479 WeakPolarHBondContact O-CD2 3.2Å; R477-F479 VanDerWaalsContact O-CE2 3.24Å; R477-F479 WeakPolarHBondContact O-CE2 3.4Å; R477-E495 IonicContact NH2-OE2 3.71Å; R477-E495 PolarHBondContact NH2-OE2 2.82Å; R477-E495 VanDerWaalsContact NH2-OE2 3.15Å; R477-L534 HydrophobicContact CB-CD1 4.25Å; R477-L534 HydrophobicContact CG-CD1 4.46Å; R477-D579 WeakPolarHBondContact CA-OD2 3.45Å
478	S	97	Very high	95.1	Very high	1 Å²	1	48 Å²	48	1%	0.007	25%	0.253	C	S	.	.			trans	-87.5	146.5	171.1	-67	0	0	0	0	112.6	A533 L534 L575 G577 D579	S478-A533 VanDerWaalsContact O-CA 3.31Å; S478-A533 WeakPolarHBondContact O-CA 3.35Å; S478-L534 PolarHBondContact O-N 3.17Å; S478-L575 CarbonylContact C-O 3.51Å; S478-L575 WeakPolarHBondContact CA-O 3.44Å; S478-L575 WeakPolarHBondContact CB-O 3.27Å; S478-G577 PolarHBondContact OG-N 2.85Å; S478-D579 PolarHBondContact N-OD1 3.01Å; S478-D579 PolarHBondContact N-OD2 3.34Å; S478-D579 PolarHBondContact OG-OD1 3.45Å
479	F	97.4	Very high	95	Very high	30 Å²	30	49.9 Å²	49.9	13%	0.132	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	153.9	-175.6	-63.6	-91.1	0	0	0	112.1	S475 R477 I497 L534 V536 I539 V574 L575	S475-F479 WeakPolarHBondContact OG-CE2 3.32Å; R477-F479 HydrophobicContact CB-CE2 3.96Å; R477-F479 HydrophobicContact CB-CZ 4.12Å; R477-F479 VanDerWaalsContact O-CD2 3.28Å; R477-F479 WeakPolarHBondContact O-CD2 3.2Å; R477-F479 VanDerWaalsContact O-CE2 3.24Å; R477-F479 WeakPolarHBondContact O-CE2 3.4Å; F479-I497 HydrophobicContact CE1-CD1 4.04Å; F479-L534 CarbonylContact C-O 3.59Å; F479-L534 VanDerWaalsContact CA-O 3.3Å; F479-L534 WeakPolarHBondContact CA-O 2.99Å; F479-L534 HydrophobicContact CD1-CB 3.65Å; F479-L534 HydrophobicContact CD1-CD1 4.45Å; F479-L534 HydrophobicContact CE1-CB 3.81Å; F479-L534 HydrophobicContact CE1-CD1 3.83Å; F479-L534 HydrophobicContact CE1-CG 4.48Å; F479-L534 HydrophobicContact CZ-CD1 4.22Å; F479-V536 HydrophobicContact CB-CG2 4.13Å; F479-V536 HydrophobicContact CD1-CG1 3.69Å; F479-V536 HydrophobicContact CD1-CG2 4.2Å; F479-V536 HydrophobicContact CE1-CG1 4.11Å; F479-I539 HydrophobicContact CB-CG1 4.45Å; F479-V574 CarbonylContact O-C 3.56Å; F479-V574 WeakPolarHBondContact O-CA 3.47Å; F479-L575 HydrophobicContact CB-CB 4.28Å; F479-L575 HydrophobicContact CD2-CD2 4.15Å; F479-L575 PolarHBondContact N-O 3.23Å; F479-L575 PolarHBondContact O-N 3.01Å
480	V	98.4	Very high	95	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.1	174.9	61.8	0	0	0	0	110	K482 L484 A485 V515 F517 A533 L534 C535 V536 V574	V480-K482 PolarHBondContact O-N 3.32Å; V480-L484 HydrophobicContact CG2-CD2 4.21Å; V480-A485 HydrophobicContact CG1-CB 4.18Å; V480-V515 HydrophobicContact CG1-CG2 3.65Å; V480-F517 HydrophobicContact CB-CE1 3.87Å; V480-F517 HydrophobicContact CB-CZ 4.11Å; V480-F517 HydrophobicContact CG1-CE1 4Å; V480-F517 HydrophobicContact CG2-CE1 4.06Å; V480-F517 HydrophobicContact CG2-CZ 4.28Å; V480-A533 HydrophobicContact CB-CB 4.36Å; V480-A533 HydrophobicContact CG1-CB 4.25Å; V480-L534 PolarHBondContact N-O 3.35Å; V480-C535 WeakPolarHBondContact O-CA 3.32Å; V480-V536 PolarHBondContact O-N 3.22Å; V480-V574 HydrophobicContact CG2-CG2 4.12Å
481	R	97.8	Very high	94.9	Very high	30 Å²	30	58.1 Å²	58.1	11%	0.113	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	129.5	176.3	-152.4	176.4	50.7	-111.3	-7.9	110.1	D483 L484 A485 V536 P537 V572 D573	R481-D483 WeakPolarHBondContact CB-OD1 3.37Å; R481-D483 VanDerWaalsContact CD-OD1 3.25Å; R481-D483 WeakPolarHBondContact CD-OD1 3.39Å; R481-D483 WeakPolarHBondContact CG-OD1 3.42Å; R481-D483 IonicContact CZ-OD1 2.81Å; R481-D483 IonicContact NE-OD1 3.11Å; R481-D483 PolarHBondContact NE-OD1 3.38Å; R481-D483 IonicContact NE-OD2 3.25Å; R481-D483 PolarHBondContact NE-OD2 3.24Å; R481-D483 IonicContact NH2-OD1 3.9Å; R481-D483 IonicContact NH2-OD2 3.34Å; R481-D483 PolarHBondContact O-N 3.45Å; R481-L484 HydrophobicContact CB-CB 4.35Å; R481-L484 WeakPolarHBondContact O-CB 3.4Å; R481-L484 PolarHBondContact O-N 3.12Å; R481-A485 PolarHBondContact O-N 3.27Å; R481-V536 CarbonylContact C-O 3.59Å; R481-V536 WeakPolarHBondContact CA-O 3.46Å; R481-P537 VanDerWaalsContact CG-O 3.29Å; R481-P537 WeakPolarHBondContact CG-O 3.28Å; R481-V572 PolarHBondContact NH1-O 2.8Å; R481-D573 IonicContact CZ-OD1 2.61Å; R481-D573 PolarHBondContact N-O 3.31Å; R481-D573 IonicContact NH1-OD1 3.46Å; R481-D573 PolarHBondContact NH1-OD1 3.49Å; R481-D573 IonicContact NH2-OD1 3.56Å; R481-D573 PolarHBondContact NH2-OD1 3.47Å
482	K	96.5	Very high	94.7	Very high	94 Å²	94	59.4 Å²	59.4	41%	0.409	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-42.5	-171.2	-179.4	176.3	179	175.1	0	112.1	V480 L484 A485 D486 C535 V536	V480-K482 PolarHBondContact O-N 3.32Å; K482-L484 VanDerWaalsContact C-N 3.34Å; K482-L484 PolarHBondContact O-N 3.25Å; K482-A485 PolarHBondContact O-N 3.14Å; K482-D486 WeakPolarHBondContact O-CB 3.37Å; K482-D486 PolarHBondContact O-N 2.83Å; K482-C535 HydrophobicContact CB-CB 4.27Å; K482-C535 HydrophobicContact CG-CB 4.33Å; K482-V536 WeakPolarHBondContact CB-O 3.32Å; K482-V536 PolarHBondContact N-O 2.8Å
483	D	97.3	Very high	94.7	Very high	71 Å²	71	60.4 Å²	60.4	38%	0.38	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-40.7	177.2	68.3	-28.1	0	0	0	112.2	R481 D486 N487	R481-D483 WeakPolarHBondContact CB-OD1 3.37Å; R481-D483 VanDerWaalsContact CD-OD1 3.25Å; R481-D483 WeakPolarHBondContact CD-OD1 3.39Å; R481-D483 WeakPolarHBondContact CG-OD1 3.42Å; R481-D483 IonicContact CZ-OD1 2.81Å; R481-D483 IonicContact NE-OD1 3.11Å; R481-D483 PolarHBondContact NE-OD1 3.38Å; R481-D483 IonicContact NE-OD2 3.25Å; R481-D483 PolarHBondContact NE-OD2 3.24Å; R481-D483 IonicContact NH2-OD1 3.9Å; R481-D483 IonicContact NH2-OD2 3.34Å; R481-D483 PolarHBondContact O-N 3.45Å; D483-D486 PolarHBondContact O-N 3.49Å; D483-N487 VanDerWaalsContact O-CB 3.3Å; D483-N487 WeakPolarHBondContact O-CB 3.25Å; D483-N487 PolarHBondContact O-N 3.45Å; D483-N487 PolarHBondContact O-ND2 3.02Å; D483-N487 VanDerWaalsContact O-ND2 3.09Å
484	L	97.9	Very high	94.7	Very high	18 Å²	18	62 Å²	62	9%	0.094	34%	0.34	C	S	.	.	H	α-helix	trans	-64.8	-46.5	176	175.4	65.3	0	0	0	110.7	L457 A465 V467 V480 R481 K482 D486 N487 L488 D573	L457-L484 HydrophobicContact CD1-CD2 4.41Å; A465-L484 HydrophobicContact CB-CD1 3.96Å; V467-L484 HydrophobicContact CG1-CD2 3.64Å; V480-L484 HydrophobicContact CG2-CD2 4.21Å; R481-L484 HydrophobicContact CB-CB 4.35Å; R481-L484 WeakPolarHBondContact O-CB 3.4Å; R481-L484 PolarHBondContact O-N 3.12Å; K482-L484 VanDerWaalsContact C-N 3.34Å; K482-L484 PolarHBondContact O-N 3.25Å; L484-D486 VanDerWaalsContact C-N 3.32Å; L484-D486 PolarHBondContact O-N 2.96Å; L484-N487 PolarHBondContact O-N 2.99Å; L484-L488 HydrophobicContact CD1-CD1 3.88Å; L484-L488 HydrophobicContact CD1-CG 4.25Å; L484-L488 HydrophobicContact CG-CD1 4.07Å; L484-L488 WeakPolarHBondContact O-CB 3.43Å; L484-L488 WeakPolarHBondContact O-CG 3.46Å; L484-L488 PolarHBondContact O-N 3.13Å; L484-D573 HydrophobicContact CD2-CB 3.82Å
485	A	97.9	Very high	94.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-39.7	176.6	0	0	0	0	0	112	V480 R481 K482 G489 L490 V515 C535	V480-A485 HydrophobicContact CG1-CB 4.18Å; R481-A485 PolarHBondContact O-N 3.27Å; K482-A485 PolarHBondContact O-N 3.14Å; A485-G489 PolarHBondContact O-N 2.61Å; A485-L490 HydrophobicContact CB-CB 4.39Å; A485-L490 HydrophobicContact CB-CD1 4.24Å; A485-L490 PolarHBondContact O-N 2.96Å; A485-V515 HydrophobicContact CB-CG2 4.49Å; A485-C535 WeakPolarHBondContact CB-SG 3.37Å
486	D	97.3	Very high	94	Very high	73 Å²	73	69.8 Å²	69.8	39%	0.39	35%	0.349	S	S	.	.	H	α-helix	trans	-65.6	-46.2	175.6	-71.5	-24.2	0	0	0	111.7	K482 D483 L484 L488 G489 R513	K482-D486 WeakPolarHBondContact O-CB 3.37Å; K482-D486 PolarHBondContact O-N 2.83Å; D483-D486 PolarHBondContact O-N 3.49Å; L484-D486 VanDerWaalsContact C-N 3.32Å; L484-D486 PolarHBondContact O-N 2.96Å; D486-L488 VanDerWaalsContact C-N 3.27Å; D486-L488 PolarHBondContact O-N 3.36Å; D486-G489 WeakPolarHBondContact O-CA 3.38Å; D486-G489 PolarHBondContact O-N 3.37Å; D486-R513 IonicContact OD1-CZ 3.85Å; D486-R513 IonicContact OD1-NH1 3.2Å; D486-R513 PolarHBondContact OD1-NH1 3.49Å; D486-R513 IonicContact OD1-NH2 2.73Å; D486-R513 PolarHBondContact OD1-NH2 3.27Å
487	N	97.2	Very high	93.7	Very high	135 Å²	135	62.5 Å²	62.5	72%	0.722	32%	0.315	S	S	*	.	H	α-helix	trans	-63.9	-31.5	178.9	-71.6	-26.2	0	0	0	112.8	D483 L484 G489	D483-N487 VanDerWaalsContact O-CB 3.3Å; D483-N487 WeakPolarHBondContact O-CB 3.25Å; D483-N487 PolarHBondContact O-N 3.45Å; D483-N487 PolarHBondContact O-ND2 3.02Å; D483-N487 VanDerWaalsContact O-ND2 3.09Å; L484-N487 PolarHBondContact O-N 2.99Å; N487-G489 VanDerWaalsContact C-N 3.29Å
488	L	97.1	Very high	92.9	Very high	18 Å²	18	59.5 Å²	59.5	9%	0.094	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.6	173.9	-68.3	174.2	0	0	0	113.1	L457 N461 S463 A465 L484 D486 L490	L457-L488 HydrophobicContact CD1-CD1 4.34Å; L457-L488 HydrophobicContact CD2-CD1 3.5Å; L457-L488 VanDerWaalsContact CD2-CD1 3.5Å; L457-L488 HydrophobicContact CG-CD1 4.46Å; N461-L488 PolarHBondContact ND2-O 3.36Å; S463-L488 PolarHBondContact OG-O 2.87Å; A465-L488 HydrophobicContact CB-CD1 4.07Å; A465-L488 HydrophobicContact CB-CD2 4.1Å; L484-L488 HydrophobicContact CD1-CD1 3.88Å; L484-L488 HydrophobicContact CD1-CG 4.25Å; L484-L488 HydrophobicContact CG-CD1 4.07Å; L484-L488 WeakPolarHBondContact O-CB 3.43Å; L484-L488 WeakPolarHBondContact O-CG 3.46Å; L484-L488 PolarHBondContact O-N 3.13Å; D486-L488 VanDerWaalsContact C-N 3.27Å; D486-L488 PolarHBondContact O-N 3.36Å; L488-L490 VanDerWaalsContact C-N 3.29Å; L488-L490 HydrophobicContact CB-CD1 4.42Å; L488-L490 HydrophobicContact CB-CD2 4.23Å; L488-L490 HydrophobicContact CB-CG 3.89Å; L488-L490 HydrophobicContact CD1-CD1 4.49Å; L488-L490 PolarHBondContact O-N 3.18Å
489	G	95.7	Very high	91.9	Very high	41 Å²	41	62 Å²	62	42%	0.423	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	29.4	-179.3	0	0	0	0	0	113.5	A485 D486 N487 K491	A485-G489 PolarHBondContact O-N 2.61Å; D486-G489 WeakPolarHBondContact O-CA 3.38Å; D486-G489 PolarHBondContact O-N 3.37Å; N487-G489 VanDerWaalsContact C-N 3.29Å; G489-K491 PolarHBondContact O-N 2.98Å
490	L	97.5	Very high	90.7	Very high	3 Å²	3	66 Å²	66	2%	0.016	35%	0.347	C	S	.	.			trans	-72.7	126.5	179.2	-55	-177.6	0	0	0	110	A485 L488 R513 V515 F517	A485-L490 HydrophobicContact CB-CB 4.39Å; A485-L490 HydrophobicContact CB-CD1 4.24Å; A485-L490 PolarHBondContact O-N 2.96Å; L488-L490 VanDerWaalsContact C-N 3.29Å; L488-L490 HydrophobicContact CB-CD1 4.42Å; L488-L490 HydrophobicContact CB-CD2 4.23Å; L488-L490 HydrophobicContact CB-CG 3.89Å; L488-L490 HydrophobicContact CD1-CD1 4.49Å; L488-L490 PolarHBondContact O-N 3.18Å; L490-R513 VanDerWaalsContact O-CZ 3.31Å; L490-R513 PolarHBondContact O-NE 3.09Å; L490-V515 HydrophobicContact CB-CB 3.98Å; L490-V515 HydrophobicContact CB-CG1 3.88Å; L490-V515 HydrophobicContact CB-CG2 4.44Å; L490-V515 HydrophobicContact CD1-CB 4.5Å; L490-V515 HydrophobicContact CD1-CG2 4.21Å; L490-F517 HydrophobicContact CD1-CB 4.24Å; L490-F517 HydrophobicContact CD1-CD1 3.85Å; L490-F517 HydrophobicContact CD1-CG 4.4Å
491	K	94.4	Very high	89.6	Confident	184 Å²	184	69.9 Å²	69.9	80%	0.8	37%	0.371	S	S	*	.			trans	-114.3	156.1	-179.5	-62.4	-175.2	-178.9	-179.5	0	110.3	G489	G489-K491 PolarHBondContact O-N 2.98Å
492	G	93.1	Very high	87.9	Confident	36 Å²	36	76.4 Å²	76.4	37%	0.371	40%	0.401	S	S	.	.			trans	171.3	179.8	172.6	0	0	0	0	0	111.3	S514	G492-S514 CarbonylContact C-O 3.51Å; G492-S514 WeakPolarHBondContact CA-O 3.17Å
493	P	93.1	Very high	86	Confident	82 Å²	82	75.2 Å²	75.2	53%	0.532	42%	0.415	S	S	.	.			trans	-71.2	156.9	-174.6	30.6	-35.4	0	0	0	111.7	R513 S514	P493-R513 CarbonylContact O-C 3.36Å; P493-R513 WeakPolarHBondContact O-CA 3.5Å; P493-S514 PolarHBondContact O-N 3Å
494	N	89.5	Confident	83.9	Confident	111 Å²	111	76.2 Å²	76.2	59%	0.594	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.8	169.8	-74.3	-23	0	0	0	109.8	V511 R513	N494-V511 HydrophobicContact CB-CG1 3.63Å; N494-R513 WeakPolarHBondContact OD1-CA 3.4Å; N494-R513 WeakPolarHBondContact OD1-CB 3.26Å
495	E	82	Confident	81.7	Confident	41 Å²	41	84.2 Å²	84.2	19%	0.192	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141.1	176.3	-63.6	-178	-161.8	0	0	109.3	R477 I497 V511 A512 S514 K532 L534	R477-E495 IonicContact NH2-OE2 3.71Å; R477-E495 PolarHBondContact NH2-OE2 2.82Å; R477-E495 VanDerWaalsContact NH2-OE2 3.15Å; E495-I497 HydrophobicContact CB-CG2 4.24Å; E495-V511 WeakPolarHBondContact O-CA 3.34Å; E495-A512 PolarHBondContact N-O 2.95Å; E495-A512 PolarHBondContact O-N 3.28Å; E495-S514 WeakPolarHBondContact OE1-CB 3.45Å; E495-K532 VanDerWaalsContact OE1-CE 3.29Å; E495-K532 WeakPolarHBondContact OE1-CE 3.48Å; E495-K532 IonicContact OE1-NZ 2.79Å; E495-K532 PolarHBondContact OE1-NZ 3.46Å; E495-L534 HydrophobicContact CB-CD2 4.3Å
496	Y	79	Confident	79.7	Confident	206 Å²	206	92 Å²	92	81%	0.808	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	122.1	169.3	-71.8	-90.5	0	0	0	108.4	V511	Y496-V511 HydrophobicContact CD1-CG2 3.55Å; Y496-V511 HydrophobicContact CE1-CG2 3.31Å; Y496-V511 HydrophobicContact CG-CG2 4.3Å
497	I	78.5	Confident	77.9	Confident	19 Å²	19	89.2 Å²	89.2	10%	0.097	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	150	-176.4	66.2	163.8	0	0	0	111.2	F479 E495 I499 Q509 E510 A512 L534	F479-I497 HydrophobicContact CE1-CD1 4.04Å; E495-I497 HydrophobicContact CB-CG2 4.24Å; I497-I499 HydrophobicContact CD1-CD1 4.03Å; I497-I499 HydrophobicContact CD1-CG1 3.93Å; I497-I499 HydrophobicContact CG1-CG1 4.49Å; I497-Q509 WeakPolarHBondContact O-CA 3.41Å; I497-E510 WeakPolarHBondContact CG1-O 3.43Å; I497-E510 PolarHBondContact N-O 2.79Å; I497-E510 PolarHBondContact O-N 3.23Å; I497-A512 HydrophobicContact CD1-CB 3.48Å; I497-A512 VanDerWaalsContact CD1-CB 3.48Å; I497-A512 HydrophobicContact CG1-CB 3.87Å; I497-L534 HydrophobicContact CD1-CD1 4.16Å; I497-L534 HydrophobicContact CG2-CD1 3.87Å; I497-L534 HydrophobicContact CG2-CD2 4.12Å
498	S	76.3	Confident	76.4	Confident	56 Å²	56	90.6 Å²	90.6	39%	0.392	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110.7	173.2	177.1	0	0	0	0	108.6	L500 Q509	S498-L500 PolarHBondContact O-N 3.26Å; S498-Q509 PolarHBondContact OG-NE2 3.14Å
499	I	76	Confident	75.2	Confident	54 Å²	54	96 Å²	96	28%	0.277	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	107.2	176.4	-57.1	177.4	0	0	0	108.4	I497 T501 G507 R508 V536	I497-I499 HydrophobicContact CD1-CD1 4.03Å; I497-I499 HydrophobicContact CD1-CG1 3.93Å; I497-I499 HydrophobicContact CG1-CG1 4.49Å; I499-T501 HydrophobicContact CG2-CG2 4.37Å; I499-G507 CarbonylContact O-C 3.55Å; I499-G507 WeakPolarHBondContact O-CA 3.31Å; I499-R508 PolarHBondContact N-O 3.41Å; I499-R508 PolarHBondContact O-N 2.98Å; I499-V536 HydrophobicContact CD1-CG1 4.13Å
500	L	72.4	Confident	74.2	Confident	113 Å²	113	96.3 Å²	96.3	59%	0.592	48%	0.484	S	S	*	.			trans	-96.9	127.1	175.5	-69.2	159.6	0	0	0	109.1	S498 G507	S498-L500 PolarHBondContact O-N 3.26Å; L500-G507 VanDerWaalsContact CD2-N 3.34Å
501	T	74.4	Confident	73.4	Confident	82 Å²	82	99.3 Å²	99.3	50%	0.503	50%	0.502	S	S	.	.			trans	-114.6	163.1	177	54.1	0	0	0	0	110.4	I499 G503 N504	I499-T501 HydrophobicContact CG2-CG2 4.37Å; T501-G503 PolarHBondContact O-N 3.45Å; T501-N504 WeakPolarHBondContact O-CB 3.31Å; T501-N504 PolarHBondContact O-N 3.03Å
502	F	62.9	Low	73	Confident	168 Å²	168	90.6 Å²	90.6	74%	0.737	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	131.3	179	-171	-91.4	0	0	0	111.1	N504 C625	F502-N504 VanDerWaalsContact C-N 3.28Å; F502-N504 PolarHBondContact O-N 3.07Å; F502-C625 HydrophobicContact CD1-CB 3.96Å; F502-C625 HydrophobicContact CE1-CB 3.76Å; F502-C625 VanDerWaalsContact CE1-SG 3.58Å
503	G	55.8	Low	73.1	Confident	69 Å²	69	91.3 Å²	91.3	71%	0.711	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	-1.3	-178.6	0	0	0	0	0	115.6	T501	T501-G503 PolarHBondContact O-N 3.45Å
504	N	54.8	Low	73.2	Confident	91 Å²	91	87.6 Å²	87.6	49%	0.487	43%	0.432	S	S	.	.			trans	-109.6	110	-175.3	-128.8	-22.4	0	0	0	112.1	T501 F502	T501-N504 WeakPolarHBondContact O-CB 3.31Å; T501-N504 PolarHBondContact O-N 3.03Å; F502-N504 VanDerWaalsContact C-N 3.28Å; F502-N504 PolarHBondContact O-N 3.07Å
505	R	50.8	Low	73.7	Confident	187 Å²	187	82.4 Å²	82.4	71%	0.706	40%	0.404	S	S	*	.	S	Bend	trans	-76.1	-23.2	178	-68.6	-172.8	-179.2	-152.4	2	113.5
506	H	56	Low	74.4	Confident	164 Å²	164	86 Å²	86	76%	0.759	42%	0.421	S	S	*	.	S	Bend	trans	-113	96.6	179.3	-58.6	95.5	0	0	0	108.4
507	G	60	Low	75.3	Confident	13 Å²	13	76.1 Å²	76.1	13%	0.134	38%	0.382	C	S	.	.			trans	-63.6	145.8	177.8	0	0	0	0	0	111.5	I499 L500 Q509	I499-G507 CarbonylContact O-C 3.55Å; I499-G507 WeakPolarHBondContact O-CA 3.31Å; L500-G507 VanDerWaalsContact CD2-N 3.34Å; G507-Q509 PolarHBondContact O-N 2.76Å; G507-Q509 VanDerWaalsContact O-N 3.15Å; G507-Q509 PolarHBondContact O-NE2 3.31Å
508	R	65.3	Low	76.3	Confident	164 Å²	164	75.4 Å²	75.4	62%	0.619	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	114.2	173.2	176.1	174.6	163.2	165	-3.2	108.2	I499 E510	I499-R508 PolarHBondContact N-O 3.41Å; I499-R508 PolarHBondContact O-N 2.98Å; R508-E510 IonicContact CZ-OE2 3.96Å; R508-E510 VanDerWaalsContact CZ-OE2 3.26Å; R508-E510 IonicContact NE-OE2 3.26Å; R508-E510 PolarHBondContact NE-OE2 2.93Å; R508-E510 IonicContact NH2-OE2 3.91Å; R508-E510 PolarHBondContact NH2-OE2 3.39Å
509	Q	71.8	Confident	77.3	Confident	132 Å²	132	72.7 Å²	72.7	62%	0.617	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	128.2	172.2	-56.7	-54.8	-54.8	0	0	109.2	I497 S498 G507	I497-Q509 WeakPolarHBondContact O-CA 3.41Å; S498-Q509 PolarHBondContact OG-NE2 3.14Å; G507-Q509 PolarHBondContact O-N 2.76Å; G507-Q509 VanDerWaalsContact O-N 3.15Å; G507-Q509 PolarHBondContact O-NE2 3.31Å
510	E	75.2	Confident	78.3	Confident	48 Å²	48	70.1 Å²	70.1	22%	0.224	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.9	175.9	-170.5	162.9	165.3	0	0	110.7	I497 R508	I497-E510 WeakPolarHBondContact CG1-O 3.43Å; I497-E510 PolarHBondContact N-O 2.79Å; I497-E510 PolarHBondContact O-N 3.23Å; R508-E510 IonicContact CZ-OE2 3.96Å; R508-E510 VanDerWaalsContact CZ-OE2 3.26Å; R508-E510 IonicContact NE-OE2 3.26Å; R508-E510 PolarHBondContact NE-OE2 2.93Å; R508-E510 IonicContact NH2-OE2 3.91Å; R508-E510 PolarHBondContact NH2-OE2 3.39Å
511	V	80.1	Confident	79.4	Confident	65 Å²	65	65.2 Å²	65.2	39%	0.394	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	112.7	169.2	179.6	0	0	0	0	108.2	N494 E495 Y496	N494-V511 HydrophobicContact CB-CG1 3.63Å; E495-V511 WeakPolarHBondContact O-CA 3.34Å; Y496-V511 HydrophobicContact CD1-CG2 3.55Å; Y496-V511 HydrophobicContact CE1-CG2 3.31Å; Y496-V511 HydrophobicContact CG-CG2 4.3Å
512	A	86.5	Confident	80.2	Confident	2 Å²	2	64.7 Å²	64.7	2%	0.017	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.4	179.1	0	0	0	0	0	110.6	E495 I497 S514 L534	E495-A512 PolarHBondContact N-O 2.95Å; E495-A512 PolarHBondContact O-N 3.28Å; I497-A512 HydrophobicContact CD1-CB 3.48Å; I497-A512 VanDerWaalsContact CD1-CB 3.48Å; I497-A512 HydrophobicContact CG1-CB 3.87Å; A512-S514 PolarHBondContact O-N 3.26Å; A512-L534 HydrophobicContact CB-CB 4.15Å; A512-L534 HydrophobicContact CB-CD2 4.12Å
513	R	95.3	Very high	81.3	Confident	51 Å²	51	61.3 Å²	61.3	19%	0.192	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.8	171.7	-176	-178.5	62	-151.3	-7.2	108.6	D486 L490 P493 N494 V515 C535	D486-R513 IonicContact OD1-CZ 3.85Å; D486-R513 IonicContact OD1-NH1 3.2Å; D486-R513 PolarHBondContact OD1-NH1 3.49Å; D486-R513 IonicContact OD1-NH2 2.73Å; D486-R513 PolarHBondContact OD1-NH2 3.27Å; L490-R513 VanDerWaalsContact O-CZ 3.31Å; L490-R513 PolarHBondContact O-NE 3.09Å; P493-R513 CarbonylContact O-C 3.36Å; P493-R513 WeakPolarHBondContact O-CA 3.5Å; N494-R513 WeakPolarHBondContact OD1-CA 3.4Å; N494-R513 WeakPolarHBondContact OD1-CB 3.26Å; R513-V515 HydrophobicContact CG-CG1 3.98Å; R513-C535 HydrophobicContact CB-CB 4.15Å; R513-C535 VanDerWaalsContact O-CB 3.31Å; R513-C535 WeakPolarHBondContact O-CB 3.31Å; R513-C535 PolarHBondContact O-N 3.42Å; R513-C535 PolarHBondContact O-SG 2.94Å; R513-C535 VanDerWaalsContact O-SG 3.35Å
514	S	95.8	Very high	82.3	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.021	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	131.9	168.7	-168.4	0	0	0	0	110	G492 P493 E495 A512 K532	G492-S514 CarbonylContact C-O 3.51Å; G492-S514 WeakPolarHBondContact CA-O 3.17Å; P493-S514 PolarHBondContact O-N 3Å; E495-S514 WeakPolarHBondContact OE1-CB 3.45Å; A512-S514 PolarHBondContact O-N 3.26Å; S514-K532 WeakPolarHBondContact OG-CE 3.35Å; S514-K532 WeakPolarHBondContact OG-CG 3.43Å
515	V	98.1	Very high	83.6	Confident	2 Å²	2	62 Å²	62	1%	0.012	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	154.2	178.5	-63.7	0	0	0	0	110.6	V480 A485 L490 R513 F517 K532 A533	V480-V515 HydrophobicContact CG1-CG2 3.65Å; A485-V515 HydrophobicContact CB-CG2 4.49Å; L490-V515 HydrophobicContact CB-CB 3.98Å; L490-V515 HydrophobicContact CB-CG1 3.88Å; L490-V515 HydrophobicContact CB-CG2 4.44Å; L490-V515 HydrophobicContact CD1-CB 4.5Å; L490-V515 HydrophobicContact CD1-CG2 4.21Å; R513-V515 HydrophobicContact CG-CG1 3.98Å; V515-F517 HydrophobicContact CG2-CD1 4.1Å; V515-F517 HydrophobicContact CG2-CE1 4.15Å; V515-K532 CarbonylContact O-C 3.51Å; V515-K532 WeakPolarHBondContact O-CA 3.46Å; V515-A533 PolarHBondContact N-O 3.5Å; V515-A533 PolarHBondContact O-N 3.31Å
516	E	98.1	Very high	85.3	Confident	116 Å²	116	60.3 Å²	60.3	54%	0.542	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.2	175.4	-70.3	-179.9	-177.3	0	0	110.7	I531 K532	E516-I531 WeakPolarHBondContact CA-O 3.27Å; E516-K532 HydrophobicContact CG-CB 4Å; E516-K532 HydrophobicContact CG-CG 4.08Å
517	F	98.5	Very high	87	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	165.2	176.3	55.6	-98.4	0	0	0	111.2	L457 V480 L490 V515 L519 W530 I531 A533 V574	L457-F517 HydrophobicContact CD1-CD1 4.26Å; L457-F517 HydrophobicContact CD1-CD2 3.6Å; L457-F517 HydrophobicContact CD1-CE1 4.3Å; L457-F517 HydrophobicContact CD1-CE2 3.65Å; L457-F517 HydrophobicContact CD1-CG 3.91Å; L457-F517 HydrophobicContact CD1-CZ 4.01Å; L457-F517 HydrophobicContact CD2-CB 3.83Å; L457-F517 HydrophobicContact CD2-CD2 4.17Å; L457-F517 HydrophobicContact CD2-CG 4.04Å; L457-F517 HydrophobicContact CG-CB 4.14Å; L457-F517 HydrophobicContact CG-CD2 3.51Å; L457-F517 HydrophobicContact CG-CE2 4.02Å; L457-F517 HydrophobicContact CG-CG 3.87Å; V480-F517 HydrophobicContact CB-CE1 3.87Å; V480-F517 HydrophobicContact CB-CZ 4.11Å; V480-F517 HydrophobicContact CG1-CE1 4Å; V480-F517 HydrophobicContact CG2-CE1 4.06Å; V480-F517 HydrophobicContact CG2-CZ 4.28Å; L490-F517 HydrophobicContact CD1-CB 4.24Å; L490-F517 HydrophobicContact CD1-CD1 3.85Å; L490-F517 HydrophobicContact CD1-CG 4.4Å; V515-F517 HydrophobicContact CG2-CD1 4.1Å; V515-F517 HydrophobicContact CG2-CE1 4.15Å; F517-L519 HydrophobicContact CD2-CD2 4.13Å; F517-L519 HydrophobicContact CD2-CG 4.14Å; F517-L519 HydrophobicContact CE2-CD1 4.23Å; F517-L519 HydrophobicContact CE2-CD2 3.86Å; F517-L519 HydrophobicContact CE2-CG 3.88Å; F517-W530 VanDerWaalsContact C-CE3 3.45Å; F517-W530 WeakPolarHBondContact O-CA 3.48Å; F517-I531 HydrophobicContact CD2-CG1 4.09Å; F517-I531 HydrophobicContact CE2-CD1 3.64Å; F517-I531 HydrophobicContact CE2-CG1 3.64Å; F517-I531 HydrophobicContact CZ-CD1 3.81Å; F517-I531 HydrophobicContact CZ-CG1 3.95Å; F517-I531 PolarHBondContact N-O 2.86Å; F517-I531 VanDerWaalsContact N-O 3.13Å; F517-I531 PolarHBondContact O-N 2.85Å; F517-A533 HydrophobicContact CE1-CB 3.79Å; F517-A533 HydrophobicContact CZ-CB 3.95Å; F517-V574 HydrophobicContact CE2-CG1 4.31Å; F517-V574 HydrophobicContact CE2-CG2 4.26Å; F517-V574 HydrophobicContact CZ-CG1 4.04Å; F517-V574 HydrophobicContact CZ-CG2 4.06Å
518	C	97.7	Very high	88.6	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.02	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.4	178.8	-179.6	0	0	0	0	111.6	L457 I458 R528 K529 W530	L457-C518 CarbonylContact C-O 3.05Å; L457-C518 WeakPolarHBondContact CA-O 3.48Å; I458-C518 HydrophobicContact CB-CB 4.34Å; I458-C518 PolarHBondContact N-O 3.39Å; I458-C518 PolarHBondContact O-N 3.39Å; C518-R528 VanDerWaalsContact SG-CB 3.56Å; C518-K529 CarbonylContact C-O 3.59Å; C518-K529 VanDerWaalsContact CA-O 3.3Å; C518-K529 WeakPolarHBondContact CA-O 3.17Å; C518-W530 HydrophobicContact CB-CD2 3.81Å; C518-W530 HydrophobicContact CB-CE3 4.23Å; C518-W530 HydrophobicContact CB-CG 4.19Å; C518-W530 HydrophobicContact CB-CH2 4.44Å; C518-W530 HydrophobicContact CB-CZ2 4.04Å
519	L	98.4	Very high	90.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	139.8	170.1	-66.3	177.7	0	0	0	110.9	A455 L457 V467 F517 K529 I531 V574 I576 F584 F604	A455-L519 HydrophobicContact CB-CD2 4.25Å; L457-L519 HydrophobicContact CB-CD2 3.92Å; L457-L519 HydrophobicContact CG-CD2 4.17Å; V467-L519 HydrophobicContact CG2-CD2 3.99Å; F517-L519 HydrophobicContact CD2-CD2 4.13Å; F517-L519 HydrophobicContact CD2-CG 4.14Å; F517-L519 HydrophobicContact CE2-CD1 4.23Å; F517-L519 HydrophobicContact CE2-CD2 3.86Å; F517-L519 HydrophobicContact CE2-CG 3.88Å; L519-K529 PolarHBondContact N-O 2.81Å; L519-K529 PolarHBondContact O-N 3.1Å; L519-I531 HydrophobicContact CD1-CD1 3.85Å; L519-V574 HydrophobicContact CD1-CG1 4.39Å; L519-I576 HydrophobicContact CD1-CD1 3.87Å; L519-I576 HydrophobicContact CD1-CG1 4.37Å; L519-F584 HydrophobicContact CB-CE1 3.83Å; L519-F584 HydrophobicContact CB-CZ 4.09Å; L519-F584 HydrophobicContact CD1-CE1 4.07Å; L519-F584 HydrophobicContact CD1-CZ 3.85Å; L519-F584 HydrophobicContact CG-CZ 4.48Å; L519-F604 HydrophobicContact CB-CE1 4.13Å; L519-F604 HydrophobicContact CB-CZ 3.94Å; L519-F604 HydrophobicContact CD1-CZ 4.23Å
520	T	96.5	Very high	91.3	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	156.4	-177.9	68.4	0	0	0	0	111.7	K456 I458 R528	K456-T520 PolarHBondContact N-O 3.41Å; K456-T520 PolarHBondContact O-N 2.73Å; K456-T520 PolarHBondContact O-OG1 2.82Å; I458-T520 HydrophobicContact CD1-CG2 3.91Å; T520-R528 HydrophobicContact CG2-CB 4.2Å; T520-R528 HydrophobicContact CG2-CG 3.63Å
521	P	95.1	Very high	92.4	Very high	9 Å²	9	55.9 Å²	55.9	6%	0.058	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	142	171.7	-24	37.7	0	0	0	111.5	A523 G525 K526 P527 I603 F604	P521-A523 PolarHBondContact O-N 2.94Å; P521-G525 PolarHBondContact O-N 2.83Å; P521-K526 WeakPolarHBondContact CG-O 3.47Å; P521-P527 VanDerWaalsContact CD-O 3.27Å; P521-P527 WeakPolarHBondContact CD-O 3.45Å; P521-I603 WeakPolarHBondContact CG-O 3.42Å; P521-F604 HydrophobicContact CG-CD1 4.43Å
522	V	92.3	Very high	93.2	Very high	72 Å²	72	56.2 Å²	56.2	44%	0.436	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-43.2	-173.2	-179	0	0	0	0	112.4	Q454 L466	Q454-V522 HydrophobicContact CB-CG2 4.06Å; Q454-V522 WeakPolarHBondContact O-CG2 3.4Å; L466-V522 HydrophobicContact CD1-CB 4.4Å; L466-V522 HydrophobicContact CD1-CG1 3.89Å; L466-V522 HydrophobicContact CD1-CG2 3.61Å
523	A	84.7	Confident	93.8	Very high	97 Å²	97	56.2 Å²	56.2	80%	0.802	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-46.6	-174.9	0	0	0	0	0	113.7	P521	P521-A523 PolarHBondContact O-N 2.94Å
524	Q	77.1	Confident	93.8	Very high	155 Å²	155	54 Å²	54	72%	0.724	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-19.4	-167.1	-64.2	176.4	1.3	0	0	113.7	K526	Q524-K526 PolarHBondContact O-N 3.37Å
525	G	81.6	Confident	93.9	Very high	20 Å²	20	54.1 Å²	54.1	21%	0.206	27%	0.27	C	S	.	.			trans	64.7	3.7	-179.8	0	0	0	0	0	115.9	P521 R528	P521-G525 PolarHBondContact O-N 2.83Å; G525-R528 WeakPolarHBondContact O-CG 3.4Å; G525-R528 PolarHBondContact O-NE 2.96Å
526	K	87.9	Confident	93.6	Very high	151 Å²	151	54.4 Å²	54.4	66%	0.657	27%	0.272	S	S	*	.			trans	-138.8	150.5	173.2	-70.4	-174.1	-179.3	-179.2	0	109.3	P521 Q524	P521-K526 WeakPolarHBondContact CG-O 3.47Å; Q524-K526 PolarHBondContact O-N 3.37Å
527	P	91.2	Very high	93.3	Very high	64 Å²	64	52.4 Å²	52.4	42%	0.416	27%	0.269	S	S	.	.	S	Bend	cis	-69.4	161.2	-4.2	31.6	-35.5	0	0	0	111.8	P521 I603	P521-P527 VanDerWaalsContact CD-O 3.27Å; P521-P527 WeakPolarHBondContact CD-O 3.45Å; P527-I603 HydrophobicContact CG-CB 3.67Å; P527-I603 HydrophobicContact CG-CD1 4.24Å; P527-I603 HydrophobicContact CG-CG2 3.65Å
528	R	92.9	Very high	92.8	Very high	151 Å²	151	58 Å²	58	57%	0.57	30%	0.295	S	S	*	.			trans	-107.5	126.9	179.7	-65.5	-153.6	177.7	167.1	2	108.8	C518 T520 G525	C518-R528 VanDerWaalsContact SG-CB 3.56Å; T520-R528 HydrophobicContact CG2-CB 4.2Å; T520-R528 HydrophobicContact CG2-CG 3.63Å; G525-R528 WeakPolarHBondContact O-CG 3.4Å; G525-R528 PolarHBondContact O-NE 2.96Å
529	K	96.7	Very high	92.4	Very high	68 Å²	68	59.7 Å²	59.7	30%	0.296	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.4	176.6	-72.2	-68.7	-168.8	155.4	0	109.7	C518 L519 D583 F584 I603	C518-K529 CarbonylContact C-O 3.59Å; C518-K529 VanDerWaalsContact CA-O 3.3Å; C518-K529 WeakPolarHBondContact CA-O 3.17Å; L519-K529 PolarHBondContact N-O 2.81Å; L519-K529 PolarHBondContact O-N 3.1Å; K529-D583 HydrophobicContact CD-CB 4.39Å; K529-D583 VanDerWaalsContact CE-O 3.29Å; K529-D583 WeakPolarHBondContact CE-O 3.24Å; K529-D583 IonicContact NZ-OD1 3.3Å; K529-D583 PolarHBondContact NZ-OD1 2.78Å; K529-F584 HydrophobicContact CB-CE1 3.63Å; K529-F584 HydrophobicContact CB-CE2 4.43Å; K529-F584 HydrophobicContact CB-CZ 3.59Å; K529-F584 HydrophobicContact CG-CE1 4.16Å; K529-F584 HydrophobicContact CG-CZ 4.4Å; K529-I603 HydrophobicContact CB-CD1 4.37Å; K529-I603 HydrophobicContact CG-CD1 3.83Å
530	W	97.4	Very high	91.7	Very high	141 Å²	141	61.9 Å²	61.9	53%	0.534	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.3	173.9	-76.8	88.3	0	0	0	109.3	P460 F517 C518	P460-W530 HydrophobicContact CB-CH2 4.13Å; P460-W530 HydrophobicContact CB-CZ3 4.39Å; F517-W530 VanDerWaalsContact C-CE3 3.45Å; F517-W530 WeakPolarHBondContact O-CA 3.48Å; C518-W530 HydrophobicContact CB-CD2 3.81Å; C518-W530 HydrophobicContact CB-CE3 4.23Å; C518-W530 HydrophobicContact CB-CG 4.19Å; C518-W530 HydrophobicContact CB-CH2 4.44Å; C518-W530 HydrophobicContact CB-CZ2 4.04Å
531	I	98.1	Very high	91	Very high	3 Å²	3	63.8 Å²	63.8	2%	0.015	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	151.7	175.2	68.1	172	0	0	0	110.3	E516 F517 L519 V574 Y580 F584	E516-I531 WeakPolarHBondContact CA-O 3.27Å; F517-I531 HydrophobicContact CD2-CG1 4.09Å; F517-I531 HydrophobicContact CE2-CD1 3.64Å; F517-I531 HydrophobicContact CE2-CG1 3.64Å; F517-I531 HydrophobicContact CZ-CD1 3.81Å; F517-I531 HydrophobicContact CZ-CG1 3.95Å; F517-I531 PolarHBondContact N-O 2.86Å; F517-I531 VanDerWaalsContact N-O 3.13Å; F517-I531 PolarHBondContact O-N 2.85Å; L519-I531 HydrophobicContact CD1-CD1 3.85Å; I531-V574 HydrophobicContact CD1-CG1 4.27Å; I531-Y580 HydrophobicContact CB-CD1 4.23Å; I531-Y580 HydrophobicContact CB-CD2 3.89Å; I531-Y580 HydrophobicContact CB-CE1 4.21Å; I531-Y580 HydrophobicContact CB-CE2 3.88Å; I531-Y580 HydrophobicContact CB-CG 4.06Å; I531-Y580 HydrophobicContact CG2-CD1 3.66Å; I531-Y580 HydrophobicContact CG2-CD2 3.96Å; I531-Y580 HydrophobicContact CG2-CE1 4.05Å; I531-Y580 HydrophobicContact CG2-CE2 4.34Å; I531-Y580 HydrophobicContact CG2-CG 3.6Å; I531-F584 HydrophobicContact CG2-CE2 3.63Å; I531-F584 HydrophobicContact CG2-CZ 3.69Å
532	K	97.9	Very high	90.5	Very high	73 Å²	73	67 Å²	67	32%	0.317	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.9	168	-175.1	176.7	172.7	-171.4	0	108.3	E495 S514 V515 E516 Y580	E495-K532 VanDerWaalsContact OE1-CE 3.29Å; E495-K532 WeakPolarHBondContact OE1-CE 3.48Å; E495-K532 IonicContact OE1-NZ 2.79Å; E495-K532 PolarHBondContact OE1-NZ 3.46Å; S514-K532 WeakPolarHBondContact OG-CE 3.35Å; S514-K532 WeakPolarHBondContact OG-CG 3.43Å; V515-K532 CarbonylContact O-C 3.51Å; V515-K532 WeakPolarHBondContact O-CA 3.46Å; E516-K532 HydrophobicContact CG-CB 4Å; E516-K532 HydrophobicContact CG-CG 4.08Å; K532-Y580 PolarHBondContact N-OH 3.12Å; K532-Y580 VanDerWaalsContact N-OH 3.14Å; K532-Y580 WeakPolarHBondContact O-CE2 3.33Å
533	A	98	Very high	90.1	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.008	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.1	-176.9	0	0	0	0	0	112.3	S478 V480 V515 F517	S478-A533 VanDerWaalsContact O-CA 3.31Å; S478-A533 WeakPolarHBondContact O-CA 3.35Å; V480-A533 HydrophobicContact CB-CB 4.36Å; V480-A533 HydrophobicContact CG1-CB 4.25Å; V515-A533 PolarHBondContact N-O 3.5Å; V515-A533 PolarHBondContact O-N 3.31Å; F517-A533 HydrophobicContact CE1-CB 3.79Å; F517-A533 HydrophobicContact CZ-CB 3.95Å
534	L	96.6	Very high	90	Very high	5 Å²	5	63.2 Å²	63.2	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	131	-179.2	-66.3	162.3	0	0	0	111	R477 S478 F479 V480 E495 I497 A512 V536	R477-L534 HydrophobicContact CB-CD1 4.25Å; R477-L534 HydrophobicContact CG-CD1 4.46Å; S478-L534 PolarHBondContact O-N 3.17Å; F479-L534 CarbonylContact C-O 3.59Å; F479-L534 VanDerWaalsContact CA-O 3.3Å; F479-L534 WeakPolarHBondContact CA-O 2.99Å; F479-L534 HydrophobicContact CD1-CB 3.65Å; F479-L534 HydrophobicContact CD1-CD1 4.45Å; F479-L534 HydrophobicContact CE1-CB 3.81Å; F479-L534 HydrophobicContact CE1-CD1 3.83Å; F479-L534 HydrophobicContact CE1-CG 4.48Å; F479-L534 HydrophobicContact CZ-CD1 4.22Å; V480-L534 PolarHBondContact N-O 3.35Å; E495-L534 HydrophobicContact CB-CD2 4.3Å; I497-L534 HydrophobicContact CD1-CD1 4.16Å; I497-L534 HydrophobicContact CG2-CD1 3.87Å; I497-L534 HydrophobicContact CG2-CD2 4.12Å; A512-L534 HydrophobicContact CB-CB 4.15Å; A512-L534 HydrophobicContact CB-CD2 4.12Å; L534-V536 PolarHBondContact O-N 3.34Å
535	C	97.1	Very high	90.3	Very high	5 Å²	5	57.6 Å²	57.6	3%	0.034	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	118.3	177.9	-69.3	0	0	0	0	111.2	V480 K482 A485 R513	V480-C535 WeakPolarHBondContact O-CA 3.32Å; K482-C535 HydrophobicContact CB-CB 4.27Å; K482-C535 HydrophobicContact CG-CB 4.33Å; A485-C535 WeakPolarHBondContact CB-SG 3.37Å; R513-C535 HydrophobicContact CB-CB 4.15Å; R513-C535 VanDerWaalsContact O-CB 3.31Å; R513-C535 WeakPolarHBondContact O-CB 3.31Å; R513-C535 PolarHBondContact O-N 3.42Å; R513-C535 PolarHBondContact O-SG 2.94Å; R513-C535 VanDerWaalsContact O-SG 3.35Å
536	V	91.9	Very high	90.6	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.055	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.4	173.9	-68.7	0	0	0	0	110.6	F479 V480 R481 K482 I499 L534 Q538 I539	F479-V536 HydrophobicContact CB-CG2 4.13Å; F479-V536 HydrophobicContact CD1-CG1 3.69Å; F479-V536 HydrophobicContact CD1-CG2 4.2Å; F479-V536 HydrophobicContact CE1-CG1 4.11Å; V480-V536 PolarHBondContact O-N 3.22Å; R481-V536 CarbonylContact C-O 3.59Å; R481-V536 WeakPolarHBondContact CA-O 3.46Å; K482-V536 WeakPolarHBondContact CB-O 3.32Å; K482-V536 PolarHBondContact N-O 2.8Å; I499-V536 HydrophobicContact CD1-CG1 4.13Å; L534-V536 PolarHBondContact O-N 3.34Å; V536-Q538 PolarHBondContact O-N 3.42Å; V536-I539 HydrophobicContact CG2-CG1 3.84Å
537	P	91.8	Very high	90.4	Very high	73 Å²	73	50.8 Å²	50.8	47%	0.474	27%	0.27	S	S	.	.	S	Bend	trans	-56.7	-36.3	-178.3	-25.5	34.4	0	0	0	113.5	R481	R481-P537 VanDerWaalsContact CG-O 3.29Å; R481-P537 WeakPolarHBondContact CG-O 3.28Å
538	Q	87.5	Confident	90.2	Very high	119 Å²	119	51.7 Å²	51.7	56%	0.556	28%	0.276	S	S	*	.			trans	-147.8	138.4	178.5	-176.8	175.7	2.6	0	0	108.4	V536 C540	V536-Q538 PolarHBondContact O-N 3.42Å; Q538-C540 WeakPolarHBondContact CG-O 3.33Å; Q538-C540 PolarHBondContact NE2-O 3.25Å
539	I	89	Confident	89.8	Confident	37 Å²	37	46.8 Å²	46.8	19%	0.19	26%	0.258	C	S	.	.	S	Bend	trans	-85.2	-57	177.4	-66	174.3	0	0	0	109.6	F479 V536 V572 D573 L575	F479-I539 HydrophobicContact CB-CG1 4.45Å; V536-I539 HydrophobicContact CG2-CG1 3.84Å; I539-V572 HydrophobicContact CB-CB 4.5Å; I539-V572 HydrophobicContact CD1-CG1 4.01Å; I539-V572 HydrophobicContact CG2-CB 4.39Å; I539-V572 HydrophobicContact CG2-CG1 4.11Å; I539-D573 WeakPolarHBondContact CD1-O 3.42Å; I539-L575 HydrophobicContact CD1-CB 4.3Å; I539-L575 HydrophobicContact CG2-CB 3.77Å; I539-L575 HydrophobicContact CG2-CD1 3.8Å; I539-L575 HydrophobicContact CG2-CG 4.43Å
540	C	84.1	Confident	89.2	Confident	46 Å²	46	45.3 Å²	45.3	31%	0.311	26%	0.257	S	S	.	.	S	Bend	trans	-151	178.3	177.3	62.6	0	0	0	0	110.3	Q538 V572	Q538-C540 WeakPolarHBondContact CG-O 3.33Å; Q538-C540 PolarHBondContact NE2-O 3.25Å; C540-V572 WeakPolarHBondContact SG-CG2 3.47Å
541	G	81.6	Confident	88.4	Confident	41 Å²	41	47.7 Å²	47.7	42%	0.423	27%	0.271	S	S	.	.	S	Bend	trans	-61.3	165.1	166.7	0	0	0	0	0	112	L543	G541-L543 PolarHBondContact O-N 2.96Å
542	P	84.6	Confident	87.5	Confident	76 Å²	76	53.7 Å²	53.7	49%	0.494	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-56	135.1	175.3	-22	32.5	0	0	0	111.2	E571	P542-E571 HydrophobicContact CB-CG 4.4Å; P542-E571 HydrophobicContact CG-CG 4.2Å
543	L	85	Confident	86.9	Confident	18 Å²	18	50.7 Å²	50.7	9%	0.094	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-67.8	135.5	172.8	-61.8	172.5	0	0	0	109.8	L450 T452 M468 G541 R567 T569 K570 V572	L450-L543 HydrophobicContact CD1-CD2 4.32Å; T452-L543 HydrophobicContact CG2-CD1 3.57Å; M468-L543 HydrophobicContact CG-CD1 4.21Å; G541-L543 PolarHBondContact O-N 2.96Å; L543-R567 PolarHBondContact O-NH1 2.95Å; L543-T569 VanDerWaalsContact O-CA 3.23Å; L543-T569 WeakPolarHBondContact O-CA 3.38Å; L543-K570 WeakPolarHBondContact CB-O 3.46Å; L543-K570 PolarHBondContact N-O 3.4Å; L543-K570 PolarHBondContact O-N 3.21Å; L543-K570 VanDerWaalsContact O-N 3.14Å; L543-V572 HydrophobicContact CD1-CG2 3.54Å; L543-V572 HydrophobicContact CD2-CG2 3.91Å; L543-V572 HydrophobicContact CG-CG2 3.59Å
544	D	81.9	Confident	86.3	Confident	72 Å²	72	59.2 Å²	59.2	39%	0.385	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-55.2	156.5	173	-70.9	-27.8	0	0	0	112	R567 T621	D544-R567 PolarHBondContact O-NH1 3.5Å; D544-R567 PolarHBondContact O-NH2 3.4Å; D544-T621 WeakPolarHBondContact OD2-CB 3.39Å; D544-T621 PolarHBondContact OD2-OG1 3.02Å
545	A	83.9	Confident	85.9	Confident	37 Å²	37	60.7 Å²	60.7	31%	0.306	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-61	140.8	178.8	0	0	0	0	0	112.6	K447 R567	K447-A545 VanDerWaalsContact CE-O 3.28Å; K447-A545 WeakPolarHBondContact CE-O 3.15Å; K447-A545 PolarHBondContact NZ-O 2.79Å; A545-R567 CarbonylContact C-O 3.45Å; A545-R567 WeakPolarHBondContact CA-O 3.46Å; A545-R567 WeakPolarHBondContact CB-O 3.43Å
546	N	86.9	Confident	85.5	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.064	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-79.6	137.5	169.9	-66	-7.6	0	0	0	109.5	D563 Q564 F565 P566 R567	N546-D563 VanDerWaalsContact ND2-CG 3.35Å; N546-D563 PolarHBondContact ND2-OD2 3.03Å; N546-Q564 WeakPolarHBondContact CB-O 3.1Å; N546-Q564 PolarHBondContact ND2-O 3.41Å; N546-F565 HydrophobicContact CB-CD1 3.69Å; N546-F565 HydrophobicContact CB-CE1 3.61Å; N546-F565 HydrophobicContact CB-CG 4.32Å; N546-F565 HydrophobicContact CB-CZ 4.2Å; N546-F565 WeakPolarHBondContact ND2-CZ 3.36Å; N546-P566 WeakPolarHBondContact O-CA 3.42Å; N546-P566 WeakPolarHBondContact O-CB 3.41Å; N546-R567 HydrophobicContact CB-CB 3.88Å; N546-R567 PolarHBondContact N-O 3.39Å; N546-R567 PolarHBondContact ND2-NE 3.36Å; N546-R567 PolarHBondContact O-N 3.34Å; N546-R567 PolarHBondContact OD1-NH2 3.02Å
547	P	85.2	Confident	85.2	Confident	15 Å²	15	61.2 Å²	61.2	10%	0.097	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-68.4	165.6	175.4	30.8	-35.6	0	0	0	111.4	I449 W553 F565 P566 T612	I449-P547 HydrophobicContact CD1-CG 4.44Å; P547-W553 HydrophobicContact CG-CH2 4.23Å; P547-F565 WeakPolarHBondContact O-CD1 3.33Å; P547-P566 WeakPolarHBondContact O-CA 3.49Å; P547-T612 HydrophobicContact CG-CG2 4.28Å
548	P	85.7	Confident	84.6	Confident	83 Å²	83	64.3 Å²	64.3	54%	0.539	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-58.9	146	169	-20.8	32.9	0	0	0	111.5	S550 P566	P548-S550 PolarHBondContact O-N 3.22Å; P548-S550 VanDerWaalsContact O-N 3.11Å; P548-P566 HydrophobicContact CG-CB 4.32Å
549	F	85.5	Confident	84.3	Confident	48 Å²	48	67.9 Å²	67.9	21%	0.211	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-61.2	116.9	175.4	-171.3	-80.5	0	0	0	110.5	W553 L556 K558 L561 F565 L608	F549-W553 HydrophobicContact CD1-CE3 4.43Å; F549-W553 AromaticContact CD2-CE3 3.91Å; F549-W553 HydrophobicContact CD2-CE3 3.91Å; F549-W553 HydrophobicContact CD2-CZ3 4.17Å; F549-W553 HydrophobicContact CE1-CB 4.43Å; F549-W553 HydrophobicContact CE2-CE3 4.06Å; F549-W553 HydrophobicContact CG-CE3 4.12Å; F549-W553 HydrophobicContact CG-CZ3 4.36Å; F549-W553 HydrophobicContact CZ-CB 4.3Å; F549-W553 HydrophobicContact CZ-CE3 4.37Å; F549-L556 HydrophobicContact CE2-CB 4.21Å; F549-L556 HydrophobicContact CZ-CB 3.97Å; F549-K558 HydrophobicContact CE1-CG 3.98Å; F549-K558 HydrophobicContact CZ-CG 4.2Å; F549-L561 HydrophobicContact CD2-CD1 3.8Å; F549-L561 HydrophobicContact CE2-CD1 4.16Å; F549-F565 HydrophobicContact CB-CB 4.1Å; F549-F565 PolarHBondContact N-O 3.3Å; F549-L608 HydrophobicContact CD2-CD1 3.84Å; F549-L608 HydrophobicContact CE2-CD1 3.79Å
550	S	84.1	Confident	84.2	Confident	38 Å²	38	71 Å²	71	27%	0.266	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-74.5	139.3	-177	-177.8	0	0	0	0	111.9	P548 M552 W553	P548-S550 PolarHBondContact O-N 3.22Å; P548-S550 VanDerWaalsContact O-N 3.11Å; S550-M552 PolarHBondContact O-N 3.26Å; S550-M552 PolarHBondContact OG-N 3.24Å; S550-W553 VanDerWaalsContact CB-CE2 3.47Å; S550-W553 PolarHBondContact O-N 2.98Å
551	K	79.3	Confident	84.6	Confident	190 Å²	190	71 Å²	71	83%	0.826	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.1	171.7	-65.3	-176.3	-178.5	175.9	0	112.8
552	M	79.7	Confident	85.1	Confident	129 Å²	129	69.3 Å²	69.3	64%	0.635	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-26.2	178.8	-65.7	178.5	62.1	0	0	112.9	S550 K554	S550-M552 PolarHBondContact O-N 3.26Å; S550-M552 PolarHBondContact OG-N 3.24Å; M552-K554 PolarHBondContact O-N 3.1Å
553	W	86.2	Confident	85.5	Confident	11 Å²	11	66 Å²	66	4%	0.042	32%	0.323	C	S	.	.			trans	-77.8	55.3	-177.4	-52.3	-23.2	0	0	0	112.4	P547 F549 S550 H555 L556 P597 L608 T612	P547-W553 HydrophobicContact CG-CH2 4.23Å; F549-W553 HydrophobicContact CD1-CE3 4.43Å; F549-W553 AromaticContact CD2-CE3 3.91Å; F549-W553 HydrophobicContact CD2-CE3 3.91Å; F549-W553 HydrophobicContact CD2-CZ3 4.17Å; F549-W553 HydrophobicContact CE1-CB 4.43Å; F549-W553 HydrophobicContact CE2-CE3 4.06Å; F549-W553 HydrophobicContact CG-CE3 4.12Å; F549-W553 HydrophobicContact CG-CZ3 4.36Å; F549-W553 HydrophobicContact CZ-CB 4.3Å; F549-W553 HydrophobicContact CZ-CE3 4.37Å; S550-W553 VanDerWaalsContact CB-CE2 3.47Å; S550-W553 PolarHBondContact O-N 2.98Å; W553-H555 PolarHBondContact O-N 2.92Å; W553-L556 HydrophobicContact CB-CB 4.22Å; W553-L556 HydrophobicContact CB-CD1 3.7Å; W553-L556 HydrophobicContact CB-CG 4.06Å; W553-L556 HydrophobicContact CD2-CD1 4.27Å; W553-L556 HydrophobicContact CE3-CD1 4.28Å; W553-L556 HydrophobicContact CG-CD1 4.06Å; W553-L556 PolarHBondContact O-N 3.46Å; W553-P597 VanDerWaalsContact CD1-CD 3.49Å; W553-P597 HydrophobicContact CD2-CG 3.54Å; W553-P597 HydrophobicContact CE3-CG 3.99Å; W553-P597 HydrophobicContact CG-CG 3.96Å; W553-P597 HydrophobicContact CH2-CG 4.14Å; W553-P597 HydrophobicContact CZ2-CG 3.72Å; W553-P597 HydrophobicContact CZ3-CG 4.25Å; W553-L608 HydrophobicContact CZ3-CD1 4.39Å; W553-T612 HydrophobicContact CH2-CG2 4.22Å; W553-T612 HydrophobicContact CZ2-CG2 3.94Å
554	K	84.2	Confident	85.8	Confident	180 Å²	180	70 Å²	70	78%	0.783	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.4	-172.4	-66.2	-179.2	-177	175.8	0	113.2	M552 L556	M552-K554 PolarHBondContact O-N 3.1Å; K554-L556 VanDerWaalsContact C-N 3.27Å
555	H	88.9	Confident	86.2	Confident	36 Å²	36	67.8 Å²	67.8	17%	0.167	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-21.2	175	62	-59.9	0	0	0	112.7	W553 R590 N592 E596 P597	W553-H555 PolarHBondContact O-N 2.92Å; H555-R590 WeakPolarHBondContact O-CD 3.36Å; H555-N592 HydrophobicContact CB-CB 4.3Å; H555-E596 IonicContact CE1-OE2 3.65Å; H555-E596 PolarHBondContact CE1-OE2 2.97Å; H555-E596 IonicContact ND1-OE2 2.82Å; H555-E596 PolarHBondContact ND1-OE2 3.39Å; H555-P597 PolarHBondContact NE2-O 3.27Å
556	L	89.7	Confident	86.4	Confident	4 Å²	4	70 Å²	70	2%	0.021	34%	0.34	C	S	.	.	S	Bend	trans	-88.6	141.7	-177	-57.4	178.5	0	0	0	111.1	F549 W553 K554 K558 R590 P597 L608	F549-L556 HydrophobicContact CE2-CB 4.21Å; F549-L556 HydrophobicContact CZ-CB 3.97Å; W553-L556 HydrophobicContact CB-CB 4.22Å; W553-L556 HydrophobicContact CB-CD1 3.7Å; W553-L556 HydrophobicContact CB-CG 4.06Å; W553-L556 HydrophobicContact CD2-CD1 4.27Å; W553-L556 HydrophobicContact CE3-CD1 4.28Å; W553-L556 HydrophobicContact CG-CD1 4.06Å; W553-L556 PolarHBondContact O-N 3.46Å; K554-L556 VanDerWaalsContact C-N 3.27Å; L556-K558 PolarHBondContact O-N 2.66Å; L556-R590 HydrophobicContact CD2-CB 4.4Å; L556-P597 HydrophobicContact CD1-CB 4.08Å; L556-P597 HydrophobicContact CD1-CG 3.69Å; L556-P597 WeakPolarHBondContact CD1-O 3.46Å; L556-L608 HydrophobicContact CB-CD2 4.3Å; L556-L608 HydrophobicContact CD1-CD2 3.97Å; L556-L608 HydrophobicContact CD2-CD2 4.3Å; L556-L608 HydrophobicContact CG-CD2 4.4Å
557	P	84.3	Confident	86.5	Confident	20 Å²	20	70.1 Å²	70.1	13%	0.13	34%	0.339	C	S	.	.			trans	-67.3	134.4	176.9	24.2	-27	0	0	0	110.5	Y559 L561 W606	P557-Y559 VanDerWaalsContact C-N 3.33Å; P557-L561 WeakPolarHBondContact O-CD2 3.19Å; P557-W606 HydrophobicContact CB-CD2 4.47Å; P557-W606 HydrophobicContact CB-CG 4.16Å; P557-W606 HydrophobicContact CG-CB 3.61Å; P557-W606 HydrophobicContact CG-CD2 3.34Å; P557-W606 HydrophobicContact CG-CE3 3.95Å; P557-W606 HydrophobicContact CG-CG 3.15Å; P557-W606 HydrophobicContact CG-CZ2 4.44Å
558	K	78.7	Confident	86.7	Confident	138 Å²	138	71.9 Å²	71.9	60%	0.6	36%	0.36	S	S	*	.	S	Bend	trans	-81.7	-13.8	178.2	-63.7	-179	-179.4	176	0	113.5	F549 L556	F549-K558 HydrophobicContact CE1-CG 3.98Å; F549-K558 HydrophobicContact CZ-CG 4.2Å; L556-K558 PolarHBondContact O-N 2.66Å
559	Y	81.8	Confident	86.8	Confident	194 Å²	194	72.9 Å²	72.9	76%	0.761	37%	0.365	S	S	*	.	S	Bend	trans	-126.1	158.9	-174.4	-48.6	-75.6	0	0	0	110	P557 L561	P557-Y559 VanDerWaalsContact C-N 3.33Å; Y559-L561 VanDerWaalsContact C-N 3.32Å; Y559-L561 PolarHBondContact O-N 3.38Å
560	N	87.6	Confident	87	Confident	104 Å²	104	73.7 Å²	73.7	56%	0.556	37%	0.368	S	S	*	.	S	Bend	trans	57.6	40.9	-178.6	-164.4	41.8	0	0	0	113.3	G605 W606	N560-G605 CarbonylContact O-C 3.43Å; N560-G605 VanDerWaalsContact O-CA 3.27Å; N560-G605 WeakPolarHBondContact O-CA 3.32Å; N560-W606 PolarHBondContact O-N 3.41Å
561	L	92.2	Very high	87.4	Confident	44 Å²	44	76.6 Å²	76.6	23%	0.23	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-72.5	139.7	170.6	-63.1	-179.7	0	0	0	109.9	F549 P557 Y559 D563 F565 W606 L608	F549-L561 HydrophobicContact CD2-CD1 3.8Å; F549-L561 HydrophobicContact CE2-CD1 4.16Å; P557-L561 WeakPolarHBondContact O-CD2 3.19Å; Y559-L561 VanDerWaalsContact C-N 3.32Å; Y559-L561 PolarHBondContact O-N 3.38Å; L561-D563 VanDerWaalsContact C-N 3.3Å; L561-D563 WeakPolarHBondContact CB-O 3.23Å; L561-F565 HydrophobicContact CD1-CD2 4.06Å; L561-W606 WeakPolarHBondContact CA-O 3.19Å; L561-W606 HydrophobicContact CD2-CB 4.07Å; L561-L608 HydrophobicContact CD1-CD1 4.12Å; L561-L608 HydrophobicContact CD2-CD1 3.92Å; L561-L608 HydrophobicContact CD2-CD2 3.9Å; L561-L608 HydrophobicContact CD2-CG 3.89Å
562	S	92.4	Very high	88.2	Confident	6 Å²	6	67.7 Å²	67.7	4%	0.042	34%	0.339	C	S	.	.	S	Bend	trans	-73.6	-23	178.8	61.3	0	0	0	0	112.7	T452 A453 Q454 W606 I607	T452-S562 PolarHBondContact O-OG 3.08Å; T452-S562 VanDerWaalsContact O-OG 3.12Å; A453-S562 CarbonylContact C-O 3.42Å; Q454-S562 PolarHBondContact N-O 3.19Å; S562-W606 PolarHBondContact N-O 3.28Å; S562-W606 PolarHBondContact OG-O 2.86Å; S562-I607 VanDerWaalsContact OG-CA 3.29Å; S562-I607 WeakPolarHBondContact OG-CA 3.46Å; S562-I607 VanDerWaalsContact OG-CG1 3.24Å; S562-I607 WeakPolarHBondContact OG-CG1 3.36Å
563	D	92.9	Very high	89.1	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.032	31%	0.314	C	S	.	.	S	Bend	trans	-129.3	166.2	175.7	-163.4	5.9	0	0	0	110.7	T452 M468 N546 L561 F565 R567	T452-D563 PolarHBondContact OG1-OD2 3.42Å; M468-D563 WeakPolarHBondContact CE-OD1 3.41Å; N546-D563 VanDerWaalsContact ND2-CG 3.35Å; N546-D563 PolarHBondContact ND2-OD2 3.03Å; L561-D563 VanDerWaalsContact C-N 3.3Å; L561-D563 WeakPolarHBondContact CB-O 3.23Å; D563-F565 HydrophobicContact CB-CE2 4.06Å; D563-F565 WeakPolarHBondContact O-CD2 3.49Å; D563-R567 WeakPolarHBondContact OD1-CD 3.47Å; D563-R567 IonicContact OD1-NE 3.99Å; D563-R567 IonicContact OD2-NE 3.79Å; D563-R567 PolarHBondContact OD2-NE 3.45Å
564	Q	90.8	Very high	89.7	Confident	103 Å²	103	61.9 Å²	61.9	48%	0.481	31%	0.312	S	S	.	.			trans	-84.4	138.5	-179.2	-63.7	174.1	7.8	0	0	110.9	N546 P566 R567	N546-Q564 WeakPolarHBondContact CB-O 3.1Å; N546-Q564 PolarHBondContact ND2-O 3.41Å; Q564-P566 CarbonylContact C-O 3.43Å; Q564-P566 CarbonylContact O-C 3.57Å; Q564-R567 HydrophobicContact CB-CB 4.09Å; Q564-R567 WeakPolarHBondContact O-CB 3.17Å
565	F	89.7	Confident	90.3	Very high	26 Å²	26	54 Å²	54	11%	0.114	28%	0.278	C	S	.	.	S	Bend	trans	-135.2	93.9	176.5	-73.6	-92.9	0	0	0	108.5	I449 N546 P547 F549 L561 D563 L608	I449-F565 HydrophobicContact CD1-CE1 3.69Å; I449-F565 HydrophobicContact CD1-CZ 4.36Å; I449-F565 HydrophobicContact CG1-CE1 4.49Å; I449-F565 HydrophobicContact CG2-CE1 4.37Å; I449-F565 HydrophobicContact CG2-CZ 4.16Å; N546-F565 HydrophobicContact CB-CD1 3.69Å; N546-F565 HydrophobicContact CB-CE1 3.61Å; N546-F565 HydrophobicContact CB-CG 4.32Å; N546-F565 HydrophobicContact CB-CZ 4.2Å; N546-F565 WeakPolarHBondContact ND2-CZ 3.36Å; P547-F565 WeakPolarHBondContact O-CD1 3.33Å; F549-F565 HydrophobicContact CB-CB 4.1Å; F549-F565 PolarHBondContact N-O 3.3Å; L561-F565 HydrophobicContact CD1-CD2 4.06Å; D563-F565 HydrophobicContact CB-CE2 4.06Å; D563-F565 WeakPolarHBondContact O-CD2 3.49Å; F565-L608 HydrophobicContact CD1-CD1 4.48Å; F565-L608 HydrophobicContact CD2-CD1 4.02Å; F565-L608 HydrophobicContact CE1-CB 4.48Å; F565-L608 HydrophobicContact CE1-CD1 4.45Å; F565-L608 HydrophobicContact CE2-CB 4.09Å; F565-L608 HydrophobicContact CE2-CD1 3.96Å; F565-L608 HydrophobicContact CE2-CG 4.16Å; F565-L608 HydrophobicContact CG-CD1 4.3Å; F565-L608 HydrophobicContact CZ-CB 3.85Å; F565-L608 HydrophobicContact CZ-CD1 4.2Å; F565-L608 HydrophobicContact CZ-CG 4.38Å
566	P	88.5	Confident	90.8	Very high	83 Å²	83	52.3 Å²	52.3	54%	0.539	27%	0.27	S	S	.	.	S	Bend	cis	-85.4	159.8	14.2	33.9	-35.1	0	0	0	114.7	N546 P547 P548 Q564	N546-P566 WeakPolarHBondContact O-CA 3.42Å; N546-P566 WeakPolarHBondContact O-CB 3.41Å; P547-P566 WeakPolarHBondContact O-CA 3.49Å; P548-P566 HydrophobicContact CG-CB 4.32Å; Q564-P566 CarbonylContact C-O 3.43Å; Q564-P566 CarbonylContact O-C 3.57Å
567	R	90.3	Very high	91.1	Very high	15 Å²	15	52.1 Å²	52.1	6%	0.057	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-134.8	137.8	170.6	-176	-163.8	44.3	90.6	-4.1	109	L543 D544 A545 N546 D563 Q564	L543-R567 PolarHBondContact O-NH1 2.95Å; D544-R567 PolarHBondContact O-NH1 3.5Å; D544-R567 PolarHBondContact O-NH2 3.4Å; A545-R567 CarbonylContact C-O 3.45Å; A545-R567 WeakPolarHBondContact CA-O 3.46Å; A545-R567 WeakPolarHBondContact CB-O 3.43Å; N546-R567 HydrophobicContact CB-CB 3.88Å; N546-R567 PolarHBondContact N-O 3.39Å; N546-R567 PolarHBondContact ND2-NE 3.36Å; N546-R567 PolarHBondContact O-N 3.34Å; N546-R567 PolarHBondContact OD1-NH2 3.02Å; D563-R567 WeakPolarHBondContact OD1-CD 3.47Å; D563-R567 IonicContact OD1-NE 3.99Å; D563-R567 IonicContact OD2-NE 3.79Å; D563-R567 PolarHBondContact OD2-NE 3.45Å; Q564-R567 HydrophobicContact CB-CB 4.09Å; Q564-R567 WeakPolarHBondContact O-CB 3.17Å
568	G	89.3	Confident	91.5	Very high	52 Å²	52	53 Å²	53	54%	0.536	28%	0.279	S	S	.	.			trans	-70.4	176.1	169.5	0	0	0	0	0	113.4	K570	G568-K570 PolarHBondContact O-N 2.87Å
569	T	87.6	Confident	92.4	Very high	104 Å²	104	49.2 Å²	49.2	64%	0.638	27%	0.265	S	S	*	.			trans	-59.5	137	175.5	53.6	0	0	0	0	111.4	L543	L543-T569 VanDerWaalsContact O-CA 3.23Å; L543-T569 WeakPolarHBondContact O-CA 3.38Å
570	K	89.5	Confident	93.2	Very high	64 Å²	64	42.6 Å²	42.6	28%	0.278	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-149	141	-175.1	-163.3	173.3	178.7	-177.1	0	111.5	M468 L543 G568	M468-K570 HydrophobicContact CB-CD 4.22Å; M468-K570 HydrophobicContact CE-CD 3.79Å; M468-K570 HydrophobicContact CG-CD 4.48Å; L543-K570 WeakPolarHBondContact CB-O 3.46Å; L543-K570 PolarHBondContact N-O 3.4Å; L543-K570 PolarHBondContact O-N 3.21Å; L543-K570 VanDerWaalsContact O-N 3.14Å; G568-K570 PolarHBondContact O-N 2.87Å
571	E	93.1	Very high	93.7	Very high	99 Å²	99	38.7 Å²	38.7	46%	0.463	22%	0.216	S	C	.	.			trans	-74.3	149.4	174.3	-66.6	-176.5	167.7	0	0	111.5	P542	P542-E571 HydrophobicContact CB-CG 4.4Å; P542-E571 HydrophobicContact CG-CG 4.2Å
572	V	94.9	Very high	93.8	Very high	4 Å²	4	45 Å²	45	2%	0.024	24%	0.238	C	C	.	.			trans	-81.2	128.9	172.4	-178.6	0	0	0	0	108.9	L470 R481 I539 C540 L543 V574	L470-V572 HydrophobicContact CB-CG1 3.72Å; L470-V572 HydrophobicContact CB-CG2 4.04Å; L470-V572 HydrophobicContact CD2-CG2 4.43Å; R481-V572 PolarHBondContact NH1-O 2.8Å; I539-V572 HydrophobicContact CB-CB 4.5Å; I539-V572 HydrophobicContact CD1-CG1 4.01Å; I539-V572 HydrophobicContact CG2-CB 4.39Å; I539-V572 HydrophobicContact CG2-CG1 4.11Å; C540-V572 WeakPolarHBondContact SG-CG2 3.47Å; L543-V572 HydrophobicContact CD1-CG2 3.54Å; L543-V572 HydrophobicContact CD2-CG2 3.91Å; L543-V572 HydrophobicContact CG-CG2 3.59Å; V572-V574 WeakPolarHBondContact CG1-O 3.24Å
573	D	98.3	Very high	94	Very high	17 Å²	17	48 Å²	48	9%	0.091	25%	0.254	C	S	.	.	S	Bend	trans	-93.2	-38.1	177.8	-65.3	-60.4	0	0	0	111.3	V467 M468 R481 L484 I539	V467-D573 WeakPolarHBondContact CA-OD2 3.42Å; V467-D573 HydrophobicContact CB-CB 3.73Å; V467-D573 HydrophobicContact CG1-CB 4.01Å; M468-D573 PolarHBondContact N-OD2 3.41Å; M468-D573 PolarHBondContact O-N 3.42Å; R481-D573 IonicContact CZ-OD1 2.61Å; R481-D573 PolarHBondContact N-O 3.31Å; R481-D573 IonicContact NH1-OD1 3.46Å; R481-D573 PolarHBondContact NH1-OD1 3.49Å; R481-D573 IonicContact NH2-OD1 3.56Å; R481-D573 PolarHBondContact NH2-OD1 3.47Å; L484-D573 HydrophobicContact CD2-CB 3.82Å; I539-D573 WeakPolarHBondContact CD1-O 3.42Å
574	V	98.6	Very high	94.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.8	-178.5	-179.6	0	0	0	0	110	L457 V467 M468 C469 L470 F479 V480 F517 L519 I531 V572 I576	L457-V574 HydrophobicContact CD1-CG2 4.1Å; V467-V574 HydrophobicContact CB-CG2 4.38Å; V467-V574 HydrophobicContact CG2-CG2 4.33Å; M468-V574 PolarHBondContact O-N 3.43Å; C469-V574 CarbonylContact C-O 3.57Å; C469-V574 VanDerWaalsContact CA-O 3.22Å; C469-V574 WeakPolarHBondContact CA-O 3.45Å; L470-V574 PolarHBondContact N-O 2.89Å; F479-V574 CarbonylContact O-C 3.56Å; F479-V574 WeakPolarHBondContact O-CA 3.47Å; V480-V574 HydrophobicContact CG2-CG2 4.12Å; F517-V574 HydrophobicContact CE2-CG1 4.31Å; F517-V574 HydrophobicContact CE2-CG2 4.26Å; F517-V574 HydrophobicContact CZ-CG1 4.04Å; F517-V574 HydrophobicContact CZ-CG2 4.06Å; L519-V574 HydrophobicContact CD1-CG1 4.39Å; I531-V574 HydrophobicContact CD1-CG1 4.27Å; V572-V574 WeakPolarHBondContact CG1-O 3.24Å; V574-I576 HydrophobicContact CG1-CG1 4.21Å
575	L	98.3	Very high	94.3	Very high	15 Å²	15	44 Å²	44	8%	0.079	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	124.1	167.5	-174.1	150.7	0	0	0	108.2	L470 D472 S475 S478 F479 I539	L470-L575 HydrophobicContact CD2-CD1 4.3Å; L470-L575 CarbonylContact O-C 3.57Å; L470-L575 WeakPolarHBondContact O-CA 3.32Å; D472-L575 HydrophobicContact CB-CD1 4.26Å; D472-L575 HydrophobicContact CB-CD2 4.25Å; D472-L575 HydrophobicContact CB-CG 4.23Å; S475-L575 VanDerWaalsContact CB-CD2 3.42Å; S478-L575 CarbonylContact C-O 3.51Å; S478-L575 WeakPolarHBondContact CA-O 3.44Å; S478-L575 WeakPolarHBondContact CB-O 3.27Å; F479-L575 HydrophobicContact CB-CB 4.28Å; F479-L575 HydrophobicContact CD2-CD2 4.15Å; F479-L575 PolarHBondContact N-O 3.23Å; F479-L575 PolarHBondContact O-N 3.01Å; I539-L575 HydrophobicContact CD1-CB 4.3Å; I539-L575 HydrophobicContact CG2-CB 3.77Å; I539-L575 HydrophobicContact CG2-CD1 3.8Å; I539-L575 HydrophobicContact CG2-CG 4.43Å
576	I	98.2	Very high	94.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	106.6	175.5	-57.3	176.9	0	0	0	106.9	C469 L470 L471 D472 L519 V574 F584 F604	C469-I576 HydrophobicContact CB-CD1 4.16Å; L470-I576 PolarHBondContact O-N 3.26Å; L471-I576 HydrophobicContact CG-CB 4.36Å; L471-I576 HydrophobicContact CG-CD1 4.3Å; D472-I576 PolarHBondContact N-O 3.42Å; L519-I576 HydrophobicContact CD1-CD1 3.87Å; L519-I576 HydrophobicContact CD1-CG1 4.37Å; V574-I576 HydrophobicContact CG1-CG1 4.21Å; I576-F584 HydrophobicContact CD1-CD1 4.4Å; I576-F584 HydrophobicContact CD1-CD2 4Å; I576-F584 HydrophobicContact CD1-CE1 4.49Å; I576-F584 HydrophobicContact CD1-CE2 4.07Å; I576-F584 HydrophobicContact CD1-CG 4.19Å; I576-F584 HydrophobicContact CD1-CZ 4.33Å; I576-F584 HydrophobicContact CG2-CD2 3.8Å; I576-F584 HydrophobicContact CG2-CE2 4.07Å; I576-F604 HydrophobicContact CD1-CE2 4.14Å
577	G	95.7	Very high	94.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	177.2	178.2	0	0	0	0	0	112.7	D472 S475 S478 D579 Y580 Y581	D472-G577 WeakPolarHBondContact O-CA 3.3Å; S475-G577 CarbonylContact O-C 3.33Å; S475-G577 WeakPolarHBondContact O-CA 3.37Å; S478-G577 PolarHBondContact OG-N 2.85Å; G577-D579 VanDerWaalsContact C-OD1 3.27Å; G577-D579 WeakPolarHBondContact CA-OD1 3.48Å; G577-D579 PolarHBondContact O-N 3.26Å; G577-D579 VanDerWaalsContact O-N 3.12Å; G577-Y580 PolarHBondContact O-N 3.27Å; G577-Y580 VanDerWaalsContact O-N 3.13Å; G577-Y581 VanDerWaalsContact O-CB 3.32Å; G577-Y581 WeakPolarHBondContact O-CB 3.33Å; G577-Y581 PolarHBondContact O-N 2.92Å
578	A	93.9	Very high	94.7	Very high	40 Å²	40	51 Å²	51	33%	0.331	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.7	174	0	0	0	0	0	113.5	S475 Y580	S475-A578 PolarHBondContact O-N 3.3Å; A578-Y580 VanDerWaalsContact C-N 3.27Å; A578-Y580 PolarHBondContact O-N 2.89Å
579	D	97.3	Very high	94.9	Very high	57 Å²	57	51.9 Å²	51.9	31%	0.305	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-32.5	176.1	56.8	-13	0	0	0	113.5	R477 S478 G577	R477-D579 WeakPolarHBondContact CA-OD2 3.45Å; S478-D579 PolarHBondContact N-OD1 3.01Å; S478-D579 PolarHBondContact N-OD2 3.34Å; S478-D579 PolarHBondContact OG-OD1 3.45Å; G577-D579 VanDerWaalsContact C-OD1 3.27Å; G577-D579 WeakPolarHBondContact CA-OD1 3.48Å; G577-D579 PolarHBondContact O-N 3.26Å; G577-D579 VanDerWaalsContact O-N 3.12Å
580	Y	97.9	Very high	95.1	Very high	56 Å²	56	51.3 Å²	51.3	22%	0.22	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-5.1	177.7	-66.1	-76.2	0	0	0	113.9	I531 K532 G577 A578 Y582 D583 F584	I531-Y580 HydrophobicContact CB-CD1 4.23Å; I531-Y580 HydrophobicContact CB-CD2 3.89Å; I531-Y580 HydrophobicContact CB-CE1 4.21Å; I531-Y580 HydrophobicContact CB-CE2 3.88Å; I531-Y580 HydrophobicContact CB-CG 4.06Å; I531-Y580 HydrophobicContact CG2-CD1 3.66Å; I531-Y580 HydrophobicContact CG2-CD2 3.96Å; I531-Y580 HydrophobicContact CG2-CE1 4.05Å; I531-Y580 HydrophobicContact CG2-CE2 4.34Å; I531-Y580 HydrophobicContact CG2-CG 3.6Å; K532-Y580 PolarHBondContact N-OH 3.12Å; K532-Y580 VanDerWaalsContact N-OH 3.14Å; K532-Y580 WeakPolarHBondContact O-CE2 3.33Å; G577-Y580 PolarHBondContact O-N 3.27Å; G577-Y580 VanDerWaalsContact O-N 3.13Å; A578-Y580 VanDerWaalsContact C-N 3.27Å; A578-Y580 PolarHBondContact O-N 2.89Å; Y580-Y582 VanDerWaalsContact C-N 3.29Å; Y580-Y582 PolarHBondContact O-N 3.27Å; Y580-Y582 VanDerWaalsContact O-N 3.17Å; Y580-D583 VanDerWaalsContact O-CB 3.28Å; Y580-D583 WeakPolarHBondContact O-CB 3.42Å; Y580-D583 PolarHBondContact O-N 3.07Å; Y580-F584 VanDerWaalsContact O-CD2 3.27Å; Y580-F584 WeakPolarHBondContact O-CD2 3.23Å
581	Y	97.8	Very high	95.1	Very high	22 Å²	22	55.5 Å²	55.5	9%	0.086	28%	0.276	C	S	.	.	H	α-helix	trans	-48.9	-48.9	-174.4	177.4	-87.6	0	0	0	113	Q451 L471 V473 G577 D583 F584 V585	Q451-Y581 PolarHBondContact NE2-OH 3.29Å; Q451-Y581 PolarHBondContact OE1-OH 3.04Å; L471-Y581 HydrophobicContact CB-CD2 3.9Å; L471-Y581 HydrophobicContact CB-CE2 3.84Å; L471-Y581 HydrophobicContact CD2-CD2 4.33Å; L471-Y581 HydrophobicContact CD2-CE2 4.31Å; V473-Y581 HydrophobicContact CG1-CD1 3.57Å; V473-Y581 HydrophobicContact CG1-CD2 3.45Å; V473-Y581 VanDerWaalsContact CG1-CD2 3.45Å; V473-Y581 HydrophobicContact CG1-CE1 3.7Å; V473-Y581 HydrophobicContact CG1-CE2 3.56Å; V473-Y581 HydrophobicContact CG1-CG 3.45Å; V473-Y581 VanDerWaalsContact CG1-CG 3.45Å; G577-Y581 VanDerWaalsContact O-CB 3.32Å; G577-Y581 WeakPolarHBondContact O-CB 3.33Å; G577-Y581 PolarHBondContact O-N 2.92Å; Y581-D583 PolarHBondContact O-N 2.94Å; Y581-F584 PolarHBondContact O-N 3.05Å; Y581-F584 VanDerWaalsContact O-N 3.16Å; Y581-V585 HydrophobicContact CD1-CG2 4.24Å; Y581-V585 HydrophobicContact CD2-CG2 4.5Å; Y581-V585 HydrophobicContact CE1-CB 4.14Å; Y581-V585 HydrophobicContact CE1-CG1 4.45Å; Y581-V585 HydrophobicContact CE1-CG2 3.78Å; Y581-V585 HydrophobicContact CE2-CG2 4.08Å; Y581-V585 PolarHBondContact O-N 3.26Å; Y581-V585 VanDerWaalsContact O-N 3.14Å
582	Y	95.4	Very high	94.6	Very high	175 Å²	175	55.4 Å²	55.4	69%	0.686	28%	0.278	S	S	*	.	H	α-helix	trans	-75.1	-7.8	-178.1	-60.7	-73.9	0	0	0	114	Y580	Y580-Y582 VanDerWaalsContact C-N 3.29Å; Y580-Y582 PolarHBondContact O-N 3.27Å; Y580-Y582 VanDerWaalsContact O-N 3.17Å
583	D	95.4	Very high	93.5	Very high	70 Å²	70	58 Å²	58	37%	0.374	30%	0.3	S	S	.	.	H	α-helix	trans	-78.1	-22.5	168.8	-78.6	-57.3	0	0	0	113.2	K529 Y580 Y581	K529-D583 HydrophobicContact CD-CB 4.39Å; K529-D583 VanDerWaalsContact CE-O 3.29Å; K529-D583 WeakPolarHBondContact CE-O 3.24Å; K529-D583 IonicContact NZ-OD1 3.3Å; K529-D583 PolarHBondContact NZ-OD1 2.78Å; Y580-D583 VanDerWaalsContact O-CB 3.28Å; Y580-D583 WeakPolarHBondContact O-CB 3.42Å; Y580-D583 PolarHBondContact O-N 3.07Å; Y581-D583 PolarHBondContact O-N 2.94Å
584	F	96.3	Very high	92	Very high	1 Å²	1	61.6 Å²	61.6	0%	0.004	33%	0.332	C	S	.	.	H	α-helix	trans	-101.8	-36.6	-176.8	-70.7	-83.7	0	0	0	112.7	L471 L519 K529 I531 I576 Y580 Y581 S602 I603 F604	L471-F584 HydrophobicContact CD2-CB 4.41Å; L519-F584 HydrophobicContact CB-CE1 3.83Å; L519-F584 HydrophobicContact CB-CZ 4.09Å; L519-F584 HydrophobicContact CD1-CE1 4.07Å; L519-F584 HydrophobicContact CD1-CZ 3.85Å; L519-F584 HydrophobicContact CG-CZ 4.48Å; K529-F584 HydrophobicContact CB-CE1 3.63Å; K529-F584 HydrophobicContact CB-CE2 4.43Å; K529-F584 HydrophobicContact CB-CZ 3.59Å; K529-F584 HydrophobicContact CG-CE1 4.16Å; K529-F584 HydrophobicContact CG-CZ 4.4Å; I531-F584 HydrophobicContact CG2-CE2 3.63Å; I531-F584 HydrophobicContact CG2-CZ 3.69Å; I576-F584 HydrophobicContact CD1-CD1 4.4Å; I576-F584 HydrophobicContact CD1-CD2 4Å; I576-F584 HydrophobicContact CD1-CE1 4.49Å; I576-F584 HydrophobicContact CD1-CE2 4.07Å; I576-F584 HydrophobicContact CD1-CG 4.19Å; I576-F584 HydrophobicContact CD1-CZ 4.33Å; I576-F584 HydrophobicContact CG2-CD2 3.8Å; I576-F584 HydrophobicContact CG2-CE2 4.07Å; Y580-F584 VanDerWaalsContact O-CD2 3.27Å; Y580-F584 WeakPolarHBondContact O-CD2 3.23Å; Y581-F584 PolarHBondContact O-N 3.05Å; Y581-F584 VanDerWaalsContact O-N 3.16Å; F584-S602 CarbonylContact O-C 3.57Å; F584-S602 VanDerWaalsContact O-CA 3.22Å; F584-S602 WeakPolarHBondContact O-CA 3.36Å; F584-S602 VanDerWaalsContact O-CB 3.3Å; F584-S602 WeakPolarHBondContact O-CB 3.45Å; F584-I603 HydrophobicContact CD1-CD1 3.34Å; F584-I603 HydrophobicContact CD1-CG1 3.71Å; F584-I603 HydrophobicContact CE1-CD1 3.64Å; F584-I603 HydrophobicContact CE1-CG1 4.45Å; F584-I603 HydrophobicContact CG-CD1 4.42Å; F584-I603 PolarHBondContact O-N 2.83Å; F584-F604 HydrophobicContact CB-CE2 4.41Å; F584-F604 HydrophobicContact CD1-CD2 4.37Å; F584-F604 HydrophobicContact CD1-CE1 4.15Å; F584-F604 AromaticContact CD1-CE2 3.39Å; F584-F604 HydrophobicContact CD1-CE2 3.39Å; F584-F604 AromaticContact CD1-CZ 3.26Å; F584-F604 HydrophobicContact CD1-CZ 3.26Å; F584-F604 HydrophobicContact CE1-CE1 4.16Å; F584-F604 AromaticContact CE1-CE2 3.96Å; F584-F604 HydrophobicContact CE1-CE2 3.96Å; F584-F604 AromaticContact CE1-CZ 3.35Å; F584-F604 HydrophobicContact CE1-CZ 3.35Å; F584-F604 HydrophobicContact CG-CE2 4.12Å; F584-F604 HydrophobicContact CG-CZ 4.34Å; F584-F604 HydrophobicContact CZ-CZ 4.48Å
585	V	95.4	Very high	90.9	Very high	25 Å²	25	65.8 Å²	65.8	15%	0.152	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	135.1	-179.9	175.1	0	0	0	0	110.3	L471 Y581 V600	L471-V585 HydrophobicContact CD2-CG2 3.78Å; Y581-V585 HydrophobicContact CD1-CG2 4.24Å; Y581-V585 HydrophobicContact CD2-CG2 4.5Å; Y581-V585 HydrophobicContact CE1-CB 4.14Å; Y581-V585 HydrophobicContact CE1-CG1 4.45Å; Y581-V585 HydrophobicContact CE1-CG2 3.78Å; Y581-V585 HydrophobicContact CE2-CG2 4.08Å; Y581-V585 PolarHBondContact O-N 3.26Å; Y581-V585 VanDerWaalsContact O-N 3.14Å; V585-V600 HydrophobicContact CG1-CG1 3.42Å; V585-V600 VanDerWaalsContact CG1-CG1 3.42Å; V585-V600 HydrophobicContact CG2-CG1 4.48Å
586	G	90.9	Very high	90.2	Very high	28 Å²	28	66.9 Å²	66.9	29%	0.289	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-171.1	176.1	0	0	0	0	0	112.9	Q601	G586-Q601 WeakPolarHBondContact CA-O 3.27Å; G586-Q601 PolarHBondContact N-O 3.25Å
587	N	90	Very high	89.8	Confident	168 Å²	168	66.9 Å²	66.9	90%	0.898	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	-13.6	-173.4	-63	-23.9	0	0	0	113.9
588	E	94.3	Very high	89.6	Confident	73 Å²	73	68.3 Å²	68.3	34%	0.341	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125.5	-176.5	-161.6	-175.7	157	0	0	111.3	R590 Q601 W606	E588-R590 IonicContact OE1-CZ 3.27Å; E588-R590 VanDerWaalsContact OE1-CZ 3.27Å; E588-R590 IonicContact OE1-NE 2.99Å; E588-R590 PolarHBondContact OE1-NE 3.41Å; E588-R590 IonicContact OE1-NH2 2.83Å; E588-R590 PolarHBondContact OE1-NH2 3.1Å; E588-Q601 HydrophobicContact CB-CB 3.95Å; E588-Q601 WeakPolarHBondContact O-CB 3.36Å; E588-Q601 PolarHBondContact O-N 3.44Å; E588-W606 HydrophobicContact CB-CH2 4.09Å; E588-W606 HydrophobicContact CG-CH2 3.77Å; E588-W606 WeakPolarHBondContact OE1-CH2 3.45Å
589	V	94.3	Very high	89.6	Confident	72 Å²	72	66.4 Å²	66.4	44%	0.436	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	124.4	173.8	-175.3	0	0	0	0	109	K591 V598 G599 V600	V589-K591 HydrophobicContact CG1-CD 4.29Å; V589-K591 VanDerWaalsContact CG1-CE 3.4Å; V589-K591 HydrophobicContact CG1-CG 3.92Å; V589-V598 HydrophobicContact CG1-CG1 3.39Å; V589-G599 CarbonylContact C-O 3.54Å; V589-G599 WeakPolarHBondContact CA-O 3.45Å; V589-V600 HydrophobicContact CG1-CG2 4.22Å; V589-V600 HydrophobicContact CG2-CG1 4.48Å; V589-V600 HydrophobicContact CG2-CG2 4.45Å
590	R	92.3	Very high	89.5	Confident	92 Å²	92	64.1 Å²	64.1	35%	0.347	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116.2	177.7	-63.4	-171.9	-175	-177.6	1.8	110	H555 L556 E588 V598 G599 W606	H555-R590 WeakPolarHBondContact O-CD 3.36Å; L556-R590 HydrophobicContact CD2-CB 4.4Å; E588-R590 IonicContact OE1-CZ 3.27Å; E588-R590 VanDerWaalsContact OE1-CZ 3.27Å; E588-R590 IonicContact OE1-NE 2.99Å; E588-R590 PolarHBondContact OE1-NE 3.41Å; E588-R590 IonicContact OE1-NH2 2.83Å; E588-R590 PolarHBondContact OE1-NH2 3.1Å; R590-V598 WeakPolarHBondContact O-CA 3.32Å; R590-G599 PolarHBondContact N-O 2.8Å; R590-G599 PolarHBondContact O-N 2.84Å; R590-W606 HydrophobicContact CG-CH2 3.91Å; R590-W606 HydrophobicContact CG-CZ3 3.97Å
591	K	89.3	Confident	89.4	Confident	152 Å²	152	64.9 Å²	64.9	66%	0.661	35%	0.346	S	S	*	.			trans	-123.1	150.6	177.6	-52.1	-174	-178.3	175.7	0	108.6	V589 V598	V589-K591 HydrophobicContact CG1-CD 4.29Å; V589-K591 VanDerWaalsContact CG1-CE 3.4Å; V589-K591 HydrophobicContact CG1-CG 3.92Å; K591-V598 HydrophobicContact CB-CG2 4.46Å; K591-V598 HydrophobicContact CD-CG1 4.4Å; K591-V598 HydrophobicContact CD-CG2 4.22Å; K591-V598 HydrophobicContact CG-CB 4.38Å; K591-V598 HydrophobicContact CG-CG1 3.77Å; K591-V598 HydrophobicContact CG-CG2 3.85Å
592	N	83.4	Confident	89.3	Confident	96 Å²	96	64.4 Å²	64.4	51%	0.513	35%	0.346	S	S	.	.			trans	-127.3	-143.8	170.7	-167.5	16.4	0	0	0	108.5	H555 E596	H555-N592 HydrophobicContact CB-CB 4.3Å; N592-E596 WeakPolarHBondContact CB-OE2 3.5Å; N592-E596 PolarHBondContact ND2-OE2 2.79Å
593	A	69.8	Low	89.2	Confident	60 Å²	60	58 Å²	58	50%	0.496	32%	0.323	S	S	.	.	S	Bend	trans	-56	162.1	175.9	0	0	0	0	0	113.3	D595 E596	A593-D595 PolarHBondContact O-N 3Å; A593-E596 PolarHBondContact O-N 3.14Å
594	A	67	Low	89.2	Confident	92 Å²	92	55.1 Å²	55.1	76%	0.76	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-12.9	-168.2	0	0	0	0	0	116.1
595	D	76.7	Confident	89.1	Confident	88 Å²	88	55.2 Å²	55.2	47%	0.471	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	22.9	-175.8	-70.3	-36.9	0	0	0	113.3	A593 T612 G613	A593-D595 PolarHBondContact O-N 3Å; D595-T612 CarbonylContact O-C 3.51Å; D595-G613 WeakPolarHBondContact O-CA 3.46Å; D595-G613 PolarHBondContact O-N 3.22Å
596	E	83.9	Confident	89.1	Confident	37 Å²	37	55 Å²	55	17%	0.173	31%	0.305	C	S	.	.	S	Bend	trans	-117.2	151.8	171.9	-69.1	-176.6	-176.4	0	0	111.3	H555 N592 A593 K611	H555-E596 IonicContact CE1-OE2 3.65Å; H555-E596 PolarHBondContact CE1-OE2 2.97Å; H555-E596 IonicContact ND1-OE2 2.82Å; H555-E596 PolarHBondContact ND1-OE2 3.39Å; N592-E596 WeakPolarHBondContact CB-OE2 3.5Å; N592-E596 PolarHBondContact ND2-OE2 2.79Å; A593-E596 PolarHBondContact O-N 3.14Å; E596-K611 CarbonylContact C-O 3.5Å
597	P	88.9	Confident	89.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-68.5	153.9	-177.4	17.1	-17.6	0	0	0	110.9	W553 H555 L556 C609 K611	W553-P597 VanDerWaalsContact CD1-CD 3.49Å; W553-P597 HydrophobicContact CD2-CG 3.54Å; W553-P597 HydrophobicContact CE3-CG 3.99Å; W553-P597 HydrophobicContact CG-CG 3.96Å; W553-P597 HydrophobicContact CH2-CG 4.14Å; W553-P597 HydrophobicContact CZ2-CG 3.72Å; W553-P597 HydrophobicContact CZ3-CG 4.25Å; H555-P597 PolarHBondContact NE2-O 3.27Å; L556-P597 HydrophobicContact CD1-CB 4.08Å; L556-P597 HydrophobicContact CD1-CG 3.69Å; L556-P597 WeakPolarHBondContact CD1-O 3.46Å; P597-C609 CarbonylContact C-O 3.48Å; P597-C609 WeakPolarHBondContact CA-O 3.39Å; P597-K611 VanDerWaalsContact CA-O 3.25Å; P597-K611 WeakPolarHBondContact CA-O 3.44Å; P597-K611 WeakPolarHBondContact CD-O 3.38Å
598	V	92.1	Very high	89.4	Confident	30 Å²	30	45.8 Å²	45.8	18%	0.182	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	135.8	175.1	176.9	0	0	0	0	108.8	V589 R590 K591 V600 L608 C609	V589-V598 HydrophobicContact CG1-CG1 3.39Å; R590-V598 WeakPolarHBondContact O-CA 3.32Å; K591-V598 HydrophobicContact CB-CG2 4.46Å; K591-V598 HydrophobicContact CD-CG1 4.4Å; K591-V598 HydrophobicContact CD-CG2 4.22Å; K591-V598 HydrophobicContact CG-CB 4.38Å; K591-V598 HydrophobicContact CG-CG1 3.77Å; K591-V598 HydrophobicContact CG-CG2 3.85Å; V598-V600 HydrophobicContact CG1-CG2 4Å; V598-L608 WeakPolarHBondContact O-CA 3.34Å; V598-C609 PolarHBondContact N-O 2.65Å; V598-C609 PolarHBondContact O-N 3.27Å
599	G	93.5	Very high	89.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.6	169	0	0	0	0	0	109.7	V589 R590 I607	V589-G599 CarbonylContact C-O 3.54Å; V589-G599 WeakPolarHBondContact CA-O 3.45Å; R590-G599 PolarHBondContact N-O 2.8Å; R590-G599 PolarHBondContact O-N 2.84Å; G599-I607 CarbonylContact C-O 3.57Å; G599-I607 WeakPolarHBondContact CA-O 3.44Å
600	V	95.6	Very high	88.9	Confident	9 Å²	9	40.6 Å²	40.6	6%	0.055	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.5	175.3	179.9	0	0	0	0	108.1	V585 V589 V598 I607	V585-V600 HydrophobicContact CG1-CG1 3.42Å; V585-V600 VanDerWaalsContact CG1-CG1 3.42Å; V585-V600 HydrophobicContact CG2-CG1 4.48Å; V589-V600 HydrophobicContact CG1-CG2 4.22Å; V589-V600 HydrophobicContact CG2-CG1 4.48Å; V589-V600 HydrophobicContact CG2-CG2 4.45Å; V598-V600 HydrophobicContact CG1-CG2 4Å; V600-I607 HydrophobicContact CB-CB 4.4Å; V600-I607 PolarHBondContact N-O 3.07Å; V600-I607 PolarHBondContact O-N 3.19Å
601	Q	95.4	Very high	88.6	Confident	73 Å²	73	40.8 Å²	40.8	34%	0.341	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	135.7	174.4	-171.3	-174.9	42.2	0	0	109.1	G586 E588 W606	G586-Q601 WeakPolarHBondContact CA-O 3.27Å; G586-Q601 PolarHBondContact N-O 3.25Å; E588-Q601 HydrophobicContact CB-CB 3.95Å; E588-Q601 WeakPolarHBondContact O-CB 3.36Å; E588-Q601 PolarHBondContact O-N 3.44Å; Q601-W606 HydrophobicContact CB-CD2 4.39Å; Q601-W606 HydrophobicContact CB-CE3 4.15Å; Q601-W606 HydrophobicContact CB-CH2 4.01Å; Q601-W606 HydrophobicContact CB-CZ2 4.25Å; Q601-W606 HydrophobicContact CB-CZ3 3.95Å; Q601-W606 HydrophobicContact CG-CZ2 4.42Å
602	S	95.2	Very high	88	Confident	12 Å²	12	34.2 Å²	34.2	8%	0.084	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	171.2	172.8	79.5	0	0	0	0	110.1	F584 F604 G605	F584-S602 CarbonylContact O-C 3.57Å; F584-S602 VanDerWaalsContact O-CA 3.22Å; F584-S602 WeakPolarHBondContact O-CA 3.36Å; F584-S602 VanDerWaalsContact O-CB 3.3Å; F584-S602 WeakPolarHBondContact O-CB 3.45Å; S602-F604 PolarHBondContact O-N 3.08Å; S602-F604 PolarHBondContact OG-N 3.47Å; S602-F604 VanDerWaalsContact OG-N 3.14Å; S602-G605 WeakPolarHBondContact CB-O 3.26Å; S602-G605 PolarHBondContact N-O 3.34Å; S602-G605 PolarHBondContact O-N 3.1Å; S602-G605 VanDerWaalsContact O-N 3.14Å; S602-G605 PolarHBondContact OG-O 3.47Å
603	I	94.5	Very high	87.3	Confident	39 Å²	39	30.2 Å²	30.2	20%	0.2	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29	172.8	70.4	167	0	0	0	112.3	P521 P527 K529 F584 G605	P521-I603 WeakPolarHBondContact CG-O 3.42Å; P527-I603 HydrophobicContact CG-CB 3.67Å; P527-I603 HydrophobicContact CG-CD1 4.24Å; P527-I603 HydrophobicContact CG-CG2 3.65Å; K529-I603 HydrophobicContact CB-CD1 4.37Å; K529-I603 HydrophobicContact CG-CD1 3.83Å; F584-I603 HydrophobicContact CD1-CD1 3.34Å; F584-I603 HydrophobicContact CD1-CG1 3.71Å; F584-I603 HydrophobicContact CE1-CD1 3.64Å; F584-I603 HydrophobicContact CE1-CG1 4.45Å; F584-I603 HydrophobicContact CG-CD1 4.42Å; F584-I603 PolarHBondContact O-N 2.83Å; I603-G605 PolarHBondContact O-N 3.4Å
604	F	94.8	Very high	86.8	Confident	10 Å²	10	37.2 Å²	37.2	4%	0.044	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-4.8	-178.7	-55.3	-54.3	0	0	0	113.3	A453 A455 L519 P521 I576 F584 S602	A453-F604 HydrophobicContact CB-CB 4.14Å; A453-F604 HydrophobicContact CB-CD2 3.67Å; A453-F604 HydrophobicContact CB-CE2 4.43Å; A453-F604 HydrophobicContact CB-CG 4.19Å; A455-F604 HydrophobicContact CB-CD1 3.84Å; A455-F604 HydrophobicContact CB-CE1 3.44Å; A455-F604 VanDerWaalsContact CB-CE1 3.44Å; A455-F604 HydrophobicContact CB-CE2 4.43Å; A455-F604 HydrophobicContact CB-CG 4.5Å; A455-F604 HydrophobicContact CB-CZ 3.75Å; L519-F604 HydrophobicContact CB-CE1 4.13Å; L519-F604 HydrophobicContact CB-CZ 3.94Å; L519-F604 HydrophobicContact CD1-CZ 4.23Å; P521-F604 HydrophobicContact CG-CD1 4.43Å; I576-F604 HydrophobicContact CD1-CE2 4.14Å; F584-F604 HydrophobicContact CB-CE2 4.41Å; F584-F604 HydrophobicContact CD1-CD2 4.37Å; F584-F604 HydrophobicContact CD1-CE1 4.15Å; F584-F604 AromaticContact CD1-CE2 3.39Å; F584-F604 HydrophobicContact CD1-CE2 3.39Å; F584-F604 AromaticContact CD1-CZ 3.26Å; F584-F604 HydrophobicContact CD1-CZ 3.26Å; F584-F604 HydrophobicContact CE1-CE1 4.16Å; F584-F604 AromaticContact CE1-CE2 3.96Å; F584-F604 HydrophobicContact CE1-CE2 3.96Å; F584-F604 AromaticContact CE1-CZ 3.35Å; F584-F604 HydrophobicContact CE1-CZ 3.35Å; F584-F604 HydrophobicContact CG-CE2 4.12Å; F584-F604 HydrophobicContact CG-CZ 4.34Å; F584-F604 HydrophobicContact CZ-CZ 4.48Å; S602-F604 PolarHBondContact O-N 3.08Å; S602-F604 PolarHBondContact OG-N 3.47Å; S602-F604 VanDerWaalsContact OG-N 3.14Å
605	G	93.4	Very high	86.1	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.031	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	112.4	-165.3	-167	0	0	0	0	0	111.5	N560 S602 I603	N560-G605 CarbonylContact O-C 3.43Å; N560-G605 VanDerWaalsContact O-CA 3.27Å; N560-G605 WeakPolarHBondContact O-CA 3.32Å; S602-G605 WeakPolarHBondContact CB-O 3.26Å; S602-G605 PolarHBondContact N-O 3.34Å; S602-G605 PolarHBondContact O-N 3.1Å; S602-G605 VanDerWaalsContact O-N 3.14Å; S602-G605 PolarHBondContact OG-O 3.47Å; I603-G605 PolarHBondContact O-N 3.4Å
606	W	95	Very high	84.8	Confident	22 Å²	22	41.6 Å²	41.6	8%	0.083	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.2	-177.7	-73.5	98	0	0	0	111.6	P557 N560 L561 S562 E588 R590 Q601	P557-W606 HydrophobicContact CB-CD2 4.47Å; P557-W606 HydrophobicContact CB-CG 4.16Å; P557-W606 HydrophobicContact CG-CB 3.61Å; P557-W606 HydrophobicContact CG-CD2 3.34Å; P557-W606 HydrophobicContact CG-CE3 3.95Å; P557-W606 HydrophobicContact CG-CG 3.15Å; P557-W606 HydrophobicContact CG-CZ2 4.44Å; N560-W606 PolarHBondContact O-N 3.41Å; L561-W606 WeakPolarHBondContact CA-O 3.19Å; L561-W606 HydrophobicContact CD2-CB 4.07Å; S562-W606 PolarHBondContact N-O 3.28Å; S562-W606 PolarHBondContact OG-O 2.86Å; E588-W606 HydrophobicContact CB-CH2 4.09Å; E588-W606 HydrophobicContact CG-CH2 3.77Å; E588-W606 WeakPolarHBondContact OE1-CH2 3.45Å; R590-W606 HydrophobicContact CG-CH2 3.91Å; R590-W606 HydrophobicContact CG-CZ3 3.97Å; Q601-W606 HydrophobicContact CB-CD2 4.39Å; Q601-W606 HydrophobicContact CB-CE3 4.15Å; Q601-W606 HydrophobicContact CB-CH2 4.01Å; Q601-W606 HydrophobicContact CB-CZ2 4.25Å; Q601-W606 HydrophobicContact CB-CZ3 3.95Å; Q601-W606 HydrophobicContact CG-CZ2 4.42Å
607	I	95.4	Very high	83	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.8	173.6	-60	169.5	0	0	0	108	Q451 L471 S562 G599 V600	Q451-I607 HydrophobicContact CB-CG2 3.8Å; Q451-I607 HydrophobicContact CG-CG2 3.93Å; L471-I607 HydrophobicContact CD1-CD1 4.09Å; L471-I607 HydrophobicContact CD2-CD1 3.72Å; S562-I607 VanDerWaalsContact OG-CA 3.29Å; S562-I607 WeakPolarHBondContact OG-CA 3.46Å; S562-I607 VanDerWaalsContact OG-CG1 3.24Å; S562-I607 WeakPolarHBondContact OG-CG1 3.36Å; G599-I607 CarbonylContact C-O 3.57Å; G599-I607 WeakPolarHBondContact CA-O 3.44Å; V600-I607 HydrophobicContact CB-CB 4.4Å; V600-I607 PolarHBondContact N-O 3.07Å; V600-I607 PolarHBondContact O-N 3.19Å
608	L	92.8	Very high	81	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.6	171.8	-52.4	-173.6	0	0	0	109	I449 F549 W553 L556 L561 F565 V598	I449-L608 VanDerWaalsContact CG2-O 3.27Å; I449-L608 WeakPolarHBondContact CG2-O 3.41Å; F549-L608 HydrophobicContact CD2-CD1 3.84Å; F549-L608 HydrophobicContact CE2-CD1 3.79Å; W553-L608 HydrophobicContact CZ3-CD1 4.39Å; L556-L608 HydrophobicContact CB-CD2 4.3Å; L556-L608 HydrophobicContact CD1-CD2 3.97Å; L556-L608 HydrophobicContact CD2-CD2 4.3Å; L556-L608 HydrophobicContact CG-CD2 4.4Å; L561-L608 HydrophobicContact CD1-CD1 4.12Å; L561-L608 HydrophobicContact CD2-CD1 3.92Å; L561-L608 HydrophobicContact CD2-CD2 3.9Å; L561-L608 HydrophobicContact CD2-CG 3.89Å; F565-L608 HydrophobicContact CD1-CD1 4.48Å; F565-L608 HydrophobicContact CD2-CD1 4.02Å; F565-L608 HydrophobicContact CE1-CB 4.48Å; F565-L608 HydrophobicContact CE1-CD1 4.45Å; F565-L608 HydrophobicContact CE2-CB 4.09Å; F565-L608 HydrophobicContact CE2-CD1 3.96Å; F565-L608 HydrophobicContact CE2-CG 4.16Å; F565-L608 HydrophobicContact CG-CD1 4.3Å; F565-L608 HydrophobicContact CZ-CB 3.85Å; F565-L608 HydrophobicContact CZ-CD1 4.2Å; F565-L608 HydrophobicContact CZ-CG 4.38Å; V598-L608 WeakPolarHBondContact O-CA 3.34Å
609	C	91	Very high	78.7	Confident	13 Å²	13	56 Å²	56	9%	0.088	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	167.5	-178.9	64.3	0	0	0	0	112.5	I449 Q451 P597 V598	I449-C609 CarbonylContact O-C 3.11Å; I449-C609 VanDerWaalsContact O-CA 3.3Å; I449-C609 WeakPolarHBondContact O-CA 3.44Å; Q451-C609 HydrophobicContact CB-CB 4.47Å; Q451-C609 HydrophobicContact CG-CB 3.53Å; P597-C609 CarbonylContact C-O 3.48Å; P597-C609 WeakPolarHBondContact CA-O 3.39Å; V598-C609 PolarHBondContact N-O 2.65Å; V598-C609 PolarHBondContact O-N 3.27Å
610	G	87.6	Confident	76.2	Confident	24 Å²	24	56.2 Å²	56.2	25%	0.247	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	89.7	-164.2	-178.9	0	0	0	0	0	113.6	V448 I449	V448-G610 WeakPolarHBondContact CA-O 3.48Å; I449-G610 PolarHBondContact N-O 2.91Å; I449-G610 PolarHBondContact O-N 3.45Å
611	K	84.9	Confident	73.5	Confident	96 Å²	96	58.9 Å²	58.9	42%	0.417	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	141.2	-174.4	-62.9	-178.7	178.3	-171.8	0	111.1	V448 E596 P597	V448-K611 HydrophobicContact CG2-CG 4.32Å; E596-K611 CarbonylContact C-O 3.5Å; P597-K611 VanDerWaalsContact CA-O 3.25Å; P597-K611 WeakPolarHBondContact CA-O 3.44Å; P597-K611 WeakPolarHBondContact CD-O 3.38Å
612	T	76.4	Confident	70.8	Confident	14 Å²	14	57.7 Å²	57.7	9%	0.086	30%	0.295	C	S	.	.			trans	-99.2	-2.6	177.6	49.9	0	0	0	0	114.4	K447 I449 P547 W553 D595	K447-T612 WeakPolarHBondContact CB-OG1 3.44Å; K447-T612 PolarHBondContact N-OG1 2.97Å; K447-T612 PolarHBondContact O-N 3.49Å; K447-T612 PolarHBondContact O-OG1 3.22Å; I449-T612 HydrophobicContact CD1-CG2 3.16Å; I449-T612 HydrophobicContact CG1-CG2 3.66Å; P547-T612 HydrophobicContact CG-CG2 4.28Å; W553-T612 HydrophobicContact CH2-CG2 4.22Å; W553-T612 HydrophobicContact CZ2-CG2 3.94Å; D595-T612 CarbonylContact O-C 3.51Å
613	G	68.9	Low	68.2	Low	12 Å²	12	63.8 Å²	63.8	12%	0.124	33%	0.326	C	S	.	.			trans	81.9	174.4	-174.6	0	0	0	0	0	112.6	G446 D595 T615	G446-G613 WeakPolarHBondContact CA-O 3.4Å; D595-G613 WeakPolarHBondContact O-CA 3.46Å; D595-G613 PolarHBondContact O-N 3.22Å; G613-T615 PolarHBondContact O-N 3.35Å; G613-T615 VanDerWaalsContact O-N 3.13Å
614	R	60.9	Low	65.3	Low	206 Å²	206	64.8 Å²	64.8	78%	0.777	33%	0.334	S	S	*	.			trans	-74	101.7	-177.5	-67.1	-179.4	-180	173	1.2	110.5
615	T	52.1	Low	62.4	Low	73 Å²	73	67.6 Å²	67.6	45%	0.448	35%	0.354	S	S	.	.			trans	-88.6	126.2	155.9	43.3	0	0	0	0	107.6	G613 E617	G613-T615 PolarHBondContact O-N 3.35Å; G613-T615 VanDerWaalsContact O-N 3.13Å; T615-E617 PolarHBondContact O-N 3.03Å
616	M	48.3	Very low	59.5	Low	200 Å²	200	74.9 Å²	74.9	99%	0.985	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-3.6	-175.3	-79.7	-174.9	88.3	0	0	114.4
617	E	46.7	Very low	56.5	Low	188 Å²	188	79.8 Å²	79.8	88%	0.879	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	2.9	-168.3	-65.9	-172.3	158.1	0	0	115.8	T615	T615-E617 PolarHBondContact O-N 3.03Å
618	E	46.4	Very low	53.6	Low	91 Å²	91	84.7 Å²	84.7	43%	0.425	45%	0.448	S	S	.	.			trans	-116.4	126.5	-177.5	-68.7	-169.9	172.4	0	0	114	S620	E618-S620 PolarHBondContact O-N 3.48Å
619	V	43.2	Very low	51	Low	90 Å²	90	93.2 Å²	93.2	55%	0.545	49%	0.488	S	S	.	.			trans	-71.5	118.7	178.1	-176.7	0	0	0	0	109.3	K442	K442-V619 HydrophobicContact CG-CG1 4.44Å
620	S	41.7	Very low	48.7	Very low	4 Å²	4	99.8 Å²	99.8	3%	0.028	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122.6	171.4	-168.9	0	0	0	0	109.9	D445 G446 K447 E618 T622	D445-S620 WeakPolarHBondContact O-CB 3.49Å; G446-S620 PolarHBondContact O-OG 3.38Å; K447-S620 VanDerWaalsContact CA-OG 3.27Å; K447-S620 WeakPolarHBondContact CA-OG 3.4Å; E618-S620 PolarHBondContact O-N 3.48Å; S620-T622 PolarHBondContact O-N 3.39Å
621	T	39.5	Very low	46.9	Very low	65 Å²	65	104.3 Å²	104.3	40%	0.399	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	85.6	175.5	-28	0	0	0	0	108.7	V440 D544	V440-T621 HydrophobicContact CG1-CG2 4.27Å; V440-T621 HydrophobicContact CG2-CG2 4.27Å; D544-T621 WeakPolarHBondContact OD2-CB 3.39Å; D544-T621 PolarHBondContact OD2-OG1 3.02Å
622	T	37.6	Very low	45.2	Very low	49 Å²	49	102.7 Å²	102.7	30%	0.301	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	122.1	168.7	-5.3	0	0	0	0	109.1	T443 S620 T624	T443-T622 PolarHBondContact OG1-OG1 3.25Å; S620-T622 PolarHBondContact O-N 3.39Å; T622-T624 PolarHBondContact O-N 3.23Å
623	L	40.4	Very low	44.6	Very low	139 Å²	139	107.7 Å²	107.7	73%	0.728	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.8	81.4	169.8	-79.8	158.1	0	0	0	109	I438 C625	I438-L623 HydrophobicContact CD1-CD2 3.95Å; I438-L623 HydrophobicContact CG1-CD2 4.42Å; I438-L623 HydrophobicContact CG2-CD2 3.75Å; L623-C625 PolarHBondContact O-N 2.92Å
624	T	34.7	Very low	44.3	Very low	60 Å²	60	111.4 Å²	111.4	37%	0.368	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.8	110.5	170.1	36.8	0	0	0	0	109.3	G439 A441 T622 Q626	G439-T624 PolarHBondContact O-OG1 3.18Å; A441-T624 HydrophobicContact CB-CG2 4.29Å; T622-T624 PolarHBondContact O-N 3.23Å; T624-Q626 PolarHBondContact O-N 3.39Å
625	C	33.9	Very low	44.3	Very low	70 Å²	70	104.1 Å²	104.1	47%	0.473	56%	0.558	S	S	.	*			trans	-78	102.9	169.3	-179.1	0	0	0	0	108.2	F502 L623 I627	F502-C625 HydrophobicContact CD1-CB 3.96Å; F502-C625 HydrophobicContact CE1-CB 3.76Å; F502-C625 VanDerWaalsContact CE1-SG 3.58Å; L623-C625 PolarHBondContact O-N 2.92Å; C625-I627 PolarHBondContact O-N 3.4Å
626	Q	31.7	Very low	45.1	Very low	156 Å²	156	104.8 Å²	104.8	73%	0.729	56%	0.559	S	S	*	*			trans	-82.9	106.3	163.3	-164.5	171.5	-19.2	0	0	106.6	T624 S628	T624-Q626 PolarHBondContact O-N 3.39Å; Q626-S628 VanDerWaalsContact C-N 3.27Å; Q626-S628 PolarHBondContact O-N 3.44Å
627	I	33.1	Very low	46.3	Very low	124 Å²	124	98.6 Å²	98.6	64%	0.636	53%	0.529	S	S	*	.			trans	-69.6	95.1	168.1	-57.9	171.2	0	0	0	104.8	C625 E629	C625-I627 PolarHBondContact O-N 3.4Å; I627-E629 PolarHBondContact O-N 2.73Å; I627-E629 VanDerWaalsContact O-N 3.13Å
628	S	34.2	Very low	47.4	Very low	103 Å²	103	97 Å²	97	72%	0.72	52%	0.515	S	S	*	.			trans	-59.7	115.9	156.7	-65.4	0	0	0	0	105.2	Q626 E630	Q626-S628 VanDerWaalsContact C-N 3.27Å; Q626-S628 PolarHBondContact O-N 3.44Å; S628-E630 PolarHBondContact O-N 2.7Å
629	E	38.3	Very low	48.5	Very low	180 Å²	180	96.4 Å²	96.4	84%	0.841	51%	0.513	S	S	*	.			trans	-42.9	129	176.9	-71.2	179	159.8	0	0	108.5	I627 E631	I627-E629 PolarHBondContact O-N 2.73Å; I627-E629 VanDerWaalsContact O-N 3.13Å; E629-E631 PolarHBondContact O-N 3.14Å
630	E	42.4	Very low	50.1	Low	152 Å²	152	97.7 Å²	97.7	71%	0.71	51%	0.511	S	S	*	.			trans	-39.1	115.6	176.1	-87.8	176.6	153.4	0	0	108.6	S628 S632	S628-E630 PolarHBondContact O-N 2.7Å; E630-S632 PolarHBondContact O-N 2.64Å
631	E	48.7	Very low	51.5	Low	118 Å²	118	104.6 Å²	104.6	55%	0.551	54%	0.537	S	S	*	.			trans	-56.5	100.5	160.7	-82.8	-178.7	152.8	0	0	104.9	E629 V633 V635	E629-E631 PolarHBondContact O-N 3.14Å; E631-V633 PolarHBondContact O-N 3.01Å; E631-V635 HydrophobicContact CB-CB 4.36Å
632	S	50	Low	53	Low	63 Å²	63	107.8 Å²	107.8	44%	0.441	55%	0.547	S	S	.	.			trans	-49.2	149.7	-174.4	72.2	0	0	0	0	108.7	E630 N634 V635	E630-S632 PolarHBondContact O-N 2.64Å; S632-N634 CarbonylContact O-C 3.36Å; S632-N634 PolarHBondContact O-N 2.64Å; S632-N634 WeakPolarHBondContact OG-CB 3.41Å; S632-N634 PolarHBondContact OG-N 3.15Å; S632-V635 PolarHBondContact O-N 3.39Å
633	V	63	Low	54.5	Low	118 Å²	118	111 Å²	111	72%	0.715	56%	0.562	S	S	*	*	H	α-helix	trans	-42.7	-31	171.9	163	0	0	0	0	111.7	E631 V635 L636 L637	E631-V633 PolarHBondContact O-N 3.01Å; V633-V635 PolarHBondContact O-N 2.88Å; V633-L636 PolarHBondContact O-N 3.38Å; V633-L637 WeakPolarHBondContact O-CB 3.45Å; V633-L637 PolarHBondContact O-N 3.44Å
634	N	62.8	Low	55.8	Low	91 Å²	91	109.9 Å²	109.9	49%	0.487	56%	0.556	S	S	.	*	H	α-helix	trans	-56.8	-41.6	174.5	-134.4	-63.2	0	0	0	114.3	S632 R638	S632-N634 CarbonylContact O-C 3.36Å; S632-N634 PolarHBondContact O-N 2.64Å; S632-N634 WeakPolarHBondContact OG-CB 3.41Å; S632-N634 PolarHBondContact OG-N 3.15Å; N634-R638 WeakPolarHBondContact O-CB 3.47Å; N634-R638 WeakPolarHBondContact O-CG 3.39Å; N634-R638 PolarHBondContact O-N 3.07Å
635	V	62.3	Low	57.1	Low	52 Å²	52	108.6 Å²	108.6	32%	0.315	55%	0.552	S	S	.	*	H	α-helix	trans	-71.9	-44.6	178.7	178.1	0	0	0	0	110.7	E631 S632 V633 L637 R638 Q639	E631-V635 HydrophobicContact CB-CB 4.36Å; S632-V635 PolarHBondContact O-N 3.39Å; V633-V635 PolarHBondContact O-N 2.88Å; V635-L637 VanDerWaalsContact C-N 3.29Å; V635-L637 PolarHBondContact O-N 3.39Å; V635-R638 WeakPolarHBondContact O-CB 3.46Å; V635-R638 PolarHBondContact O-N 2.82Å; V635-Q639 WeakPolarHBondContact O-CG 3.19Å; V635-Q639 PolarHBondContact O-N 3.45Å
636	L	68.4	Low	58	Low	88 Å²	88	110.9 Å²	110.9	46%	0.461	56%	0.558	S	S	.	*	H	α-helix	trans	-62.6	-39.6	176.2	-164	75.5	0	0	0	111.3	V633 Q639 F640	V633-L636 PolarHBondContact O-N 3.38Å; L636-Q639 PolarHBondContact O-N 3.17Å; L636-F640 WeakPolarHBondContact O-CB 3.31Å; L636-F640 PolarHBondContact O-N 3.12Å
637	L	73.4	Confident	59.2	Low	70 Å²	70	107 Å²	107	37%	0.366	56%	0.56	S	S	.	*	H	α-helix	trans	-66.7	-40.3	175.6	-155.7	81.4	0	0	0	111.3	V633 V635 F640 W641	V633-L637 WeakPolarHBondContact O-CB 3.45Å; V633-L637 PolarHBondContact O-N 3.44Å; V635-L637 VanDerWaalsContact C-N 3.29Å; V635-L637 PolarHBondContact O-N 3.39Å; L637-F640 PolarHBondContact O-N 3.19Å; L637-W641 HydrophobicContact CD2-CH2 3.36Å; L637-W641 HydrophobicContact CD2-CZ2 3.41Å; L637-W641 VanDerWaalsContact CD2-CZ2 3.41Å; L637-W641 HydrophobicContact CD2-CZ3 3.95Å; L637-W641 HydrophobicContact CG-CD2 4.31Å; L637-W641 HydrophobicContact CG-CH2 4.09Å; L637-W641 HydrophobicContact CG-CZ2 3.83Å; L637-W641 HydrophobicContact CG-CZ3 4.41Å; L637-W641 PolarHBondContact O-N 3.06Å
638	R	69.1	Low	60.4	Low	155 Å²	155	107.5 Å²	107.5	59%	0.585	56%	0.563	S	S	*	*	H	α-helix	trans	-62	-44.1	172	-79	174.1	-172.8	-148.7	1.4	111.8	N634 V635 F640 W641 Q642	N634-R638 WeakPolarHBondContact O-CB 3.47Å; N634-R638 WeakPolarHBondContact O-CG 3.39Å; N634-R638 PolarHBondContact O-N 3.07Å; V635-R638 WeakPolarHBondContact O-CB 3.46Å; V635-R638 PolarHBondContact O-N 2.82Å; R638-F640 VanDerWaalsContact C-N 3.35Å; R638-W641 PolarHBondContact O-N 2.86Å; R638-Q642 WeakPolarHBondContact O-CB 3.47Å; R638-Q642 VanDerWaalsContact O-CG 3.28Å; R638-Q642 WeakPolarHBondContact O-CG 3.41Å; R638-Q642 PolarHBondContact O-N 2.86Å
639	Q	70.6	Confident	61	Low	78 Å²	78	107.9 Å²	107.9	36%	0.364	56%	0.555	S	S	.	*	H	α-helix	trans	-64.6	-40.5	176.8	-75.1	176.4	-2.9	0	0	111.4	V635 L636 Q642 L643	V635-Q639 WeakPolarHBondContact O-CG 3.19Å; V635-Q639 PolarHBondContact O-N 3.45Å; L636-Q639 PolarHBondContact O-N 3.17Å; Q639-Q642 PolarHBondContact O-N 3.42Å; Q639-L643 WeakPolarHBondContact O-CB 3.44Å; Q639-L643 WeakPolarHBondContact O-CG 3.45Å; Q639-L643 PolarHBondContact O-N 3.38Å
640	F	76	Confident	61.6	Low	116 Å²	116	104.6 Å²	104.6	51%	0.509	55%	0.55	S	S	.	.	H	α-helix	trans	-60.3	-48.6	173.5	178.6	-96.6	0	0	0	111.4	L636 L637 R638 Q642 L643 D644	L636-F640 WeakPolarHBondContact O-CB 3.31Å; L636-F640 PolarHBondContact O-N 3.12Å; L637-F640 PolarHBondContact O-N 3.19Å; R638-F640 VanDerWaalsContact C-N 3.35Å; F640-Q642 VanDerWaalsContact C-N 3.32Å; F640-Q642 PolarHBondContact O-N 2.9Å; F640-L643 WeakPolarHBondContact O-CB 3.46Å; F640-L643 PolarHBondContact O-N 2.9Å; F640-D644 PolarHBondContact O-N 2.98Å
641	W	71.9	Confident	62	Low	150 Å²	150	105.9 Å²	105.9	57%	0.568	56%	0.556	S	S	*	*	H	α-helix	trans	-65.6	-34.2	175.6	-68.1	-28	0	0	0	113.2	L637 R638 A645	L637-W641 HydrophobicContact CD2-CH2 3.36Å; L637-W641 HydrophobicContact CD2-CZ2 3.41Å; L637-W641 VanDerWaalsContact CD2-CZ2 3.41Å; L637-W641 HydrophobicContact CD2-CZ3 3.95Å; L637-W641 HydrophobicContact CG-CD2 4.31Å; L637-W641 HydrophobicContact CG-CH2 4.09Å; L637-W641 HydrophobicContact CG-CZ2 3.83Å; L637-W641 HydrophobicContact CG-CZ3 4.41Å; L637-W641 PolarHBondContact O-N 3.06Å; R638-W641 PolarHBondContact O-N 2.86Å; W641-A645 WeakPolarHBondContact O-CB 3.44Å; W641-A645 PolarHBondContact O-N 3.13Å
642	Q	69.9	Low	61.9	Low	132 Å²	132	107 Å²	107	62%	0.617	56%	0.561	S	S	*	*	H	α-helix	trans	-64.4	-42.3	173.1	-81.1	177.1	-27.6	0	0	111.1	R638 Q639 F640 A645 I646	R638-Q642 WeakPolarHBondContact O-CB 3.47Å; R638-Q642 VanDerWaalsContact O-CG 3.28Å; R638-Q642 WeakPolarHBondContact O-CG 3.41Å; R638-Q642 PolarHBondContact O-N 2.86Å; Q639-Q642 PolarHBondContact O-N 3.42Å; F640-Q642 VanDerWaalsContact C-N 3.32Å; F640-Q642 PolarHBondContact O-N 2.9Å; Q642-A645 CarbonylContact O-C 3.51Å; Q642-A645 PolarHBondContact O-N 3.2Å; Q642-I646 WeakPolarHBondContact O-CG1 3.1Å; Q642-I646 PolarHBondContact O-N 3.38Å; Q642-I646 VanDerWaalsContact O-N 3.09Å
643	L	69.3	Low	61.8	Low	116 Å²	116	109.1 Å²	109.1	61%	0.607	57%	0.567	S	S	*	*	H	α-helix	trans	-62.9	-45.9	175.1	-77.4	165.4	0	0	0	111.8	Q639 F640 A645 I646	Q639-L643 WeakPolarHBondContact O-CB 3.44Å; Q639-L643 WeakPolarHBondContact O-CG 3.45Å; Q639-L643 PolarHBondContact O-N 3.38Å; F640-L643 WeakPolarHBondContact O-CB 3.46Å; F640-L643 PolarHBondContact O-N 2.9Å; L643-A645 PolarHBondContact O-N 2.83Å; L643-I646 HydrophobicContact CD2-CD1 3.69Å; L643-I646 VanDerWaalsContact O-CB 3.29Å; L643-I646 WeakPolarHBondContact O-CB 3.09Å; L643-I646 WeakPolarHBondContact O-CG1 3.25Å; L643-I646 PolarHBondContact O-N 3.5Å; L643-I646 VanDerWaalsContact O-N 3.08Å
644	D	67.5	Low	60.8	Low	115 Å²	115	109.6 Å²	109.6	62%	0.615	57%	0.566	S	S	*	*	H	α-helix	trans	-67.2	-28.1	177.4	-123.6	21.2	0	0	0	112.1	F640 I646	F640-D644 PolarHBondContact O-N 2.98Å; D644-I646 VanDerWaalsContact C-N 3.35Å
645	A	62	Low	59.8	Low	34 Å²	34	107.7 Å²	107.7	28%	0.281	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.7	2.9	172.9	0	0	0	0	0	113.5	W641 Q642 L643 G647 I648 I649	W641-A645 WeakPolarHBondContact O-CB 3.44Å; W641-A645 PolarHBondContact O-N 3.13Å; Q642-A645 CarbonylContact O-C 3.51Å; Q642-A645 PolarHBondContact O-N 3.2Å; L643-A645 PolarHBondContact O-N 2.83Å; A645-G647 PolarHBondContact O-N 2.88Å; A645-G647 VanDerWaalsContact O-N 3.14Å; A645-I648 CarbonylContact O-C 3.53Å; A645-I648 WeakPolarHBondContact O-CA 3.38Å; A645-I648 PolarHBondContact O-N 3.42Å; A645-I649 WeakPolarHBondContact O-CG1 3.38Å; A645-I649 PolarHBondContact O-N 2.95Å; A645-I649 VanDerWaalsContact O-N 3.07Å
646	I	54.4	Low	59	Low	117 Å²	117	107.1 Å²	107.1	60%	0.6	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	120.6	174.7	-71.7	178	0	0	0	108.8	Q642 L643 D644 I648	Q642-I646 WeakPolarHBondContact O-CG1 3.1Å; Q642-I646 PolarHBondContact O-N 3.38Å; Q642-I646 VanDerWaalsContact O-N 3.09Å; L643-I646 HydrophobicContact CD2-CD1 3.69Å; L643-I646 VanDerWaalsContact O-CB 3.29Å; L643-I646 WeakPolarHBondContact O-CB 3.09Å; L643-I646 WeakPolarHBondContact O-CG1 3.25Å; L643-I646 PolarHBondContact O-N 3.5Å; L643-I646 VanDerWaalsContact O-N 3.08Å; D644-I646 VanDerWaalsContact C-N 3.35Å; I646-I648 VanDerWaalsContact C-N 3.25Å; I646-I648 PolarHBondContact O-N 3.13Å
647	G	56.1	Low	58.1	Low	75 Å²	75	105.3 Å²	105.3	77%	0.773	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	85.7	-12.3	-173.5	0	0	0	0	0	114.5	A645	A645-G647 PolarHBondContact O-N 2.88Å; A645-G647 VanDerWaalsContact O-N 3.14Å
648	I	57.1	Low	57	Low	134 Å²	134	112.3 Å²	112.3	69%	0.687	58%	0.582	S	S	*	*			trans	-113	33.1	167.8	-36.2	176.7	0	0	0	109.3	A645 I646 P650	A645-I648 CarbonylContact O-C 3.53Å; A645-I648 WeakPolarHBondContact O-CA 3.38Å; A645-I648 PolarHBondContact O-N 3.42Å; I646-I648 VanDerWaalsContact C-N 3.25Å; I646-I648 PolarHBondContact O-N 3.13Å; I648-P650 WeakPolarHBondContact O-CD 3.48Å
649	I	48.3	Very low	55.9	Low	111 Å²	111	106.2 Å²	106.2	57%	0.569	57%	0.565	S	S	*	*	S	Bend	trans	-79.7	117.8	161.5	-49.3	-179.8	0	0	0	102.7	A645 E651	A645-I649 WeakPolarHBondContact O-CG1 3.38Å; A645-I649 PolarHBondContact O-N 2.95Å; A645-I649 VanDerWaalsContact O-N 3.07Å; I649-E651 PolarHBondContact O-N 3.31Å
650	P	50.7	Low	54.9	Low	112 Å²	112	105 Å²	105	73%	0.727	56%	0.559	S	S	*	*			trans	-50.8	122.8	166.1	-11.3	22.5	0	0	0	104.6	I648 E652	I648-P650 WeakPolarHBondContact O-CD 3.48Å; P650-E652 PolarHBondContact O-N 3.13Å
651	E	49.8	Very low	53.6	Low	179 Å²	179	106.9 Å²	106.9	84%	0.836	56%	0.563	S	S	*	*			trans	-43.2	116.9	173.5	-75.4	-170.4	159.9	0	0	105.6	I649 N653	I649-E651 PolarHBondContact O-N 3.31Å; E651-N653 PolarHBondContact O-N 3.23Å
652	E	48.2	Very low	52.5	Low	140 Å²	140	107 Å²	107	65%	0.654	57%	0.565	S	S	*	*			trans	-48.3	123.4	168.9	-74.8	-175.4	171.7	0	0	103.5	P650 N654	P650-E652 PolarHBondContact O-N 3.13Å; E652-N654 WeakPolarHBondContact CB-ND2 3.49Å; E652-N654 PolarHBondContact O-N 3.06Å; E652-N654 PolarHBondContact OE2-ND2 2.97Å
653	N	47	Very low	51.6	Low	108 Å²	108	103 Å²	103	58%	0.578	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	45.6	-176.7	-141.4	23.3	0	0	0	108.9	E651 G655 S656	E651-N653 PolarHBondContact O-N 3.23Å; N653-G655 CarbonylContact O-C 3.54Å; N653-G655 PolarHBondContact O-N 3.05Å; N653-S656 PolarHBondContact O-N 3.43Å
654	N	42.3	Very low	50.7	Low	129 Å²	129	104.5 Å²	104.5	69%	0.69	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-17.9	167.9	-72.5	-23.1	0	0	0	110.1	E652 S656	E652-N654 WeakPolarHBondContact CB-ND2 3.49Å; E652-N654 PolarHBondContact O-N 3.06Å; E652-N654 PolarHBondContact OE2-ND2 2.97Å; N654-S656 PolarHBondContact O-N 3.41Å; N654-S656 VanDerWaalsContact O-N 3.08Å
655	G	41	Very low	50.3	Low	50 Å²	50	105.9 Å²	105.9	52%	0.515	56%	0.559	S	S	.	*			trans	-76	67.8	152.7	0	0	0	0	0	110.7	N653 S657	N653-G655 CarbonylContact O-C 3.54Å; N653-G655 PolarHBondContact O-N 3.05Å; G655-S657 PolarHBondContact O-N 2.86Å
656	S	45.7	Very low	50.4	Low	41 Å²	41	109.6 Å²	109.6	29%	0.287	57%	0.566	S	S	.	*			trans	-50.4	96	152.3	163	0	0	0	0	105.1	N653 N654 R658 R661	N653-S656 PolarHBondContact O-N 3.43Å; N654-S656 PolarHBondContact O-N 3.41Å; N654-S656 VanDerWaalsContact O-N 3.08Å; S656-R658 PolarHBondContact O-N 3.5Å; S656-R661 VanDerWaalsContact OG-CG 3.28Å; S656-R661 WeakPolarHBondContact OG-CG 3.35Å; S656-R661 PolarHBondContact OG-NE 3.03Å; S656-R661 VanDerWaalsContact OG-NE 3.13Å
657	S	50.1	Low	51	Low	50 Å²	50	107.7 Å²	107.7	35%	0.35	56%	0.561	S	S	.	*			trans	-57.9	141.1	-170.5	56	0	0	0	0	105.5	G655 A659 E660 R661	G655-S657 PolarHBondContact O-N 2.86Å; S657-A659 CarbonylContact O-C 3.57Å; S657-A659 PolarHBondContact O-N 3.42Å; S657-E660 PolarHBondContact O-N 3.38Å; S657-E660 PolarHBondContact OG-N 2.95Å; S657-R661 PolarHBondContact O-N 3.21Å
658	R	49	Very low	52.3	Low	217 Å²	217	109.7 Å²	109.7	82%	0.819	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.3	-23.1	176.7	-172.4	170.5	176.3	164.7	-1.8	111.6	S656 Y662	S656-R658 PolarHBondContact O-N 3.5Å; R658-Y662 WeakPolarHBondContact O-CB 3.32Å; R658-Y662 PolarHBondContact O-N 3.46Å
659	A	47	Very low	53.6	Low	27 Å²	27	108.9 Å²	108.9	22%	0.223	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-41.9	172.9	0	0	0	0	0	115.9	S657 R661 Y662 C663	S657-A659 CarbonylContact O-C 3.57Å; S657-A659 PolarHBondContact O-N 3.42Å; A659-R661 VanDerWaalsContact C-N 3.25Å; A659-R661 PolarHBondContact O-N 3.07Å; A659-Y662 CarbonylContact O-C 3.34Å; A659-Y662 WeakPolarHBondContact O-CA 3.46Å; A659-Y662 WeakPolarHBondContact O-CB 3.43Å; A659-Y662 PolarHBondContact O-N 3.04Å; A659-C663 PolarHBondContact O-N 3.37Å
660	E	48.9	Very low	55.6	Low	52 Å²	52	109.1 Å²	109.1	24%	0.243	54%	0.543	C	S	.	.	H	α-helix	trans	-58.8	-42.2	171.1	-83.1	173.7	-179.6	0	0	110.4	S657 Y662 C663 L664	S657-E660 PolarHBondContact O-N 3.38Å; S657-E660 PolarHBondContact OG-N 2.95Å; E660-Y662 PolarHBondContact O-N 2.9Å; E660-C663 PolarHBondContact O-N 2.98Å; E660-L664 WeakPolarHBondContact O-CB 3.49Å; E660-L664 WeakPolarHBondContact O-CD1 3.42Å; E660-L664 WeakPolarHBondContact O-CG 3.46Å; E660-L664 PolarHBondContact O-N 3.31Å; E660-L664 VanDerWaalsContact O-N 3.08Å
661	R	48.8	Very low	57.2	Low	156 Å²	156	107.8 Å²	107.8	59%	0.589	53%	0.53	S	S	*	.	H	α-helix	trans	-65.3	-20.8	171.1	-58.8	-171.6	-159.8	167.9	4.8	113.2	S656 S657 A659 K665	S656-R661 VanDerWaalsContact OG-CG 3.28Å; S656-R661 WeakPolarHBondContact OG-CG 3.35Å; S656-R661 PolarHBondContact OG-NE 3.03Å; S656-R661 VanDerWaalsContact OG-NE 3.13Å; S657-R661 PolarHBondContact O-N 3.21Å; A659-R661 VanDerWaalsContact C-N 3.25Å; A659-R661 PolarHBondContact O-N 3.07Å; R661-K665 VanDerWaalsContact O-CG 3.31Å; R661-K665 WeakPolarHBondContact O-CG 3.35Å
662	Y	48.6	Very low	58.8	Low	152 Å²	152	102 Å²	102	60%	0.596	52%	0.518	S	S	*	.	H	α-helix	trans	-86.8	-41.2	178.9	-128.4	-87.2	0	0	0	112	R658 A659 E660 L664 K665	R658-Y662 WeakPolarHBondContact O-CB 3.32Å; R658-Y662 PolarHBondContact O-N 3.46Å; A659-Y662 CarbonylContact O-C 3.34Å; A659-Y662 WeakPolarHBondContact O-CA 3.46Å; A659-Y662 WeakPolarHBondContact O-CB 3.43Å; A659-Y662 PolarHBondContact O-N 3.04Å; E660-Y662 PolarHBondContact O-N 2.9Å; Y662-L664 VanDerWaalsContact C-N 3.28Å; Y662-L664 PolarHBondContact O-N 3.31Å; Y662-K665 WeakPolarHBondContact O-CB 3.2Å; Y662-K665 PolarHBondContact O-N 2.93Å; Y662-K665 VanDerWaalsContact O-N 3.08Å
663	C	51.5	Low	60.6	Low	47 Å²	47	101.9 Å²	101.9	32%	0.318	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-37.3	172.8	-69.6	0	0	0	0	110.8	A659 E660 K665 R666 P680	A659-C663 PolarHBondContact O-N 3.37Å; E660-C663 PolarHBondContact O-N 2.98Å; C663-K665 PolarHBondContact O-N 3.48Å; C663-R666 PolarHBondContact O-N 3.35Å; C663-P680 VanDerWaalsContact SG-CA 3.57Å; C663-P680 WeakPolarHBondContact SG-CB 3.04Å
664	L	51.6	Low	62.5	Low	148 Å²	148	97.9 Å²	97.9	78%	0.775	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-10.2	173.2	-78.2	161.6	0	0	0	114.6	E660 Y662	E660-L664 WeakPolarHBondContact O-CB 3.49Å; E660-L664 WeakPolarHBondContact O-CD1 3.42Å; E660-L664 WeakPolarHBondContact O-CG 3.46Å; E660-L664 PolarHBondContact O-N 3.31Å; E660-L664 VanDerWaalsContact O-N 3.08Å; Y662-L664 VanDerWaalsContact C-N 3.28Å; Y662-L664 PolarHBondContact O-N 3.31Å
665	K	57.3	Low	64.7	Low	145 Å²	145	98.1 Å²	98.1	63%	0.63	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-25.3	177.5	-82.6	173.5	-176.5	-167.8	0	113.6	R661 Y662 C663	R661-K665 VanDerWaalsContact O-CG 3.31Å; R661-K665 WeakPolarHBondContact O-CG 3.35Å; Y662-K665 WeakPolarHBondContact O-CB 3.2Å; Y662-K665 PolarHBondContact O-N 2.93Å; Y662-K665 VanDerWaalsContact O-N 3.08Å; C663-K665 PolarHBondContact O-N 3.48Å
666	R	65.4	Low	67	Low	112 Å²	112	96.6 Å²	96.6	42%	0.423	47%	0.468	S	S	.	.	S	Bend	trans	-91.8	115.9	174.4	-77.4	-170.4	177.1	-144	-1.9	107.8	C663 I668 P678 E817	C663-R666 PolarHBondContact O-N 3.35Å; R666-I668 PolarHBondContact O-N 2.97Å; R666-P678 HydrophobicContact CB-CB 4.36Å; R666-P678 HydrophobicContact CB-CG 3.73Å; R666-E817 IonicContact CZ-OE2 3.26Å; R666-E817 IonicContact NH1-OE2 3.3Å; R666-E817 PolarHBondContact NH1-OE2 2.98Å; R666-E817 IonicContact NH2-OE2 2.83Å
667	P	67.6	Low	69.1	Low	77 Å²	77	96.2 Å²	96.2	50%	0.5	46%	0.463	S	S	.	.			trans	-65.4	133.6	-173.8	25.3	-32.5	0	0	0	110.8
668	I	82.7	Confident	70.9	Confident	116 Å²	116	94.8 Å²	94.8	60%	0.595	45%	0.453	S	S	*	.			trans	-67.9	129.1	161.8	-59.7	176.1	0	0	0	106.7	R666 Y675 V677	R666-I668 PolarHBondContact O-N 2.97Å; I668-Y675 HydrophobicContact CG2-CD1 4Å; I668-V677 HydrophobicContact CD1-CG1 4.44Å; I668-V677 HydrophobicContact CG1-CG1 4.09Å; I668-V677 HydrophobicContact CG2-CG1 3.94Å
669	Q	84.8	Confident	72.8	Confident	118 Å²	118	85.6 Å²	85.6	55%	0.551	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.9	179.9	-68.1	-177.4	-18.3	0	0	109.9	Y675 V676	Q669-Y675 CarbonylContact O-C 3.59Å; Q669-Y675 WeakPolarHBondContact O-CA 3.41Å; Q669-V676 PolarHBondContact N-O 2.93Å; Q669-V676 VanDerWaalsContact N-O 3.13Å; Q669-V676 PolarHBondContact O-N 3Å
670	F	89.2	Confident	74.8	Confident	115 Å²	115	86.3 Å²	86.3	50%	0.504	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.2	169.8	-176.5	-110.9	0	0	0	108.1	G672 R674 Y675	F670-G672 VanDerWaalsContact C-N 3.3Å; F670-G672 VanDerWaalsContact CE1-C 3.46Å; F670-G672 WeakPolarHBondContact CE1-O 3.4Å; F670-G672 VanDerWaalsContact CZ-O 3.24Å; F670-G672 WeakPolarHBondContact CZ-O 3.45Å; F670-R674 WeakPolarHBondContact CD2-O 3.35Å; F670-Y675 HydrophobicContact CB-CD1 4.13Å; F670-Y675 HydrophobicContact CB-CE1 4.05Å; F670-Y675 HydrophobicContact CD2-CD1 4.03Å; F670-Y675 HydrophobicContact CD2-CD2 4.09Å; F670-Y675 AromaticContact CD2-CE1 3.98Å; F670-Y675 HydrophobicContact CD2-CE1 3.98Å; F670-Y675 HydrophobicContact CD2-CE2 4.03Å; F670-Y675 HydrophobicContact CD2-CG 4.1Å; F670-Y675 AromaticContact CD2-CZ 3.97Å; F670-Y675 HydrophobicContact CE2-CD2 4.48Å; F670-Y675 HydrophobicContact CE2-CE2 4.3Å; F670-Y675 HydrophobicContact CG-CE1 4.32Å
671	N	84.6	Confident	76.6	Confident	84 Å²	84	86 Å²	86	45%	0.449	42%	0.419	S	S	.	.			trans	-88.9	4.8	-176.7	67.6	10.2	0	0	0	113.5	E673 R674 V676 E813	N671-E673 PolarHBondContact OD1-N 2.74Å; N671-R674 PolarHBondContact N-O 3.14Å; N671-R674 PolarHBondContact OD1-N 2.78Å; N671-R674 PolarHBondContact OD1-O 3.24Å; N671-R674 VanDerWaalsContact OD1-O 3.07Å; N671-V676 HydrophobicContact CB-CG2 4.1Å; N671-E813 PolarHBondContact ND2-OE2 3.34Å
672	G	84.1	Confident	78.2	Confident	58 Å²	58	82.2 Å²	82.2	60%	0.598	41%	0.407	S	S	*	.	S	Bend	trans	104.6	-25.9	-175.3	0	0	0	0	0	113.3	F670	F670-G672 VanDerWaalsContact C-N 3.3Å; F670-G672 VanDerWaalsContact CE1-C 3.46Å; F670-G672 WeakPolarHBondContact CE1-O 3.4Å; F670-G672 VanDerWaalsContact CZ-O 3.24Å; F670-G672 WeakPolarHBondContact CZ-O 3.45Å
673	E	85.2	Confident	79.6	Confident	137 Å²	137	82.3 Å²	82.3	64%	0.64	41%	0.411	S	S	*	.	S	Bend	trans	-118.2	-44.2	178.1	-165.4	-173.9	143.8	0	0	111.6	N671	N671-E673 PolarHBondContact OD1-N 2.74Å
674	R	86.9	Confident	81	Confident	24 Å²	24	89.3 Å²	89.3	9%	0.091	44%	0.435	C	S	.	.	S	Bend	trans	-133.8	157.6	-172.4	-63.8	-177.4	-168.5	167.4	6.7	112.3	F670 N671 K725 G726 Q811 E813	F670-R674 WeakPolarHBondContact CD2-O 3.35Å; N671-R674 PolarHBondContact N-O 3.14Å; N671-R674 PolarHBondContact OD1-N 2.78Å; N671-R674 PolarHBondContact OD1-O 3.24Å; N671-R674 VanDerWaalsContact OD1-O 3.07Å; R674-K725 PolarHBondContact NH2-O 2.85Å; R674-G726 PolarHBondContact NH1-O 3Å; R674-Q811 WeakPolarHBondContact CB-O 3.43Å; R674-E813 HydrophobicContact CB-CB 4.18Å
675	Y	87.9	Confident	82.4	Confident	135 Å²	135	83.4 Å²	83.4	53%	0.529	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	120.6	168.3	-70.9	-83	0	0	0	109.4	I668 Q669 F670 T812 E813	I668-Y675 HydrophobicContact CG2-CD1 4Å; Q669-Y675 CarbonylContact O-C 3.59Å; Q669-Y675 WeakPolarHBondContact O-CA 3.41Å; F670-Y675 HydrophobicContact CB-CD1 4.13Å; F670-Y675 HydrophobicContact CB-CE1 4.05Å; F670-Y675 HydrophobicContact CD2-CD1 4.03Å; F670-Y675 HydrophobicContact CD2-CD2 4.09Å; F670-Y675 AromaticContact CD2-CE1 3.98Å; F670-Y675 HydrophobicContact CD2-CE1 3.98Å; F670-Y675 HydrophobicContact CD2-CE2 4.03Å; F670-Y675 HydrophobicContact CD2-CG 4.1Å; F670-Y675 AromaticContact CD2-CZ 3.97Å; F670-Y675 HydrophobicContact CE2-CD2 4.48Å; F670-Y675 HydrophobicContact CE2-CE2 4.3Å; F670-Y675 HydrophobicContact CG-CE1 4.32Å; Y675-T812 WeakPolarHBondContact O-CA 3.46Å; Y675-E813 PolarHBondContact O-N 3.02Å
676	V	90.2	Very high	83.5	Confident	18 Å²	18	84.9 Å²	84.9	11%	0.109	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	120.7	175.8	-171.8	0	0	0	0	109	Q669 N671 E813 Q815	Q669-V676 PolarHBondContact N-O 2.93Å; Q669-V676 VanDerWaalsContact N-O 3.13Å; Q669-V676 PolarHBondContact O-N 3Å; N671-V676 HydrophobicContact CB-CG2 4.1Å; V676-E813 CarbonylContact C-O 3.54Å; V676-E813 VanDerWaalsContact CA-O 3.27Å; V676-E813 WeakPolarHBondContact CA-O 3.08Å; V676-E813 HydrophobicContact CG2-CB 4.26Å; V676-Q815 HydrophobicContact CG1-CG 3.86Å
677	V	89.6	Confident	84.6	Confident	32 Å²	32	79.9 Å²	79.9	19%	0.194	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.3	-176.4	-59.3	0	0	0	0	111.6	I668 E813 L814 Q815	I668-V677 HydrophobicContact CD1-CG1 4.44Å; I668-V677 HydrophobicContact CG1-CG1 4.09Å; I668-V677 HydrophobicContact CG2-CG1 3.94Å; V677-E813 PolarHBondContact N-O 3.07Å; V677-L814 HydrophobicContact CG2-CD2 4.27Å; V677-L814 CarbonylContact O-C 3.56Å; V677-L814 WeakPolarHBondContact O-CA 3.21Å; V677-Q815 PolarHBondContact O-N 3.13Å
678	P	88.2	Confident	85.6	Confident	21 Å²	21	77.5 Å²	77.5	14%	0.136	38%	0.379	C	S	.	.			trans	-76.8	157.7	169.4	32.9	-35.9	0	0	0	111.5	R666 Q815 D818	R666-P678 HydrophobicContact CB-CB 4.36Å; R666-P678 HydrophobicContact CB-CG 3.73Å; P678-Q815 HydrophobicContact CB-CG 4.42Å; P678-D818 WeakPolarHBondContact CA-OD2 3.46Å
679	L	89.6	Confident	85.9	Confident	23 Å²	23	77 Å²	77	12%	0.12	38%	0.378	C	S	.	.			trans	-69.3	136.1	166.4	-79.4	176.8	0	0	0	110.3	W681 L777 L814 D818 F821 V822	L679-W681 HydrophobicContact CB-CD2 4.33Å; L679-W681 HydrophobicContact CB-CZ2 3.92Å; L679-W681 HydrophobicContact CD1-CH2 3.92Å; L679-W681 HydrophobicContact CD1-CZ2 3.46Å; L679-W681 VanDerWaalsContact CD1-CZ2 3.46Å; L679-W681 HydrophobicContact CG-CZ2 4.34Å; L679-W681 PolarHBondContact O-N 3.48Å; L679-L777 HydrophobicContact CB-CD2 3.92Å; L679-L777 HydrophobicContact CD2-CD1 4.09Å; L679-L777 HydrophobicContact CD2-CD2 4.29Å; L679-L777 HydrophobicContact CG-CD2 4.48Å; L679-L814 HydrophobicContact CD1-CD1 4.49Å; L679-L814 HydrophobicContact CD2-CD1 4.31Å; L679-L814 HydrophobicContact CD2-CD2 3.89Å; L679-L814 HydrophobicContact CG-CD1 4.28Å; L679-L814 HydrophobicContact CG-CD2 3.98Å; L679-D818 HydrophobicContact CB-CB 4.2Å; L679-D818 HydrophobicContact CD1-CB 4.01Å; L679-D818 HydrophobicContact CG-CB 3.99Å; L679-D818 PolarHBondContact N-OD2 2.93Å; L679-F821 HydrophobicContact CD1-CB 3.96Å; L679-V822 HydrophobicContact CD1-CG1 4.42Å
680	P	87.2	Confident	86.3	Confident	43 Å²	43	71.5 Å²	71.5	28%	0.279	35%	0.352	S	S	.	.			trans	-80.7	62.5	-173.6	33.5	-38.1	0	0	0	112.4	C663 K682 L777 N778	C663-P680 VanDerWaalsContact SG-CA 3.57Å; C663-P680 WeakPolarHBondContact SG-CB 3.04Å; P680-K682 PolarHBondContact O-N 3.18Å; P680-L777 HydrophobicContact CG-CB 4.42Å; P680-L777 HydrophobicContact CG-CD2 4.46Å; P680-N778 HydrophobicContact CB-CB 4.31Å; P680-N778 WeakPolarHBondContact CG-O 3.33Å; P680-N778 WeakPolarHBondContact O-CB 3.1Å; P680-N778 PolarHBondContact O-N 2.96Å; P680-N778 PolarHBondContact O-ND2 2.72Å
681	W	87.4	Confident	86.5	Confident	44 Å²	44	70.6 Å²	70.6	17%	0.167	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-55.4	131.1	-176.3	-61.9	111.8	0	0	0	113.5	L679 P685 L773 L776 L777 N778 D818 F821	L679-W681 HydrophobicContact CB-CD2 4.33Å; L679-W681 HydrophobicContact CB-CZ2 3.92Å; L679-W681 HydrophobicContact CD1-CH2 3.92Å; L679-W681 HydrophobicContact CD1-CZ2 3.46Å; L679-W681 VanDerWaalsContact CD1-CZ2 3.46Å; L679-W681 HydrophobicContact CG-CZ2 4.34Å; L679-W681 PolarHBondContact O-N 3.48Å; W681-P685 HydrophobicContact CD2-CB 4.19Å; W681-P685 HydrophobicContact CD2-CG 3.94Å; W681-P685 HydrophobicContact CE3-CB 3.81Å; W681-P685 HydrophobicContact CE3-CG 4.09Å; W681-P685 HydrophobicContact CH2-CB 3.88Å; W681-P685 HydrophobicContact CH2-CG 4.17Å; W681-P685 HydrophobicContact CZ2-CB 4.23Å; W681-P685 HydrophobicContact CZ2-CG 4Å; W681-P685 HydrophobicContact CZ3-CB 3.66Å; W681-P685 HydrophobicContact CZ3-CG 4.22Å; W681-L773 HydrophobicContact CH2-CD1 3.73Å; W681-L773 HydrophobicContact CZ3-CD1 3.97Å; W681-L776 HydrophobicContact CE3-CB 4Å; W681-L776 HydrophobicContact CZ3-CB 3.82Å; W681-L776 HydrophobicContact CZ3-CD1 4.2Å; W681-L777 HydrophobicContact CD2-CD2 3.95Å; W681-L777 HydrophobicContact CE3-CD2 3.55Å; W681-L777 HydrophobicContact CH2-CD2 4.21Å; W681-L777 HydrophobicContact CZ3-CD2 3.69Å; W681-L777 HydrophobicContact CZ3-CG 4.48Å; W681-N778 PolarHBondContact O-ND2 3.1Å; W681-D818 PolarHBondContact NE1-OD1 3.27Å; W681-F821 HydrophobicContact CH2-CB 3.87Å; W681-F821 AromaticContact CH2-CD1 3.52Å; W681-F821 HydrophobicContact CH2-CD1 3.52Å; W681-F821 HydrophobicContact CH2-CD2 4.07Å; W681-F821 AromaticContact CH2-CE1 3.99Å; W681-F821 HydrophobicContact CH2-CE1 3.99Å; W681-F821 HydrophobicContact CH2-CE2 4.48Å; W681-F821 AromaticContact CH2-CG 3.55Å; W681-F821 HydrophobicContact CH2-CG 3.55Å; W681-F821 HydrophobicContact CH2-CZ 4.44Å; W681-F821 HydrophobicContact CZ2-CB 3.99Å; W681-F821 AromaticContact CZ2-CD1 3.84Å; W681-F821 HydrophobicContact CZ2-CD1 3.84Å; W681-F821 AromaticContact CZ2-CD2 3.53Å; W681-F821 HydrophobicContact CZ2-CD2 3.53Å; W681-F821 HydrophobicContact CZ2-CE1 4.15Å; W681-F821 AromaticContact CZ2-CE2 3.84Å; W681-F821 HydrophobicContact CZ2-CE2 3.84Å; W681-F821 AromaticContact CZ2-CG 3.5Å; W681-F821 HydrophobicContact CZ2-CG 3.5Å; W681-F821 HydrophobicContact CZ2-CZ 4.14Å
682	K	82.7	Confident	86.8	Confident	77 Å²	77	70.2 Å²	70.2	34%	0.335	35%	0.348	S	S	.	.	S	Bend	trans	-69.3	-43.1	168.5	-75.4	171.9	-178.1	149.9	0	111.4	P680 D775 L776 L777 N778	P680-K682 PolarHBondContact O-N 3.18Å; K682-D775 WeakPolarHBondContact CD-O 3.33Å; K682-D775 PolarHBondContact NZ-O 2.95Å; K682-L776 WeakPolarHBondContact CB-O 3.36Å; K682-L776 PolarHBondContact N-O 3.28Å; K682-L777 WeakPolarHBondContact CE-O 3.11Å; K682-L777 PolarHBondContact NZ-O 3.02Å; K682-L777 VanDerWaalsContact NZ-O 3.08Å; K682-N778 WeakPolarHBondContact CA-ND2 3.39Å; K682-N778 HydrophobicContact CG-CB 4.44Å; K682-N778 VanDerWaalsContact CG-OD1 3.27Å; K682-N778 WeakPolarHBondContact CG-OD1 3.35Å
683	F	78	Confident	87.3	Confident	155 Å²	155	70.1 Å²	70.1	68%	0.68	33%	0.33	S	S	*	.	S	Bend	trans	-144.2	165.9	-176.9	-44.8	-73.6	0	0	0	108.9	P685	F683-P685 WeakPolarHBondContact O-CD 3.45Å; F683-P685 VanDerWaalsContact O-N 3.16Å
684	K	80.2	Confident	87.8	Confident	193 Å²	193	63.8 Å²	63.8	84%	0.839	30%	0.3	S	S	*	.			trans	-57.3	120.2	176.1	-172.7	175.6	-178.3	177.4	0	109.5
685	P	80.6	Confident	88.2	Confident	24 Å²	24	64.9 Å²	64.9	16%	0.156	31%	0.308	C	S	.	.			trans	-68.3	138.7	-172.7	26.7	-34.6	0	0	0	111.6	W681 F683 L776 F821	W681-P685 HydrophobicContact CD2-CB 4.19Å; W681-P685 HydrophobicContact CD2-CG 3.94Å; W681-P685 HydrophobicContact CE3-CB 3.81Å; W681-P685 HydrophobicContact CE3-CG 4.09Å; W681-P685 HydrophobicContact CH2-CB 3.88Å; W681-P685 HydrophobicContact CH2-CG 4.17Å; W681-P685 HydrophobicContact CZ2-CB 4.23Å; W681-P685 HydrophobicContact CZ2-CG 4Å; W681-P685 HydrophobicContact CZ3-CB 3.66Å; W681-P685 HydrophobicContact CZ3-CG 4.22Å; F683-P685 WeakPolarHBondContact O-CD 3.45Å; F683-P685 VanDerWaalsContact O-N 3.16Å; P685-L776 HydrophobicContact CB-CD1 4.29Å; P685-F821 HydrophobicContact CB-CD1 4.44Å; P685-F821 HydrophobicContact CB-CE1 3.62Å; P685-F821 HydrophobicContact CB-CZ 3.9Å; P685-F821 HydrophobicContact CG-CE1 3.74Å; P685-F821 HydrophobicContact CG-CE2 4.23Å; P685-F821 HydrophobicContact CG-CZ 3.44Å; P685-F821 VanDerWaalsContact CG-CZ 3.44Å
686	K	82.3	Confident	88.6	Confident	176 Å²	176	64.9 Å²	64.9	77%	0.765	31%	0.313	S	S	*	.			trans	-140.9	93.9	166.3	-83.1	-170.6	174.1	-172.8	0	107.3
687	L	87.5	Confident	88.9	Confident	7 Å²	7	67.3 Å²	67.3	4%	0.037	32%	0.32	C	S	.	.			trans	-99.5	138.1	-179.3	-76	169.5	0	0	0	111.5	G738 W741 L771 L773 L776 F821	L687-G738 PolarHBondContact N-O 3.27Å; L687-G738 VanDerWaalsContact N-O 3.15Å; L687-G738 WeakPolarHBondContact O-CA 3.28Å; L687-W741 HydrophobicContact CB-CD2 4.48Å; L687-W741 HydrophobicContact CB-CE3 3.66Å; L687-W741 HydrophobicContact CB-CZ3 4.06Å; L687-W741 HydrophobicContact CD1-CB 3.68Å; L687-W741 HydrophobicContact CD1-CD2 3.85Å; L687-W741 HydrophobicContact CD1-CE3 3.86Å; L687-W741 HydrophobicContact CD1-CG 3.83Å; L687-W741 HydrophobicContact CD2-CD2 4.29Å; L687-W741 HydrophobicContact CD2-CE3 3.84Å; L687-W741 HydrophobicContact CD2-CH2 4.2Å; L687-W741 HydrophobicContact CD2-CZ3 3.77Å; L687-W741 HydrophobicContact CG-CD2 4.44Å; L687-W741 HydrophobicContact CG-CE3 3.99Å; L687-W741 HydrophobicContact CG-CZ3 4.36Å; L687-L771 HydrophobicContact CD2-CB 4.49Å; L687-L773 HydrophobicContact CD1-CD1 4.13Å; L687-L776 HydrophobicContact CD1-CD1 4.04Å; L687-L776 HydrophobicContact CD2-CD1 3.35Å; L687-L776 HydrophobicContact CD2-CG 4.27Å; L687-L776 HydrophobicContact CG-CD1 3.51Å; L687-F821 HydrophobicContact CD1-CD1 3.83Å; L687-F821 HydrophobicContact CD1-CE1 4.36Å
688	P	89.3	Confident	89.2	Confident	28 Å²	28	67.1 Å²	67.1	18%	0.182	32%	0.318	C	S	.	.			trans	-67.9	154.1	171.4	27.3	-31.3	0	0	0	110.8	N690 W741 Y768 Q769	P688-N690 PolarHBondContact O-N 3.14Å; P688-W741 HydrophobicContact CG-CZ3 4.09Å; P688-W741 WeakPolarHBondContact O-CZ3 3.23Å; P688-Y768 HydrophobicContact CB-CD1 4.29Å; P688-Y768 HydrophobicContact CB-CE1 4.27Å; P688-Y768 HydrophobicContact CG-CD1 4.04Å; P688-Y768 HydrophobicContact CG-CE1 4.5Å; P688-Q769 HydrophobicContact CG-CB 4.19Å
689	N	89.3	Confident	89.6	Confident	106 Å²	106	70.9 Å²	70.9	57%	0.567	33%	0.332	S	S	*	.			trans	-68	100.8	176.9	-178.1	-5.8	0	0	0	110.8	Y691 Y768	N689-Y691 WeakPolarHBondContact OD1-CB 3.26Å; N689-Y691 PolarHBondContact OD1-N 3.3Å; N689-Y768 WeakPolarHBondContact O-CE1 3.5Å
690	N	93.3	Very high	89.9	Confident	1 Å²	1	76 Å²	76	1%	0.005	35%	0.353	C	S	.	.			trans	-90.8	8	-179	77.8	-26	0	0	0	114.1	P688 P692 Y693 A694 W741 Y742 Y768	P688-N690 PolarHBondContact O-N 3.14Å; N690-P692 VanDerWaalsContact C-CD 3.45Å; N690-Y693 WeakPolarHBondContact O-CB 3.29Å; N690-Y693 PolarHBondContact O-N 2.79Å; N690-A694 PolarHBondContact O-N 2.97Å; N690-W741 HydrophobicContact CB-CD2 4.33Å; N690-W741 HydrophobicContact CB-CE3 3.81Å; N690-W741 HydrophobicContact CB-CH2 3.92Å; N690-W741 HydrophobicContact CB-CZ2 4.34Å; N690-W741 HydrophobicContact CB-CZ3 3.61Å; N690-W741 VanDerWaalsContact CG-CE3 3.46Å; N690-W741 VanDerWaalsContact ND2-CD2 3.28Å; N690-W741 WeakPolarHBondContact ND2-CZ2 3.33Å; N690-Y742 PolarHBondContact ND2-O 2.83Å; N690-Y742 PolarHBondContact OD1-N 3.1Å; N690-Y768 HydrophobicContact CB-CD1 3.53Å; N690-Y768 HydrophobicContact CB-CE1 4.23Å; N690-Y768 HydrophobicContact CB-CG 3.73Å
691	Y	92.2	Very high	90.3	Very high	96 Å²	96	74.4 Å²	74.4	38%	0.376	34%	0.342	S	S	.	.	H	α-helix	trans	-49.9	-46.8	179.9	177.3	-88	0	0	0	113.7	N689 Y693 A694 L695 Y742 L825	N689-Y691 WeakPolarHBondContact OD1-CB 3.26Å; N689-Y691 PolarHBondContact OD1-N 3.3Å; Y691-Y693 PolarHBondContact O-N 3.35Å; Y691-A694 PolarHBondContact O-N 3.24Å; Y691-L695 HydrophobicContact CE1-CB 4.48Å; Y691-L695 HydrophobicContact CE1-CD2 4Å; Y691-L695 WeakPolarHBondContact O-CB 3.43Å; Y691-L695 PolarHBondContact O-N 3.37Å; Y691-Y742 HydrophobicContact CD2-CD1 4.36Å; Y691-Y742 HydrophobicContact CD2-CD2 4.16Å; Y691-Y742 HydrophobicContact CD2-CE1 4.03Å; Y691-Y742 AromaticContact CD2-CE2 3.84Å; Y691-Y742 HydrophobicContact CD2-CE2 3.84Å; Y691-Y742 HydrophobicContact CD2-CG 4.42Å; Y691-Y742 AromaticContact CD2-CZ 3.76Å; Y691-Y742 HydrophobicContact CG-CE2 4.34Å; Y691-L825 HydrophobicContact CD2-CD1 4.07Å; Y691-L825 HydrophobicContact CD2-CD2 3.77Å; Y691-L825 HydrophobicContact CD2-CG 4.46Å; Y691-L825 HydrophobicContact CE2-CD1 3.91Å; Y691-L825 HydrophobicContact CE2-CD2 3.4Å; Y691-L825 VanDerWaalsContact CE2-CD2 3.4Å; Y691-L825 HydrophobicContact CE2-CG 4.29Å
692	P	92.1	Very high	90.6	Very high	76 Å²	76	77.3 Å²	77.3	49%	0.494	36%	0.358	S	S	.	.	H	α-helix	trans	-60	-35	179.9	-23.2	34.7	0	0	0	112.8	N690 Q696	N690-P692 VanDerWaalsContact C-CD 3.45Å; P692-Q696 WeakPolarHBondContact O-CB 3.23Å; P692-Q696 PolarHBondContact O-N 2.84Å
693	Y	94.4	Very high	91.1	Very high	57 Å²	57	81.4 Å²	81.4	22%	0.224	37%	0.371	C	S	.	.	H	α-helix	trans	-73.2	-45.1	178.8	175	-102.4	0	0	0	111.7	N690 Y691 L695 Q696 R697 P744 A766 Y768	N690-Y693 WeakPolarHBondContact O-CB 3.29Å; N690-Y693 PolarHBondContact O-N 2.79Å; Y691-Y693 PolarHBondContact O-N 3.35Å; Y693-L695 VanDerWaalsContact C-N 3.32Å; Y693-L695 PolarHBondContact O-N 3.44Å; Y693-Q696 PolarHBondContact O-N 3.14Å; Y693-R697 HydrophobicContact CD1-CG 4.46Å; Y693-R697 HydrophobicContact CE1-CG 4.03Å; Y693-R697 HydrophobicContact CE2-CG 4.31Å; Y693-R697 WeakPolarHBondContact O-CG 3.3Å; Y693-R697 PolarHBondContact O-N 2.8Å; Y693-R697 PolarHBondContact OH-NH1 3.44Å; Y693-P744 HydrophobicContact CD1-CG 4.17Å; Y693-P744 HydrophobicContact CE1-CG 3.76Å; Y693-A766 HydrophobicContact CE1-CB 4.05Å; Y693-Y768 HydrophobicContact CG-CD2 4.04Å
694	A	94.2	Very high	91.8	Very high	3 Å²	3	79 Å²	79	3%	0.025	36%	0.362	C	S	.	.	H	α-helix	trans	-59.7	-43	174.7	0	0	0	0	0	111.4	N690 Y691 Q696 R697 L698 Y742 L825	N690-A694 PolarHBondContact O-N 2.97Å; Y691-A694 PolarHBondContact O-N 3.24Å; A694-Q696 PolarHBondContact O-N 2.87Å; A694-R697 WeakPolarHBondContact O-CB 3.46Å; A694-R697 PolarHBondContact O-N 3.41Å; A694-L698 PolarHBondContact O-N 2.76Å; A694-Y742 HydrophobicContact CB-CG 4.5Å; A694-L825 HydrophobicContact CB-CD1 3.89Å; A694-L825 HydrophobicContact CB-CG 4.37Å
695	L	95.9	Very high	92.3	Very high	47 Å²	47	70.5 Å²	70.5	25%	0.246	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-39.4	177.3	-178	62.3	0	0	0	112	Y691 Y693 R697 L698 K699 L825	Y691-L695 HydrophobicContact CE1-CB 4.48Å; Y691-L695 HydrophobicContact CE1-CD2 4Å; Y691-L695 WeakPolarHBondContact O-CB 3.43Å; Y691-L695 PolarHBondContact O-N 3.37Å; Y693-L695 VanDerWaalsContact C-N 3.32Å; Y693-L695 PolarHBondContact O-N 3.44Å; L695-R697 VanDerWaalsContact C-N 3.33Å; L695-L698 PolarHBondContact O-N 3.29Å; L695-K699 HydrophobicContact CG-CD 4.46Å; L695-K699 WeakPolarHBondContact O-CG 3.48Å; L695-K699 PolarHBondContact O-N 3.35Å; L695-L825 HydrophobicContact CB-CD1 3.77Å; L695-L825 HydrophobicContact CD1-CD1 4.29Å
696	Q	96.3	Very high	92.8	Very high	136 Å²	136	76 Å²	76	64%	0.636	35%	0.349	S	S	*	.	H	α-helix	trans	-63.5	-40.8	174.7	-171.6	-176.2	7.4	0	0	111.5	P692 Y693 A694 K700	P692-Q696 WeakPolarHBondContact O-CB 3.23Å; P692-Q696 PolarHBondContact O-N 2.84Å; Y693-Q696 PolarHBondContact O-N 3.14Å; A694-Q696 PolarHBondContact O-N 2.87Å; Q696-K700 WeakPolarHBondContact O-CB 3.4Å; Q696-K700 PolarHBondContact O-N 3.39Å; Q696-K700 VanDerWaalsContact O-N 3.13Å
697	R	96.8	Very high	93.3	Very high	69 Å²	69	76.1 Å²	76.1	26%	0.26	35%	0.349	S	S	.	.	H	α-helix	trans	-63.9	-42.3	175.1	-69.9	-80.9	-64.3	-106.6	-0.5	111.1	Y693 A694 L695 K700 L701 P744 D763	Y693-R697 HydrophobicContact CD1-CG 4.46Å; Y693-R697 HydrophobicContact CE1-CG 4.03Å; Y693-R697 HydrophobicContact CE2-CG 4.31Å; Y693-R697 WeakPolarHBondContact O-CG 3.3Å; Y693-R697 PolarHBondContact O-N 2.8Å; Y693-R697 PolarHBondContact OH-NH1 3.44Å; A694-R697 WeakPolarHBondContact O-CB 3.46Å; A694-R697 PolarHBondContact O-N 3.41Å; L695-R697 VanDerWaalsContact C-N 3.33Å; R697-K700 PolarHBondContact O-N 3.25Å; R697-L701 PolarHBondContact O-N 3.42Å; R697-P744 HydrophobicContact CB-CB 3.94Å; R697-P744 HydrophobicContact CG-CB 3.93Å; R697-P744 HydrophobicContact CG-CG 4.23Å; R697-D763 IonicContact CZ-OD2 3.1Å; R697-D763 IonicContact NH1-OD2 2.68Å; R697-D763 PolarHBondContact NH1-OD2 3.4Å; R697-D763 IonicContact NH2-OD2 2.69Å; R697-D763 PolarHBondContact NH2-OD2 2.84Å
698	L	96.4	Very high	93.5	Very high	27 Å²	27	80.4 Å²	80.4	14%	0.141	37%	0.368	C	S	.	.	H	α-helix	trans	-62.5	-51.9	176.3	179.7	62	0	0	0	111.8	A694 L695 K700 L701 E702 L825	A694-L698 PolarHBondContact O-N 2.76Å; L695-L698 PolarHBondContact O-N 3.29Å; L698-K700 PolarHBondContact O-N 3.26Å; L698-K700 VanDerWaalsContact O-N 3.14Å; L698-L701 CarbonylContact O-C 3.53Å; L698-L701 WeakPolarHBondContact O-CA 3.29Å; L698-L701 VanDerWaalsContact O-CB 3.31Å; L698-L701 WeakPolarHBondContact O-CB 3.46Å; L698-L701 PolarHBondContact O-N 2.84Å; L698-E702 HydrophobicContact CD1-CG 4.35Å; L698-E702 HydrophobicContact CG-CG 4.46Å; L698-E702 WeakPolarHBondContact O-CG 3.4Å; L698-E702 PolarHBondContact O-N 2.88Å; L698-L825 HydrophobicContact CD2-CB 3.76Å
699	K	96.9	Very high	93.6	Very high	100 Å²	100	83.3 Å²	83.3	44%	0.435	39%	0.387	S	S	.	.	H	α-helix	trans	-56.2	-35.6	177.1	-74.1	177.4	177.8	178.1	0	112.6	L695 R703	L695-K699 HydrophobicContact CG-CD 4.46Å; L695-K699 WeakPolarHBondContact O-CG 3.48Å; L695-K699 PolarHBondContact O-N 3.35Å; K699-R703 VanDerWaalsContact O-CG 3.28Å; K699-R703 WeakPolarHBondContact O-CG 3.33Å; K699-R703 PolarHBondContact O-N 3.37Å
700	K	95.6	Very high	93.5	Very high	130 Å²	130	83.5 Å²	83.5	57%	0.565	39%	0.388	S	S	*	.	H	α-helix	trans	-68.4	-43.5	175	-175.8	179.9	177.9	-178.4	0	111.3	Q696 R697 L698 R703 Q704	Q696-K700 WeakPolarHBondContact O-CB 3.4Å; Q696-K700 PolarHBondContact O-N 3.39Å; Q696-K700 VanDerWaalsContact O-N 3.13Å; R697-K700 PolarHBondContact O-N 3.25Å; L698-K700 PolarHBondContact O-N 3.26Å; L698-K700 VanDerWaalsContact O-N 3.14Å; K700-R703 PolarHBondContact O-N 2.88Å; K700-Q704 WeakPolarHBondContact O-CG 3.43Å; K700-Q704 PolarHBondContact O-N 3.45Å; K700-Q704 VanDerWaalsContact O-N 3.08Å
701	L	95	Very high	93.4	Very high	11 Å²	11	86.8 Å²	86.8	6%	0.058	40%	0.403	C	S	.	.	H	α-helix	trans	-59.9	-46.6	175.5	-179.9	67.2	0	0	0	110.9	R697 L698 R703 Q704 M705 Y715 H746	R697-L701 PolarHBondContact O-N 3.42Å; L698-L701 CarbonylContact O-C 3.53Å; L698-L701 WeakPolarHBondContact O-CA 3.29Å; L698-L701 VanDerWaalsContact O-CB 3.31Å; L698-L701 WeakPolarHBondContact O-CB 3.46Å; L698-L701 PolarHBondContact O-N 2.84Å; L701-R703 PolarHBondContact O-N 2.8Å; L701-Q704 WeakPolarHBondContact O-CB 3.45Å; L701-Q704 PolarHBondContact O-N 2.96Å; L701-Q704 VanDerWaalsContact O-N 3.09Å; L701-M705 HydrophobicContact CD1-CE 3.77Å; L701-M705 HydrophobicContact CD1-CG 4.3Å; L701-M705 HydrophobicContact CG-CG 4.35Å; L701-M705 WeakPolarHBondContact O-CB 3.33Å; L701-M705 VanDerWaalsContact O-CG 3.28Å; L701-M705 WeakPolarHBondContact O-CG 3.4Å; L701-M705 PolarHBondContact O-N 3.22Å; L701-Y715 HydrophobicContact CD2-CE1 4.32Å; L701-Y715 HydrophobicContact CD2-CE2 4.3Å; L701-H746 HydrophobicContact CD1-CB 4.36Å
702	E	93.9	Very high	93.5	Very high	104 Å²	104	88.5 Å²	88.5	49%	0.486	41%	0.409	S	S	.	.	H	α-helix	trans	-57.7	-49.5	178.3	-69.7	179.6	132	0	0	111.9	L698 Q704 M705 E706	L698-E702 HydrophobicContact CD1-CG 4.35Å; L698-E702 HydrophobicContact CG-CG 4.46Å; L698-E702 WeakPolarHBondContact O-CG 3.4Å; L698-E702 PolarHBondContact O-N 2.88Å; E702-Q704 PolarHBondContact O-N 3.49Å; E702-M705 CarbonylContact O-C 3.59Å; E702-M705 PolarHBondContact O-N 3.43Å; E702-E706 WeakPolarHBondContact O-CG 3.41Å; E702-E706 PolarHBondContact O-N 3.34Å
703	R	94.2	Very high	93.5	Very high	164 Å²	164	93.1 Å²	93.1	62%	0.619	42%	0.416	S	S	*	.	H	α-helix	trans	-60.6	-32.5	175.6	-69.4	172.3	-168.4	174.5	2.3	113.2	K699 K700 L701	K699-R703 VanDerWaalsContact O-CG 3.28Å; K699-R703 WeakPolarHBondContact O-CG 3.33Å; K699-R703 PolarHBondContact O-N 3.37Å; K700-R703 PolarHBondContact O-N 2.88Å; L701-R703 PolarHBondContact O-N 2.8Å
704	Q	91.9	Very high	93.3	Very high	104 Å²	104	93 Å²	93	49%	0.486	42%	0.418	S	S	.	.	H	α-helix	trans	-71.6	-38.9	174.6	-75	-179.8	-17.3	0	0	111.2	K700 L701 E702 K707	K700-Q704 WeakPolarHBondContact O-CG 3.43Å; K700-Q704 PolarHBondContact O-N 3.45Å; K700-Q704 VanDerWaalsContact O-N 3.08Å; L701-Q704 WeakPolarHBondContact O-CB 3.45Å; L701-Q704 PolarHBondContact O-N 2.96Å; L701-Q704 VanDerWaalsContact O-N 3.09Å; E702-Q704 PolarHBondContact O-N 3.49Å; Q704-K707 PolarHBondContact O-N 3.24Å
705	M	91.2	Very high	93.3	Very high	14 Å²	14	94 Å²	94	7%	0.069	42%	0.422	C	S	.	.	H	α-helix	trans	-72.5	-31.2	179.9	-71.3	-63	178.6	0	0	113.1	L701 E702 K707 K708 E711 R712 Y715 A747	L701-M705 HydrophobicContact CD1-CE 3.77Å; L701-M705 HydrophobicContact CD1-CG 4.3Å; L701-M705 HydrophobicContact CG-CG 4.35Å; L701-M705 WeakPolarHBondContact O-CB 3.33Å; L701-M705 VanDerWaalsContact O-CG 3.28Å; L701-M705 WeakPolarHBondContact O-CG 3.4Å; L701-M705 PolarHBondContact O-N 3.22Å; E702-M705 CarbonylContact O-C 3.59Å; E702-M705 PolarHBondContact O-N 3.43Å; M705-K707 PolarHBondContact O-N 3.22Å; M705-K708 CarbonylContact O-C 3.28Å; M705-K708 VanDerWaalsContact O-C 3.28Å; M705-K708 PolarHBondContact O-N 3.31Å; M705-E711 HydrophobicContact SD-CB 4.25Å; M705-R712 HydrophobicContact CB-CB 3.99Å; M705-R712 HydrophobicContact CB-CG 4.04Å; M705-R712 HydrophobicContact SD-CB 4.26Å; M705-Y715 HydrophobicContact CE-CD2 4.43Å; M705-Y715 HydrophobicContact CE-CG 4.09Å; M705-A747 HydrophobicContact CE-CB 3.53Å
706	E	90.9	Very high	93.2	Very high	139 Å²	139	95.9 Å²	95.9	65%	0.65	43%	0.431	S	S	*	.	H	α-helix	trans	-56	-37.5	171.5	-77.9	174	171.9	0	0	112.2	E702 K708	E702-E706 WeakPolarHBondContact O-CG 3.41Å; E702-E706 PolarHBondContact O-N 3.34Å; E706-K708 PolarHBondContact O-N 3.2Å
707	K	93.1	Very high	93.1	Very high	179 Å²	179	92.2 Å²	92.2	78%	0.778	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-10	178.6	-60.8	179.3	-177	-174.6	0	113.1	Q704 M705	Q704-K707 PolarHBondContact O-N 3.24Å; M705-K707 PolarHBondContact O-N 3.22Å
708	K	91.3	Very high	92.9	Very high	98 Å²	98	89.3 Å²	89.3	43%	0.426	42%	0.415	S	S	.	.			trans	-138.7	77.1	-170.9	-59.3	-167.2	-177.4	-174.3	0	111.9	M705 E706 N710 E711 R712	M705-K708 CarbonylContact O-C 3.28Å; M705-K708 VanDerWaalsContact O-C 3.28Å; M705-K708 PolarHBondContact O-N 3.31Å; E706-K708 PolarHBondContact O-N 3.2Å; K708-N710 VanDerWaalsContact C-N 3.3Å; K708-N710 PolarHBondContact O-N 3.44Å; K708-E711 HydrophobicContact CB-CB 4.01Å; K708-E711 HydrophobicContact CB-CG 4.21Å; K708-E711 HydrophobicContact CD-CB 4.49Å; K708-E711 HydrophobicContact CD-CG 4.12Å; K708-E711 VanDerWaalsContact CD-OE1 3.3Å; K708-E711 WeakPolarHBondContact CD-OE1 3.34Å; K708-E711 WeakPolarHBondContact CD-OE2 3.25Å; K708-E711 VanDerWaalsContact NZ-CD 3.27Å; K708-E711 IonicContact NZ-OE1 2.87Å; K708-E711 PolarHBondContact NZ-OE1 2.88Å; K708-E711 IonicContact NZ-OE2 2.91Å; K708-E711 PolarHBondContact NZ-OE2 3.32Å; K708-E711 PolarHBondContact O-N 2.86Å; K708-R712 WeakPolarHBondContact O-CB 3.48Å; K708-R712 PolarHBondContact O-N 3.42Å
709	P	90.8	Very high	92.7	Very high	89 Å²	89	89.4 Å²	89.4	58%	0.578	42%	0.415	S	S	*	.	H	α-helix	trans	-59	-37.3	-171.5	-22.8	31.8	0	0	0	114.1	R713	P709-R713 PolarHBondContact O-N 3.05Å
710	N	88.5	Confident	92.6	Very high	110 Å²	110	88.9 Å²	88.9	59%	0.588	41%	0.414	S	S	*	.	H	α-helix	trans	-70.8	-44.7	179.9	-70.1	-18.9	0	0	0	111.9	K708 R712 R713 M714	K708-N710 VanDerWaalsContact C-N 3.3Å; K708-N710 PolarHBondContact O-N 3.44Å; N710-R712 VanDerWaalsContact C-N 3.3Å; N710-R712 PolarHBondContact O-N 3.3Å; N710-R713 PolarHBondContact O-N 2.83Å; N710-M714 WeakPolarHBondContact O-CG 3.43Å; N710-M714 PolarHBondContact O-N 3.35Å; N710-M714 VanDerWaalsContact O-N 3.11Å
711	E	90.1	Very high	92.4	Very high	69 Å²	69	86.7 Å²	86.7	32%	0.322	41%	0.406	S	S	.	.	H	α-helix	trans	-62.3	-41.2	175.1	-63.9	-171.7	-162.8	0	0	110.5	M705 K708 R713 M714 Y715 I749	M705-E711 HydrophobicContact SD-CB 4.25Å; K708-E711 HydrophobicContact CB-CB 4.01Å; K708-E711 HydrophobicContact CB-CG 4.21Å; K708-E711 HydrophobicContact CD-CB 4.49Å; K708-E711 HydrophobicContact CD-CG 4.12Å; K708-E711 VanDerWaalsContact CD-OE1 3.3Å; K708-E711 WeakPolarHBondContact CD-OE1 3.34Å; K708-E711 WeakPolarHBondContact CD-OE2 3.25Å; K708-E711 VanDerWaalsContact NZ-CD 3.27Å; K708-E711 IonicContact NZ-OE1 2.87Å; K708-E711 PolarHBondContact NZ-OE1 2.88Å; K708-E711 IonicContact NZ-OE2 2.91Å; K708-E711 PolarHBondContact NZ-OE2 3.32Å; K708-E711 PolarHBondContact O-N 2.86Å; E711-R713 PolarHBondContact O-N 3.41Å; E711-M714 PolarHBondContact O-N 3.19Å; E711-Y715 WeakPolarHBondContact O-CB 3.49Å; E711-Y715 PolarHBondContact O-N 3.26Å; E711-I749 HydrophobicContact CB-CD1 3.47Å; E711-I749 VanDerWaalsContact CB-CD1 3.47Å; E711-I749 HydrophobicContact CG-CD1 3.49Å; E711-I749 VanDerWaalsContact CG-CD1 3.49Å
712	R	93.6	Very high	92.3	Very high	132 Å²	132	87.4 Å²	87.4	50%	0.498	41%	0.408	S	S	.	.	H	α-helix	trans	-57.4	-47.4	174.4	-175.6	178.8	179.7	-142.1	-0.1	112	M705 K708 N710 M714 Y715 I716	M705-R712 HydrophobicContact CB-CB 3.99Å; M705-R712 HydrophobicContact CB-CG 4.04Å; M705-R712 HydrophobicContact SD-CB 4.26Å; K708-R712 WeakPolarHBondContact O-CB 3.48Å; K708-R712 PolarHBondContact O-N 3.42Å; N710-R712 VanDerWaalsContact C-N 3.3Å; N710-R712 PolarHBondContact O-N 3.3Å; R712-M714 VanDerWaalsContact C-N 3.35Å; R712-M714 PolarHBondContact O-N 2.95Å; R712-Y715 PolarHBondContact O-N 3.42Å; R712-I716 HydrophobicContact CG-CD1 3.86Å; R712-I716 HydrophobicContact CG-CG1 4.46Å; R712-I716 VanDerWaalsContact O-CG1 3.31Å; R712-I716 WeakPolarHBondContact O-CG1 3.49Å; R712-I716 PolarHBondContact O-N 3.08Å
713	R	92	Very high	92.2	Very high	173 Å²	173	87.2 Å²	87.2	65%	0.653	41%	0.409	S	S	*	.	H	α-helix	trans	-60.6	-44.4	178.4	-170.2	-174.2	-62.6	143.7	1.6	111.6	P709 N710 E711 Y715 I716 A717	P709-R713 PolarHBondContact O-N 3.05Å; N710-R713 PolarHBondContact O-N 2.83Å; E711-R713 PolarHBondContact O-N 3.41Å; R713-Y715 VanDerWaalsContact C-N 3.34Å; R713-I716 PolarHBondContact O-N 2.84Å; R713-A717 WeakPolarHBondContact O-CB 3.34Å; R713-A717 PolarHBondContact O-N 3.17Å
714	M	91.3	Very high	92.2	Very high	54 Å²	54	85 Å²	85	27%	0.266	41%	0.41	S	S	.	.	H	α-helix	trans	-64.3	-40.4	177.7	-67.9	-177.4	72.9	0	0	112.4	N710 E711 R712 A717 A718 I749 K756 C758	N710-M714 WeakPolarHBondContact O-CG 3.43Å; N710-M714 PolarHBondContact O-N 3.35Å; N710-M714 VanDerWaalsContact O-N 3.11Å; E711-M714 PolarHBondContact O-N 3.19Å; R712-M714 VanDerWaalsContact C-N 3.35Å; R712-M714 PolarHBondContact O-N 2.95Å; M714-A717 PolarHBondContact O-N 3.27Å; M714-A718 WeakPolarHBondContact O-CB 3.4Å; M714-A718 PolarHBondContact O-N 3.38Å; M714-I749 HydrophobicContact CE-CG2 4.05Å; M714-I749 HydrophobicContact SD-CD1 4.42Å; M714-I749 HydrophobicContact SD-CG2 4.1Å; M714-K756 HydrophobicContact CE-CB 3.75Å; M714-K756 WeakPolarHBondContact CE-O 3.02Å; M714-K756 HydrophobicContact SD-CB 4.25Å; M714-C758 HydrophobicContact CB-CB 3.95Å; M714-C758 HydrophobicContact CE-CB 4.09Å
715	Y	94.2	Very high	92.1	Very high	24 Å²	24	84 Å²	84	9%	0.094	40%	0.404	C	S	.	.	H	α-helix	trans	-66.6	-44.3	177.9	171.4	-98.7	0	0	0	112.1	L701 M705 E711 R712 R713 A717 A718 M719 H745 A747 V760	L701-Y715 HydrophobicContact CD2-CE1 4.32Å; L701-Y715 HydrophobicContact CD2-CE2 4.3Å; M705-Y715 HydrophobicContact CE-CD2 4.43Å; M705-Y715 HydrophobicContact CE-CG 4.09Å; E711-Y715 WeakPolarHBondContact O-CB 3.49Å; E711-Y715 PolarHBondContact O-N 3.26Å; R712-Y715 PolarHBondContact O-N 3.42Å; R713-Y715 VanDerWaalsContact C-N 3.34Å; Y715-A717 VanDerWaalsContact C-N 3.34Å; Y715-A717 PolarHBondContact O-N 3.46Å; Y715-A718 PolarHBondContact O-N 3.05Å; Y715-M719 HydrophobicContact CE1-CG 4.22Å; Y715-M719 HydrophobicContact CE2-CE 4Å; Y715-M719 HydrophobicContact CE2-CG 4.25Å; Y715-M719 PolarHBondContact O-N 3.1Å; Y715-M719 WeakPolarHBondContact OH-CE 3.43Å; Y715-H745 AromaticContact CZ-ND1 3.87Å; Y715-H745 PolarHBondContact OH-CE1 3.02Å; Y715-H745 PolarHBondContact OH-ND1 2.83Å; Y715-A747 HydrophobicContact CD2-CB 3.59Å; Y715-A747 HydrophobicContact CE2-CB 4.38Å; Y715-A747 HydrophobicContact CG-CB 4.22Å; Y715-V760 HydrophobicContact CD2-CG2 4.12Å; Y715-V760 HydrophobicContact CE2-CG1 4.27Å; Y715-V760 HydrophobicContact CE2-CG2 4.03Å
716	I	93.7	Very high	92	Very high	87 Å²	87	85.3 Å²	85.3	45%	0.446	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-45.4	174.2	-69.2	168.5	0	0	0	110.4	R712 R713 A718 M719 Q720	R712-I716 HydrophobicContact CG-CD1 3.86Å; R712-I716 HydrophobicContact CG-CG1 4.46Å; R712-I716 VanDerWaalsContact O-CG1 3.31Å; R712-I716 WeakPolarHBondContact O-CG1 3.49Å; R712-I716 PolarHBondContact O-N 3.08Å; R713-I716 PolarHBondContact O-N 2.84Å; I716-A718 VanDerWaalsContact C-N 3.3Å; I716-A718 PolarHBondContact O-N 3.02Å; I716-M719 PolarHBondContact O-N 3.2Å; I716-Q720 WeakPolarHBondContact O-CB 3.3Å; I716-Q720 PolarHBondContact O-N 2.96Å
717	A	93.6	Very high	92	Very high	59 Å²	59	80.5 Å²	80.5	49%	0.488	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-39.4	177.1	0	0	0	0	0	112.3	R713 M714 Y715 Q720 E721	R713-A717 WeakPolarHBondContact O-CB 3.34Å; R713-A717 PolarHBondContact O-N 3.17Å; M714-A717 PolarHBondContact O-N 3.27Å; Y715-A717 VanDerWaalsContact C-N 3.34Å; Y715-A717 PolarHBondContact O-N 3.46Å; A717-Q720 PolarHBondContact O-N 3.46Å; A717-E721 PolarHBondContact O-N 3.3Å
718	A	92.4	Very high	91.9	Very high	9 Å²	9	73.9 Å²	73.9	7%	0.074	37%	0.372	C	S	.	.	H	α-helix	trans	-67.2	-39.8	176.2	0	0	0	0	0	112.5	M714 Y715 I716 E721 Y722 C758 V760	M714-A718 WeakPolarHBondContact O-CB 3.4Å; M714-A718 PolarHBondContact O-N 3.38Å; Y715-A718 PolarHBondContact O-N 3.05Å; I716-A718 VanDerWaalsContact C-N 3.3Å; I716-A718 PolarHBondContact O-N 3.02Å; A718-E721 PolarHBondContact O-N 2.98Å; A718-Y722 WeakPolarHBondContact O-CD2 3.44Å; A718-Y722 PolarHBondContact O-N 3.33Å; A718-C758 HydrophobicContact CB-CB 4.35Å; A718-V760 HydrophobicContact CB-CG2 3.96Å
719	M	93.1	Very high	91.9	Very high	29 Å²	29	74.5 Å²	74.5	14%	0.143	38%	0.376	C	S	.	.	H	α-helix	trans	-66.5	-38.6	173.9	-76.5	-62.5	-158.7	0	0	112	Y715 I716 E721 Y722 I723 V760 F762 F824	Y715-M719 HydrophobicContact CE1-CG 4.22Å; Y715-M719 HydrophobicContact CE2-CE 4Å; Y715-M719 HydrophobicContact CE2-CG 4.25Å; Y715-M719 PolarHBondContact O-N 3.1Å; Y715-M719 WeakPolarHBondContact OH-CE 3.43Å; I716-M719 PolarHBondContact O-N 3.2Å; M719-E721 VanDerWaalsContact C-N 3.32Å; M719-E721 PolarHBondContact O-N 3.5Å; M719-Y722 WeakPolarHBondContact O-CB 3.38Å; M719-Y722 PolarHBondContact O-N 2.96Å; M719-I723 PolarHBondContact O-N 2.7Å; M719-V760 HydrophobicContact CE-CG1 3.6Å; M719-V760 HydrophobicContact CE-CG2 4.39Å; M719-V760 HydrophobicContact CG-CG2 4.32Å; M719-V760 HydrophobicContact SD-CG1 4.15Å; M719-V760 HydrophobicContact SD-CG2 4.12Å; M719-F762 HydrophobicContact CE-CZ 4.33Å; M719-F824 HydrophobicContact CE-CE2 4.35Å; M719-F824 HydrophobicContact SD-CE2 4.41Å
720	Q	94	Very high	91.8	Very high	89 Å²	89	78.7 Å²	78.7	42%	0.416	39%	0.388	S	S	.	.	H	α-helix	trans	-63	-39.7	175.4	-169.2	61.4	49.5	0	0	111.5	I716 A717 Y722 I723 D724	I716-Q720 WeakPolarHBondContact O-CB 3.3Å; I716-Q720 PolarHBondContact O-N 2.96Å; A717-Q720 PolarHBondContact O-N 3.46Å; Q720-Y722 PolarHBondContact O-N 3.33Å; Q720-I723 WeakPolarHBondContact O-CB 3.08Å; Q720-I723 PolarHBondContact O-N 3.19Å; Q720-I723 VanDerWaalsContact O-N 3.08Å; Q720-D724 PolarHBondContact NE2-OD1 2.94Å; Q720-D724 PolarHBondContact O-N 2.8Å
721	E	92.3	Very high	91.6	Very high	83 Å²	83	76.8 Å²	76.8	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-58	-35.3	175.2	-174.4	-178.2	175.6	0	0	112.3	A717 A718 M719 I723 K725 W727	A717-E721 PolarHBondContact O-N 3.3Å; A718-E721 PolarHBondContact O-N 2.98Å; M719-E721 VanDerWaalsContact C-N 3.32Å; M719-E721 PolarHBondContact O-N 3.5Å; E721-I723 VanDerWaalsContact C-N 3.34Å; E721-K725 HydrophobicContact CG-CD 4.01Å; E721-K725 HydrophobicContact CG-CG 4.38Å; E721-K725 VanDerWaalsContact O-CB 3.3Å; E721-K725 WeakPolarHBondContact O-CB 3.46Å; E721-K725 WeakPolarHBondContact O-CG 3.2Å; E721-K725 PolarHBondContact O-N 3.32Å; E721-K725 WeakPolarHBondContact OE1-CE 3.28Å; E721-K725 IonicContact OE1-NZ 3.62Å; E721-K725 PolarHBondContact OE1-NZ 2.85Å; E721-W727 HydrophobicContact CG-CZ3 4.38Å
722	Y	92.6	Very high	91	Very high	27 Å²	27	80.9 Å²	80.9	11%	0.106	40%	0.399	C	S	.	.	H	α-helix	trans	-67.3	-38.2	178	-78	-138.3	0	0	0	111.5	A718 M719 Q720 G726 W727 V728 F762 L810	A718-Y722 WeakPolarHBondContact O-CD2 3.44Å; A718-Y722 PolarHBondContact O-N 3.33Å; M719-Y722 WeakPolarHBondContact O-CB 3.38Å; M719-Y722 PolarHBondContact O-N 2.96Å; Q720-Y722 PolarHBondContact O-N 3.33Å; Y722-G726 PolarHBondContact O-N 3.4Å; Y722-W727 HydrophobicContact CD1-CE3 4.44Å; Y722-W727 AromaticContact CD2-CE3 3.74Å; Y722-W727 HydrophobicContact CD2-CE3 3.74Å; Y722-W727 AromaticContact CD2-CZ3 3.95Å; Y722-W727 HydrophobicContact CD2-CZ3 3.95Å; Y722-W727 HydrophobicContact CE2-CE3 4.15Å; Y722-W727 HydrophobicContact CE2-CZ3 4.1Å; Y722-W727 AromaticContact CG-CE3 3.92Å; Y722-W727 HydrophobicContact CG-CE3 3.92Å; Y722-W727 PolarHBondContact O-N 2.91Å; Y722-V728 HydrophobicContact CD1-CG1 4.01Å; Y722-F762 HydrophobicContact CD1-CE2 4.36Å; Y722-F762 HydrophobicContact CD1-CZ 4.37Å; Y722-F762 AromaticContact CE1-CE2 3.59Å; Y722-F762 HydrophobicContact CE1-CE2 3.59Å; Y722-F762 HydrophobicContact CE1-CZ 4.03Å; Y722-L810 HydrophobicContact CE1-CD1 4.42Å; Y722-L810 HydrophobicContact CE1-CD2 3.89Å; Y722-L810 HydrophobicContact CE2-CD1 4.19Å
723	I	92.4	Very high	89.4	Confident	99 Å²	99	80 Å²	80	51%	0.508	41%	0.41	S	S	.	.	H	α-helix	trans	-69.2	-50	176.1	-61	168.9	0	0	0	109.7	M719 Q720 E721 K725 G726 V728	M719-I723 PolarHBondContact O-N 2.7Å; Q720-I723 WeakPolarHBondContact O-CB 3.08Å; Q720-I723 PolarHBondContact O-N 3.19Å; Q720-I723 VanDerWaalsContact O-N 3.08Å; E721-I723 VanDerWaalsContact C-N 3.34Å; I723-K725 VanDerWaalsContact C-N 3.3Å; I723-K725 PolarHBondContact O-N 2.91Å; I723-G726 PolarHBondContact O-N 2.86Å; I723-V728 HydrophobicContact CG1-CG2 3.84Å
724	D	93.7	Very high	88	Confident	117 Å²	117	74.2 Å²	74.2	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-63.3	-35.7	-176.4	-64.4	-12.5	0	0	0	112.2	Q720 G726	Q720-D724 PolarHBondContact NE2-OD1 2.94Å; Q720-D724 PolarHBondContact O-N 2.8Å; D724-G726 VanDerWaalsContact C-N 3.28Å
725	K	89.7	Confident	86.5	Confident	83 Å²	83	78.3 Å²	78.3	36%	0.361	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-0.5	174.8	-70.1	-174	172.8	171.5	0	113.5	R674 E721 I723 W727	R674-K725 PolarHBondContact NH2-O 2.85Å; E721-K725 HydrophobicContact CG-CD 4.01Å; E721-K725 HydrophobicContact CG-CG 4.38Å; E721-K725 VanDerWaalsContact O-CB 3.3Å; E721-K725 WeakPolarHBondContact O-CB 3.46Å; E721-K725 WeakPolarHBondContact O-CG 3.2Å; E721-K725 PolarHBondContact O-N 3.32Å; E721-K725 WeakPolarHBondContact OE1-CE 3.28Å; E721-K725 IonicContact OE1-NZ 3.62Å; E721-K725 PolarHBondContact OE1-NZ 2.85Å; I723-K725 VanDerWaalsContact C-N 3.3Å; I723-K725 PolarHBondContact O-N 2.91Å; K725-W727 VanDerWaalsContact C-N 3.27Å; K725-W727 HydrophobicContact CB-CD2 3.78Å; K725-W727 HydrophobicContact CB-CE3 4.15Å; K725-W727 HydrophobicContact CB-CG 4.21Å; K725-W727 HydrophobicContact CB-CZ2 4.19Å; K725-W727 HydrophobicContact CB-CZ3 4.49Å; K725-W727 HydrophobicContact CD-CD2 4.29Å; K725-W727 HydrophobicContact CD-CE3 4.23Å; K725-W727 HydrophobicContact CD-CH2 3.27Å; K725-W727 HydrophobicContact CD-CZ2 3.32Å; K725-W727 HydrophobicContact CD-CZ3 3.73Å; K725-W727 HydrophobicContact CG-CH2 4.49Å; K725-W727 HydrophobicContact CG-CZ2 4.38Å; K725-W727 PolarHBondContact O-N 3.01Å
726	G	89.1	Confident	85.3	Confident	42 Å²	42	82.3 Å²	82.3	43%	0.433	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	32.6	-179.7	0	0	0	0	0	113.4	R674 Y722 I723 D724 V728	R674-G726 PolarHBondContact NH1-O 3Å; Y722-G726 PolarHBondContact O-N 3.4Å; I723-G726 PolarHBondContact O-N 2.86Å; D724-G726 VanDerWaalsContact C-N 3.28Å; G726-V728 VanDerWaalsContact C-N 3.32Å
727	W	90.4	Very high	84.2	Confident	39 Å²	39	87.5 Å²	87.5	15%	0.148	47%	0.466	C	S	.	.	S	Bend	trans	-81.5	-16.4	174.4	-65.5	-34.8	0	0	0	112.6	E721 Y722 K725 A807 L810	E721-W727 HydrophobicContact CG-CZ3 4.38Å; Y722-W727 HydrophobicContact CD1-CE3 4.44Å; Y722-W727 AromaticContact CD2-CE3 3.74Å; Y722-W727 HydrophobicContact CD2-CE3 3.74Å; Y722-W727 AromaticContact CD2-CZ3 3.95Å; Y722-W727 HydrophobicContact CD2-CZ3 3.95Å; Y722-W727 HydrophobicContact CE2-CE3 4.15Å; Y722-W727 HydrophobicContact CE2-CZ3 4.1Å; Y722-W727 AromaticContact CG-CE3 3.92Å; Y722-W727 HydrophobicContact CG-CE3 3.92Å; Y722-W727 PolarHBondContact O-N 2.91Å; K725-W727 VanDerWaalsContact C-N 3.27Å; K725-W727 HydrophobicContact CB-CD2 3.78Å; K725-W727 HydrophobicContact CB-CE3 4.15Å; K725-W727 HydrophobicContact CB-CG 4.21Å; K725-W727 HydrophobicContact CB-CZ2 4.19Å; K725-W727 HydrophobicContact CB-CZ3 4.49Å; K725-W727 HydrophobicContact CD-CD2 4.29Å; K725-W727 HydrophobicContact CD-CE3 4.23Å; K725-W727 HydrophobicContact CD-CH2 3.27Å; K725-W727 HydrophobicContact CD-CZ2 3.32Å; K725-W727 HydrophobicContact CD-CZ3 3.73Å; K725-W727 HydrophobicContact CG-CH2 4.49Å; K725-W727 HydrophobicContact CG-CZ2 4.38Å; K725-W727 PolarHBondContact O-N 3.01Å; W727-A807 HydrophobicContact CH2-CB 3.84Å; W727-A807 HydrophobicContact CZ2-CB 3.84Å; W727-L810 HydrophobicContact CD2-CB 3.68Å; W727-L810 HydrophobicContact CD2-CD1 4.1Å; W727-L810 HydrophobicContact CD2-CG 4.29Å; W727-L810 HydrophobicContact CE3-CB 4.07Å; W727-L810 HydrophobicContact CE3-CD1 3.55Å; W727-L810 HydrophobicContact CE3-CD2 4.4Å; W727-L810 HydrophobicContact CE3-CG 4.19Å; W727-L810 HydrophobicContact CG-CB 4.05Å; W727-L810 HydrophobicContact CH2-CB 4.2Å; W727-L810 HydrophobicContact CH2-CD1 3.63Å; W727-L810 HydrophobicContact CZ2-CB 3.81Å; W727-L810 HydrophobicContact CZ2-CD1 4.16Å; W727-L810 HydrophobicContact CZ3-CB 4.34Å; W727-L810 HydrophobicContact CZ3-CD1 3.32Å; W727-L810 HydrophobicContact CZ3-CG 4.35Å; W727-L810 PolarHBondContact NE1-O 2.91Å
728	V	91.7	Very high	83.5	Confident	40 Å²	40	85.7 Å²	85.7	24%	0.242	45%	0.453	C	S	.	.	S	Bend	trans	-132.5	148.8	-179	-59.1	0	0	0	0	109.1	Y722 I723 G726 F824	Y722-V728 HydrophobicContact CD1-CG1 4.01Å; I723-V728 HydrophobicContact CG1-CG2 3.84Å; G726-V728 VanDerWaalsContact C-N 3.32Å; V728-F824 HydrophobicContact CB-CE1 4.16Å; V728-F824 HydrophobicContact CB-CZ 3.99Å; V728-F824 HydrophobicContact CG1-CE1 3.64Å; V728-F824 HydrophobicContact CG1-CZ 3.66Å; V728-F824 HydrophobicContact CG2-CZ 4.36Å
729	E	90	Very high	83.1	Confident	111 Å²	111	89.8 Å²	89.8	52%	0.519	47%	0.469	S	S	.	.			trans	-123.1	151.6	177.4	66.2	-172.3	169.1	0	0	110.2	V731 R819	E729-V731 PolarHBondContact O-N 3.07Å; E729-R819 VanDerWaalsContact CD-NH1 3.32Å; E729-R819 WeakPolarHBondContact OE1-CD 3.41Å; E729-R819 IonicContact OE1-CZ 3.82Å; E729-R819 IonicContact OE1-NE 3.67Å; E729-R819 IonicContact OE1-NH1 3.93Å; E729-R819 PolarHBondContact OE1-NH1 3.33Å; E729-R819 IonicContact OE2-NH1 2.65Å; E729-R819 PolarHBondContact OE2-NH1 2.98Å
730	E	89.8	Confident	82.9	Confident	177 Å²	177	89.6 Å²	89.6	83%	0.827	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-71.5	123.6	173.6	-170.8	173.7	-178.8	0	0	109.2
731	V	84.2	Confident	82.8	Confident	69 Å²	69	85.3 Å²	85.3	42%	0.418	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-89.1	125.2	-174.9	-179.7	0	0	0	0	109.7	E729	E729-V731 PolarHBondContact O-N 3.07Å
732	H	77.2	Confident	82.9	Confident	156 Å²	156	83.5 Å²	83.5	72%	0.722	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-81.6	137	163.9	-63.8	-55.1	0	0	0	109.3	S734	H732-S734 PolarHBondContact O-N 2.91Å
733	P	61	Low	83.1	Confident	112 Å²	112	83 Å²	83	73%	0.727	44%	0.438	S	S	*	.			trans	-60.1	97.8	-175.5	21.2	-30.6	0	0	0	111.5
734	S	62	Low	83.3	Confident	53 Å²	53	78.4 Å²	78.4	37%	0.371	42%	0.415	S	S	.	.			trans	-73.9	122.6	171.9	179.2	0	0	0	0	108.6	H732 E736 D820	H732-S734 PolarHBondContact O-N 2.91Å; S734-E736 VanDerWaalsContact C-N 3.3Å; S734-E736 PolarHBondContact O-N 2.77Å; S734-D820 WeakPolarHBondContact CB-OD2 3.41Å; S734-D820 PolarHBondContact OG-OD2 2.69Å
735	V	59.2	Low	83.3	Confident	139 Å²	139	73.3 Å²	73.3	84%	0.842	39%	0.387	S	S	*	.			trans	-85.2	-1.9	-164.2	-161.5	0	0	0	0	112.6	E737	V735-E737 PolarHBondContact O-N 2.68Å; V735-E737 VanDerWaalsContact O-N 3.1Å
736	E	68.5	Low	83.6	Confident	108 Å²	108	72.7 Å²	72.7	51%	0.505	39%	0.385	S	S	.	.			trans	-78.6	102.3	-175.9	-71.2	-168.5	-171.8	0	0	111.9	S734 G738 K739	S734-E736 VanDerWaalsContact C-N 3.3Å; S734-E736 PolarHBondContact O-N 2.77Å; E736-G738 PolarHBondContact O-N 2.72Å; E736-K739 HydrophobicContact CB-CB 4.45Å; E736-K739 HydrophobicContact CB-CD 4.21Å; E736-K739 HydrophobicContact CB-CG 4.48Å; E736-K739 PolarHBondContact O-N 3.06Å; E736-K739 VanDerWaalsContact OE2-CD 3.25Å; E736-K739 WeakPolarHBondContact OE2-CD 2.95Å; E736-K739 WeakPolarHBondContact OE2-CE 3.38Å; E736-K739 IonicContact OE2-NZ 2.74Å; E736-K739 PolarHBondContact OE2-NZ 3.5Å
737	E	72.2	Confident	83.7	Confident	196 Å²	196	71.7 Å²	71.7	92%	0.916	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	137.2	170	-76.3	-172.9	164.8	0	0	111.5	V735	V735-E737 PolarHBondContact O-N 2.68Å; V735-E737 VanDerWaalsContact O-N 3.1Å
738	G	78	Confident	83.8	Confident	21 Å²	21	71.8 Å²	71.8	22%	0.216	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	-11.5	179.7	0	0	0	0	0	115.2	L687 E736	L687-G738 PolarHBondContact N-O 3.27Å; L687-G738 VanDerWaalsContact N-O 3.15Å; L687-G738 WeakPolarHBondContact O-CA 3.28Å; E736-G738 PolarHBondContact O-N 2.72Å
739	K	83.9	Confident	83.6	Confident	96 Å²	96	72.1 Å²	72.1	42%	0.417	38%	0.378	S	S	.	.	S	Bend	trans	-109.5	-2	-178	-67.9	-167.3	-178.9	172	0	115.8	E736 D820 F821	E736-K739 HydrophobicContact CB-CB 4.45Å; E736-K739 HydrophobicContact CB-CD 4.21Å; E736-K739 HydrophobicContact CB-CG 4.48Å; E736-K739 PolarHBondContact O-N 3.06Å; E736-K739 VanDerWaalsContact OE2-CD 3.25Å; E736-K739 WeakPolarHBondContact OE2-CD 2.95Å; E736-K739 WeakPolarHBondContact OE2-CE 3.38Å; E736-K739 IonicContact OE2-NZ 2.74Å; E736-K739 PolarHBondContact OE2-NZ 3.5Å; K739-D820 CarbonylContact O-C 3.59Å; K739-D820 WeakPolarHBondContact O-CB 3.42Å; K739-F821 HydrophobicContact CB-CE1 4.45Å; K739-F821 HydrophobicContact CB-CZ 3.98Å; K739-F821 HydrophobicContact CG-CZ 4.1Å
740	V	89	Confident	83.4	Confident	24 Å²	24	76.1 Å²	76.1	15%	0.145	39%	0.388	C	S	.	.			trans	-114	134.9	-178.5	-175	0	0	0	0	110.3	Y742 D820	V740-Y742 HydrophobicContact CG1-CD2 4.24Å; V740-Y742 HydrophobicContact CG1-CE2 3.53Å; V740-D820 WeakPolarHBondContact CA-O 3.36Å; V740-D820 HydrophobicContact CG2-CB 4.33Å
741	W	92.6	Very high	82.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	37%	0.374	C	S	.	.			trans	-143.3	130	174.4	-173.3	-98.7	0	0	0	111.8	L687 P688 N690 L771 D820 F821 C823	L687-W741 HydrophobicContact CB-CD2 4.48Å; L687-W741 HydrophobicContact CB-CE3 3.66Å; L687-W741 HydrophobicContact CB-CZ3 4.06Å; L687-W741 HydrophobicContact CD1-CB 3.68Å; L687-W741 HydrophobicContact CD1-CD2 3.85Å; L687-W741 HydrophobicContact CD1-CE3 3.86Å; L687-W741 HydrophobicContact CD1-CG 3.83Å; L687-W741 HydrophobicContact CD2-CD2 4.29Å; L687-W741 HydrophobicContact CD2-CE3 3.84Å; L687-W741 HydrophobicContact CD2-CH2 4.2Å; L687-W741 HydrophobicContact CD2-CZ3 3.77Å; L687-W741 HydrophobicContact CG-CD2 4.44Å; L687-W741 HydrophobicContact CG-CE3 3.99Å; L687-W741 HydrophobicContact CG-CZ3 4.36Å; P688-W741 HydrophobicContact CG-CZ3 4.09Å; P688-W741 WeakPolarHBondContact O-CZ3 3.23Å; N690-W741 HydrophobicContact CB-CD2 4.33Å; N690-W741 HydrophobicContact CB-CE3 3.81Å; N690-W741 HydrophobicContact CB-CH2 3.92Å; N690-W741 HydrophobicContact CB-CZ2 4.34Å; N690-W741 HydrophobicContact CB-CZ3 3.61Å; N690-W741 VanDerWaalsContact CG-CE3 3.46Å; N690-W741 VanDerWaalsContact ND2-CD2 3.28Å; N690-W741 WeakPolarHBondContact ND2-CZ2 3.33Å; W741-L771 WeakPolarHBondContact CH2-O 3.4Å; W741-D820 PolarHBondContact N-O 3.29Å; W741-F821 WeakPolarHBondContact CB-O 3.28Å; W741-C823 WeakPolarHBondContact O-CB 3.39Å; W741-C823 PolarHBondContact O-N 3.35Å; W741-C823 VanDerWaalsContact O-N 3.1Å
742	Y	94.1	Very high	82.3	Confident	45 Å²	45	70.6 Å²	70.6	18%	0.176	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-99.7	111.2	-178.8	-63.2	-90	0	0	0	110.6	N690 Y691 A694 V740 P744 C823 L825	N690-Y742 PolarHBondContact ND2-O 2.83Å; N690-Y742 PolarHBondContact OD1-N 3.1Å; Y691-Y742 HydrophobicContact CD2-CD1 4.36Å; Y691-Y742 HydrophobicContact CD2-CD2 4.16Å; Y691-Y742 HydrophobicContact CD2-CE1 4.03Å; Y691-Y742 AromaticContact CD2-CE2 3.84Å; Y691-Y742 HydrophobicContact CD2-CE2 3.84Å; Y691-Y742 HydrophobicContact CD2-CG 4.42Å; Y691-Y742 AromaticContact CD2-CZ 3.76Å; Y691-Y742 HydrophobicContact CG-CE2 4.34Å; A694-Y742 HydrophobicContact CB-CG 4.5Å; V740-Y742 HydrophobicContact CG1-CD2 4.24Å; V740-Y742 HydrophobicContact CG1-CE2 3.53Å; Y742-P744 VanDerWaalsContact O-CD 3.28Å; Y742-P744 WeakPolarHBondContact O-CD 3.19Å; Y742-C823 CarbonylContact C-O 3.6Å; Y742-C823 VanDerWaalsContact CA-O 3.28Å; Y742-C823 WeakPolarHBondContact CA-O 3.48Å; Y742-C823 HydrophobicContact CD1-CB 3.83Å; Y742-C823 HydrophobicContact CE1-CB 3.99Å; Y742-C823 HydrophobicContact CG-CB 4.43Å; Y742-L825 HydrophobicContact CD1-CD2 3.53Å; Y742-L825 HydrophobicContact CD1-CG 3.9Å; Y742-L825 HydrophobicContact CE1-CD2 3.64Å; Y742-L825 HydrophobicContact CE1-CG 4.49Å; Y742-L825 HydrophobicContact CG-CD2 4.44Å
743	L	95.5	Very high	81.7	Confident	15 Å²	15	69.6 Å²	69.6	8%	0.079	38%	0.377	C	S	.	.			trans	-73.4	116.8	175.7	-66.7	177.3	0	0	0	110.5	F762 L773 V822 C823	L743-F762 HydrophobicContact CB-CB 4.27Å; L743-F762 HydrophobicContact CB-CD1 4.37Å; L743-F762 HydrophobicContact CD1-CB 4.06Å; L743-L773 HydrophobicContact CD2-CD2 3.97Å; L743-V822 HydrophobicContact CD1-CB 3.83Å; L743-V822 HydrophobicContact CD1-CG1 4.07Å; L743-C823 PolarHBondContact N-O 2.9Å
744	P	96.6	Very high	81.9	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.019	38%	0.381	C	S	.	.			trans	-61.9	142.6	167.5	-18.3	32.5	0	0	0	109.6	Y693 R697 Y742 D763 A766	Y693-P744 HydrophobicContact CD1-CG 4.17Å; Y693-P744 HydrophobicContact CE1-CG 3.76Å; R697-P744 HydrophobicContact CB-CB 3.94Å; R697-P744 HydrophobicContact CG-CB 3.93Å; R697-P744 HydrophobicContact CG-CG 4.23Å; Y742-P744 VanDerWaalsContact O-CD 3.28Å; Y742-P744 WeakPolarHBondContact O-CD 3.19Å; P744-D763 HydrophobicContact CB-CB 4.45Å; P744-D763 VanDerWaalsContact O-CB 3.26Å; P744-D763 WeakPolarHBondContact O-CB 3.47Å; P744-D763 PolarHBondContact O-N 3.09Å; P744-A766 HydrophobicContact CG-CB 3.71Å
745	H	95.4	Very high	82.3	Confident	11 Å²	11	73.7 Å²	73.7	5%	0.051	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	162.4	178.5	54.9	75.9	0	0	0	112.1	Y715 V760 V761 F762 L825	Y715-H745 AromaticContact CZ-ND1 3.87Å; Y715-H745 PolarHBondContact OH-CE1 3.02Å; Y715-H745 PolarHBondContact OH-ND1 2.83Å; H745-V760 HydrophobicContact CB-CG1 4.1Å; H745-V761 WeakPolarHBondContact CA-O 3.49Å; H745-F762 HydrophobicContact CB-CD1 3.88Å; H745-F762 HydrophobicContact CB-CE1 4.05Å; H745-F762 HydrophobicContact CB-CG 4.47Å; H745-L825 PolarHBondContact NE2-O 3.15Å
746	H	94.1	Very high	83.3	Confident	69 Å²	69	71.6 Å²	71.6	32%	0.319	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	160.8	174.3	64.1	-74.5	0	0	0	111.1	L701 V761	L701-H746 HydrophobicContact CD1-CB 4.36Å; H746-V761 PolarHBondContact N-O 3.03Å; H746-V761 VanDerWaalsContact N-O 3.07Å; H746-V761 PolarHBondContact O-N 3.46Å
747	A	91.9	Very high	84.1	Confident	22 Å²	22	73.5 Å²	73.5	18%	0.182	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.2	176.7	0	0	0	0	0	111.5	M705 Y715	M705-A747 HydrophobicContact CE-CB 3.53Å; Y715-A747 HydrophobicContact CD2-CB 3.59Å; Y715-A747 HydrophobicContact CE2-CB 4.38Å; Y715-A747 HydrophobicContact CG-CB 4.22Å
748	V	91.8	Very high	84.9	Confident	41 Å²	41	65.3 Å²	65.3	25%	0.248	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	109.4	165.2	177.1	0	0	0	0	108.3	R750 R759 V761	V748-R750 HydrophobicContact CG1-CG 4.06Å; V748-R759 PolarHBondContact N-O 3.42Å; V748-R759 PolarHBondContact O-N 3.36Å; V748-V761 HydrophobicContact CB-CG2 4.18Å; V748-V761 HydrophobicContact CG2-CB 4.44Å; V748-V761 HydrophobicContact CG2-CG2 3.58Å
749	I	88.5	Confident	85.5	Confident	46 Å²	46	72.9 Å²	72.9	24%	0.236	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.9	-179.1	-59.3	169	0	0	0	108.4	E711 M714 K756 K757 C758	E711-I749 HydrophobicContact CB-CD1 3.47Å; E711-I749 VanDerWaalsContact CB-CD1 3.47Å; E711-I749 HydrophobicContact CG-CD1 3.49Å; E711-I749 VanDerWaalsContact CG-CD1 3.49Å; M714-I749 HydrophobicContact CE-CG2 4.05Å; M714-I749 HydrophobicContact SD-CD1 4.42Å; M714-I749 HydrophobicContact SD-CG2 4.1Å; I749-K756 HydrophobicContact CG2-CB 4.15Å; I749-K756 HydrophobicContact CG2-CD 4.41Å; I749-K756 HydrophobicContact CG2-CG 4.44Å; I749-K757 WeakPolarHBondContact CA-O 3.49Å; I749-C758 HydrophobicContact CG1-CB 4.09Å
750	R	85.5	Confident	85.9	Confident	196 Å²	196	68.8 Å²	68.8	74%	0.74	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	143	179.6	-68.8	-177.1	-179.5	177.5	1.5	110.4	V748 K757	V748-R750 HydrophobicContact CG1-CG 4.06Å; R750-K757 PolarHBondContact N-O 3.45Å; R750-K757 PolarHBondContact O-N 3.25Å
751	G	80.3	Confident	86.1	Confident	51 Å²	51	70.2 Å²	70.2	53%	0.526	36%	0.359	S	S	.	.	S	Bend	trans	136.4	167.9	176.1	0	0	0	0	0	112.7
752	T	70.9	Confident	86.2	Confident	79 Å²	79	73 Å²	73	49%	0.485	37%	0.371	S	S	.	.			trans	-79.1	161.6	168.1	46	0	0	0	0	110	S754 M755 K756	T752-S754 PolarHBondContact O-N 3.02Å; T752-M755 CarbonylContact O-C 3.58Å; T752-M755 VanDerWaalsContact O-C 3.31Å; T752-M755 WeakPolarHBondContact O-CA 3.44Å; T752-M755 PolarHBondContact O-N 2.94Å; T752-K756 WeakPolarHBondContact O-CG 3.17Å; T752-K756 PolarHBondContact O-N 3.02Å
753	D	64.8	Low	86.2	Confident	134 Å²	134	72.7 Å²	72.7	72%	0.717	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-51.9	-35.6	-166	-71.6	-38.4	0	0	0	115.5	K756	D753-K756 WeakPolarHBondContact OD1-CE 3.36Å; D753-K756 IonicContact OD1-NZ 3.6Å; D753-K756 PolarHBondContact OD1-NZ 3.23Å
754	S	66	Low	85.9	Confident	116 Å²	116	72.5 Å²	72.5	81%	0.811	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-81.4	-13.1	176.7	53.6	0	0	0	0	114.9	T752	T752-S754 PolarHBondContact O-N 3.02Å
755	M	70	Confident	85.8	Confident	135 Å²	135	76 Å²	76	67%	0.665	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-133.8	28.7	-175	-71	-131.6	-178.8	0	0	113.2	T752 K757	T752-M755 CarbonylContact O-C 3.58Å; T752-M755 VanDerWaalsContact O-C 3.31Å; T752-M755 WeakPolarHBondContact O-CA 3.44Å; T752-M755 PolarHBondContact O-N 2.94Å; M755-K757 PolarHBondContact O-N 2.8Å
756	K	79.4	Confident	85.6	Confident	96 Å²	96	75.8 Å²	75.8	42%	0.417	40%	0.399	S	S	.	.			trans	-61.9	121.6	171.3	-74.1	179.4	-178.1	161.9	0	108.8	M714 I749 T752 D753	M714-K756 HydrophobicContact CE-CB 3.75Å; M714-K756 WeakPolarHBondContact CE-O 3.02Å; M714-K756 HydrophobicContact SD-CB 4.25Å; I749-K756 HydrophobicContact CG2-CB 4.15Å; I749-K756 HydrophobicContact CG2-CD 4.41Å; I749-K756 HydrophobicContact CG2-CG 4.44Å; T752-K756 WeakPolarHBondContact O-CG 3.17Å; T752-K756 PolarHBondContact O-N 3.02Å; D753-K756 WeakPolarHBondContact OD1-CE 3.36Å; D753-K756 IonicContact OD1-NZ 3.6Å; D753-K756 PolarHBondContact OD1-NZ 3.23Å
757	K	84.9	Confident	85.6	Confident	147 Å²	147	75.4 Å²	75.4	64%	0.639	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	134.5	171.8	-67.6	-172.2	177.7	-172	0	109	I749 R750 M755	I749-K757 WeakPolarHBondContact CA-O 3.49Å; R750-K757 PolarHBondContact N-O 3.45Å; R750-K757 PolarHBondContact O-N 3.25Å; M755-K757 PolarHBondContact O-N 2.8Å
758	C	90.1	Very high	85.6	Confident	24 Å²	24	77 Å²	77	16%	0.162	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.8	172.1	-178.7	0	0	0	0	109.1	M714 A718 I749	M714-C758 HydrophobicContact CB-CB 3.95Å; M714-C758 HydrophobicContact CE-CB 4.09Å; A718-C758 HydrophobicContact CB-CB 4.35Å; I749-C758 HydrophobicContact CG1-CB 4.09Å
759	R	90	Very high	85.6	Confident	180 Å²	180	81.8 Å²	81.8	68%	0.679	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.7	168.2	-67.1	-177.5	179.9	-177.6	-2.5	108.5	V748	V748-R759 PolarHBondContact N-O 3.42Å; V748-R759 PolarHBondContact O-N 3.36Å
760	V	92.9	Very high	85.5	Confident	10 Å²	10	82.5 Å²	82.5	6%	0.061	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	125.4	173	-176.5	0	0	0	0	108	Y715 A718 M719 H745 F762	Y715-V760 HydrophobicContact CD2-CG2 4.12Å; Y715-V760 HydrophobicContact CE2-CG1 4.27Å; Y715-V760 HydrophobicContact CE2-CG2 4.03Å; A718-V760 HydrophobicContact CB-CG2 3.96Å; M719-V760 HydrophobicContact CE-CG1 3.6Å; M719-V760 HydrophobicContact CE-CG2 4.39Å; M719-V760 HydrophobicContact CG-CG2 4.32Å; M719-V760 HydrophobicContact SD-CG1 4.15Å; M719-V760 HydrophobicContact SD-CG2 4.12Å; H745-V760 HydrophobicContact CB-CG1 4.1Å; V760-F762 HydrophobicContact CB-CE2 4.11Å; V760-F762 HydrophobicContact CB-CZ 4.47Å; V760-F762 HydrophobicContact CG1-CD2 4.28Å; V760-F762 HydrophobicContact CG1-CE1 4.32Å; V760-F762 HydrophobicContact CG1-CE2 3.61Å; V760-F762 HydrophobicContact CG1-CZ 3.66Å
761	V	93.3	Very high	85.7	Confident	55 Å²	55	76 Å²	76	33%	0.333	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119	178.4	178.9	0	0	0	0	108.7	H745 H746 V748	H745-V761 WeakPolarHBondContact CA-O 3.49Å; H746-V761 PolarHBondContact N-O 3.03Å; H746-V761 VanDerWaalsContact N-O 3.07Å; H746-V761 PolarHBondContact O-N 3.46Å; V748-V761 HydrophobicContact CB-CG2 4.18Å; V748-V761 HydrophobicContact CG2-CB 4.44Å; V748-V761 HydrophobicContact CG2-CG2 3.58Å
762	F	94.2	Very high	86.3	Confident	57 Å²	57	73.9 Å²	73.9	25%	0.25	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	120.4	172.8	-60.7	-90.8	0	0	0	108.9	M719 Y722 L743 H745 V760 G764 F824	M719-F762 HydrophobicContact CE-CZ 4.33Å; Y722-F762 HydrophobicContact CD1-CE2 4.36Å; Y722-F762 HydrophobicContact CD1-CZ 4.37Å; Y722-F762 AromaticContact CE1-CE2 3.59Å; Y722-F762 HydrophobicContact CE1-CE2 3.59Å; Y722-F762 HydrophobicContact CE1-CZ 4.03Å; L743-F762 HydrophobicContact CB-CB 4.27Å; L743-F762 HydrophobicContact CB-CD1 4.37Å; L743-F762 HydrophobicContact CD1-CB 4.06Å; H745-F762 HydrophobicContact CB-CD1 3.88Å; H745-F762 HydrophobicContact CB-CE1 4.05Å; H745-F762 HydrophobicContact CB-CG 4.47Å; V760-F762 HydrophobicContact CB-CE2 4.11Å; V760-F762 HydrophobicContact CB-CZ 4.47Å; V760-F762 HydrophobicContact CG1-CD2 4.28Å; V760-F762 HydrophobicContact CG1-CE1 4.32Å; V760-F762 HydrophobicContact CG1-CE2 3.61Å; V760-F762 HydrophobicContact CG1-CZ 3.66Å; F762-G764 PolarHBondContact O-N 3.35Å; F762-G764 VanDerWaalsContact O-N 3.13Å; F762-F824 HydrophobicContact CD1-CB 4.25Å; F762-F824 HydrophobicContact CD1-CD1 4.23Å; F762-F824 HydrophobicContact CD1-CG 4.25Å; F762-F824 HydrophobicContact CE1-CB 4.02Å; F762-F824 AromaticContact CE1-CD1 3.56Å; F762-F824 HydrophobicContact CE1-CD1 3.56Å; F762-F824 AromaticContact CE1-CD2 3.98Å; F762-F824 HydrophobicContact CE1-CD2 3.98Å; F762-F824 AromaticContact CE1-CE1 3.98Å; F762-F824 HydrophobicContact CE1-CE1 3.98Å; F762-F824 HydrophobicContact CE1-CE2 4.35Å; F762-F824 AromaticContact CE1-CG 3.58Å; F762-F824 HydrophobicContact CE1-CG 3.58Å; F762-F824 HydrophobicContact CE1-CZ 4.36Å; F762-F824 HydrophobicContact CZ-CD1 4.34Å; F762-F824 HydrophobicContact CZ-CE1 4.31Å; F762-F824 HydrophobicContact CZ-CZ 4.5Å
763	D	93.6	Very high	87.3	Confident	39 Å²	39	70.4 Å²	70.4	21%	0.209	38%	0.38	C	S	.	.			trans	-87.5	79	-169.1	-170.9	4	0	0	0	110.8	R697 P744 S765 A766	R697-D763 IonicContact CZ-OD2 3.1Å; R697-D763 IonicContact NH1-OD2 2.68Å; R697-D763 PolarHBondContact NH1-OD2 3.4Å; R697-D763 IonicContact NH2-OD2 2.69Å; R697-D763 PolarHBondContact NH2-OD2 2.84Å; P744-D763 HydrophobicContact CB-CB 4.45Å; P744-D763 VanDerWaalsContact O-CB 3.26Å; P744-D763 WeakPolarHBondContact O-CB 3.47Å; P744-D763 PolarHBondContact O-N 3.09Å; D763-S765 PolarHBondContact O-N 2.82Å; D763-A766 HydrophobicContact CB-CB 4.22Å; D763-A766 VanDerWaalsContact O-CB 3.29Å; D763-A766 WeakPolarHBondContact O-CB 3.47Å; D763-A766 PolarHBondContact O-N 3.18Å; D763-A766 VanDerWaalsContact O-N 3.14Å; D763-A766 PolarHBondContact OD1-N 3.42Å
764	G	90.2	Very high	88.5	Confident	11 Å²	11	67.5 Å²	67.5	11%	0.113	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.4	177.1	0	0	0	0	0	114.8	F762 L773 N774	F762-G764 PolarHBondContact O-N 3.35Å; F762-G764 VanDerWaalsContact O-N 3.13Å; G764-L773 PolarHBondContact O-N 2.67Å; G764-N774 VanDerWaalsContact C-ND2 3.31Å; G764-N774 PolarHBondContact O-N 3.03Å
765	S	93	Very high	89.7	Confident	78 Å²	78	65.9 Å²	65.9	55%	0.545	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.7	176.8	-60	0	0	0	0	112.8	D763 S767 N774	D763-S765 PolarHBondContact O-N 2.82Å; S765-S767 PolarHBondContact O-N 2.8Å; S765-S767 VanDerWaalsContact O-N 3.07Å; S765-N774 PolarHBondContact N-ND2 3.39Å; S765-N774 PolarHBondContact OG-ND2 3.47Å
766	A	92.7	Very high	90.6	Very high	6 Å²	6	60.5 Å²	60.5	5%	0.05	32%	0.32	C	S	.	.			trans	-64.4	113.9	178.4	0	0	0	0	0	110.1	Y693 P744 D763	Y693-A766 HydrophobicContact CE1-CB 4.05Å; P744-A766 HydrophobicContact CG-CB 3.71Å; D763-A766 HydrophobicContact CB-CB 4.22Å; D763-A766 VanDerWaalsContact O-CB 3.29Å; D763-A766 WeakPolarHBondContact O-CB 3.47Å; D763-A766 PolarHBondContact O-N 3.18Å; D763-A766 VanDerWaalsContact O-N 3.14Å; D763-A766 PolarHBondContact OD1-N 3.42Å
767	S	92.6	Very high	91.1	Very high	60 Å²	60	57 Å²	57	42%	0.42	31%	0.305	S	S	.	.			trans	-85.2	134.4	-179.8	-175.1	0	0	0	0	111.2	S765 L771	S765-S767 PolarHBondContact O-N 2.8Å; S765-S767 VanDerWaalsContact O-N 3.07Å; S767-L771 CarbonylContact C-O 3.45Å; S767-L771 WeakPolarHBondContact CA-O 3.11Å; S767-L771 PolarHBondContact OG-N 3.02Å
768	Y	92.9	Very high	91.1	Very high	55 Å²	55	51.6 Å²	51.6	22%	0.216	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-132.6	128.1	168.9	178.9	-105.2	0	0	0	108.8	P688 N689 N690 Y693 G770 L771	P688-Y768 HydrophobicContact CB-CD1 4.29Å; P688-Y768 HydrophobicContact CB-CE1 4.27Å; P688-Y768 HydrophobicContact CG-CD1 4.04Å; P688-Y768 HydrophobicContact CG-CE1 4.5Å; N689-Y768 WeakPolarHBondContact O-CE1 3.5Å; N690-Y768 HydrophobicContact CB-CD1 3.53Å; N690-Y768 HydrophobicContact CB-CE1 4.23Å; N690-Y768 HydrophobicContact CB-CG 3.73Å; Y693-Y768 HydrophobicContact CG-CD2 4.04Å; Y768-G770 PolarHBondContact O-N 2.99Å; Y768-L771 PolarHBondContact N-O 3.35Å; Y768-L771 PolarHBondContact O-N 2.85Å; Y768-L771 VanDerWaalsContact O-N 3.17Å; Y768-L771 VanDerWaalsContact O-O 3.12Å
769	Q	91	Very high	90.4	Very high	142 Å²	142	56.4 Å²	56.4	66%	0.664	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	37	-173.5	-61.4	-177.9	-6.6	0	0	113.5	P688 L771	P688-Q769 HydrophobicContact CG-CB 4.19Å; Q769-L771 VanDerWaalsContact C-N 3.3Å; Q769-L771 PolarHBondContact O-N 3.08Å
770	G	87.9	Confident	89.6	Confident	61 Å²	61	50.1 Å²	50.1	63%	0.629	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	4.9	176.6	0	0	0	0	0	115.2	Y768	Y768-G770 PolarHBondContact O-N 2.99Å
771	L	89.7	Confident	88.4	Confident	61 Å²	61	52.3 Å²	52.3	32%	0.319	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-122.3	140.9	176.7	-69	170	0	0	0	110.7	L687 W741 S767 Y768 Q769	L687-L771 HydrophobicContact CD2-CB 4.49Å; W741-L771 WeakPolarHBondContact CH2-O 3.4Å; S767-L771 CarbonylContact C-O 3.45Å; S767-L771 WeakPolarHBondContact CA-O 3.11Å; S767-L771 PolarHBondContact OG-N 3.02Å; Y768-L771 PolarHBondContact N-O 3.35Å; Y768-L771 PolarHBondContact O-N 2.85Å; Y768-L771 VanDerWaalsContact O-N 3.17Å; Y768-L771 VanDerWaalsContact O-O 3.12Å; Q769-L771 VanDerWaalsContact C-N 3.3Å; Q769-L771 PolarHBondContact O-N 3.08Å
772	S	91.8	Very high	87.3	Confident	5 Å²	5	54.5 Å²	54.5	4%	0.035	35%	0.346	C	S	.	.			trans	-119.8	164.8	164.7	71	0	0	0	0	110.5	N774 D775	S772-N774 VanDerWaalsContact C-N 3.29Å; S772-N774 PolarHBondContact O-N 3.25Å; S772-D775 WeakPolarHBondContact CB-OD2 3.18Å; S772-D775 PolarHBondContact N-OD2 2.87Å; S772-D775 PolarHBondContact O-N 3.4Å; S772-D775 PolarHBondContact OG-N 2.99Å; S772-D775 PolarHBondContact OG-OD2 3.18Å
773	L	91.7	Very high	86.1	Confident	7 Å²	7	59.5 Å²	59.5	4%	0.037	37%	0.374	C	S	.	.	H	α-helix	trans	-59.8	-44.3	175	-179.2	64.7	0	0	0	110.6	W681 L687 L743 G764 D775 L776 L777 F821 V822	W681-L773 HydrophobicContact CH2-CD1 3.73Å; W681-L773 HydrophobicContact CZ3-CD1 3.97Å; L687-L773 HydrophobicContact CD1-CD1 4.13Å; L743-L773 HydrophobicContact CD2-CD2 3.97Å; G764-L773 PolarHBondContact O-N 2.67Å; L773-D775 PolarHBondContact O-N 3.4Å; L773-L776 PolarHBondContact O-N 3.39Å; L773-L777 HydrophobicContact CD1-CD1 4.41Å; L773-L777 HydrophobicContact CD2-CD1 4.4Å; L773-L777 HydrophobicContact CG-CD1 3.95Å; L773-L777 HydrophobicContact CG-CG 4.44Å; L773-L777 WeakPolarHBondContact O-CG 3.31Å; L773-L777 PolarHBondContact O-N 2.98Å; L773-F821 HydrophobicContact CD1-CB 4.28Å; L773-V822 HydrophobicContact CD2-CG1 3.96Å
774	N	91.5	Very high	85.1	Confident	73 Å²	73	66.2 Å²	66.2	39%	0.39	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-28.6	179.8	-75.6	-16.8	0	0	0	113.5	G764 S765 S772 L776 L777	G764-N774 VanDerWaalsContact C-ND2 3.31Å; G764-N774 PolarHBondContact O-N 3.03Å; S765-N774 PolarHBondContact N-ND2 3.39Å; S765-N774 PolarHBondContact OG-ND2 3.47Å; S772-N774 VanDerWaalsContact C-N 3.29Å; S772-N774 PolarHBondContact O-N 3.25Å; N774-L776 PolarHBondContact O-N 3.22Å; N774-L777 PolarHBondContact O-N 3.47Å
775	D	89.5	Confident	84.4	Confident	82 Å²	82	71.1 Å²	71.1	44%	0.439	43%	0.428	S	S	.	.	H	α-helix	trans	-64.1	-32.4	175.9	-64	-43.1	0	0	0	111.8	K682 S772 L773	K682-D775 WeakPolarHBondContact CD-O 3.33Å; K682-D775 PolarHBondContact NZ-O 2.95Å; S772-D775 WeakPolarHBondContact CB-OD2 3.18Å; S772-D775 PolarHBondContact N-OD2 2.87Å; S772-D775 PolarHBondContact O-N 3.4Å; S772-D775 PolarHBondContact OG-N 2.99Å; S772-D775 PolarHBondContact OG-OD2 3.18Å; L773-D775 PolarHBondContact O-N 3.4Å
776	L	89.4	Confident	83.7	Confident	22 Å²	22	72.3 Å²	72.3	12%	0.115	43%	0.428	C	S	.	.	H	α-helix	trans	-86.7	-13.3	-179	-59.9	-173.9	0	0	0	114.1	W681 K682 P685 L687 L773 N774	W681-L776 HydrophobicContact CE3-CB 4Å; W681-L776 HydrophobicContact CZ3-CB 3.82Å; W681-L776 HydrophobicContact CZ3-CD1 4.2Å; K682-L776 WeakPolarHBondContact CB-O 3.36Å; K682-L776 PolarHBondContact N-O 3.28Å; P685-L776 HydrophobicContact CB-CD1 4.29Å; L687-L776 HydrophobicContact CD1-CD1 4.04Å; L687-L776 HydrophobicContact CD2-CD1 3.35Å; L687-L776 HydrophobicContact CD2-CG 4.27Å; L687-L776 HydrophobicContact CG-CD1 3.51Å; L773-L776 PolarHBondContact O-N 3.39Å; N774-L776 PolarHBondContact O-N 3.22Å
777	L	90.6	Very high	83.2	Confident	21 Å²	21	77.6 Å²	77.6	11%	0.11	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-99.3	143.1	-177.6	-61.1	179.8	0	0	0	111.7	L679 P680 W681 K682 L773 N774	L679-L777 HydrophobicContact CB-CD2 3.92Å; L679-L777 HydrophobicContact CD2-CD1 4.09Å; L679-L777 HydrophobicContact CD2-CD2 4.29Å; L679-L777 HydrophobicContact CG-CD2 4.48Å; P680-L777 HydrophobicContact CG-CB 4.42Å; P680-L777 HydrophobicContact CG-CD2 4.46Å; W681-L777 HydrophobicContact CD2-CD2 3.95Å; W681-L777 HydrophobicContact CE3-CD2 3.55Å; W681-L777 HydrophobicContact CH2-CD2 4.21Å; W681-L777 HydrophobicContact CZ3-CD2 3.69Å; W681-L777 HydrophobicContact CZ3-CG 4.48Å; K682-L777 WeakPolarHBondContact CE-O 3.11Å; K682-L777 PolarHBondContact NZ-O 3.02Å; K682-L777 VanDerWaalsContact NZ-O 3.08Å; L773-L777 HydrophobicContact CD1-CD1 4.41Å; L773-L777 HydrophobicContact CD2-CD1 4.4Å; L773-L777 HydrophobicContact CG-CD1 3.95Å; L773-L777 HydrophobicContact CG-CG 4.44Å; L773-L777 WeakPolarHBondContact O-CG 3.31Å; L773-L777 PolarHBondContact O-N 2.98Å; N774-L777 PolarHBondContact O-N 3.47Å
778	N	83.6	Confident	82.7	Confident	35 Å²	35	78.9 Å²	78.9	19%	0.187	46%	0.46	C	S	.	.			trans	-75.1	125.1	167.7	-75.4	-64.6	0	0	0	108.5	P680 W681 K682 G780	P680-N778 HydrophobicContact CB-CB 4.31Å; P680-N778 WeakPolarHBondContact CG-O 3.33Å; P680-N778 WeakPolarHBondContact O-CB 3.1Å; P680-N778 PolarHBondContact O-N 2.96Å; P680-N778 PolarHBondContact O-ND2 2.72Å; W681-N778 PolarHBondContact O-ND2 3.1Å; K682-N778 WeakPolarHBondContact CA-ND2 3.39Å; K682-N778 HydrophobicContact CG-CB 4.44Å; K682-N778 VanDerWaalsContact CG-OD1 3.27Å; K682-N778 WeakPolarHBondContact CG-OD1 3.35Å; N778-G780 PolarHBondContact O-N 2.83Å; N778-G780 VanDerWaalsContact O-N 3.13Å
779	P	76.8	Confident	82.2	Confident	124 Å²	124	77 Å²	77	81%	0.805	46%	0.458	S	S	*	.			trans	-66.4	-14.6	177.7	27.3	-34.2	0	0	0	112.8
780	G	72.3	Confident	81.9	Confident	49 Å²	49	73.4 Å²	73.4	51%	0.505	44%	0.442	S	S	.	.			trans	73.6	172.7	-172.5	0	0	0	0	0	112.4	N778	N778-G780 PolarHBondContact O-N 2.83Å; N778-G780 VanDerWaalsContact O-N 3.13Å
781	S	68.9	Low	81.9	Confident	56 Å²	56	75.1 Å²	75.1	39%	0.392	44%	0.436	S	S	.	.			trans	-68.5	152.3	170.5	57.8	0	0	0	0	110.8	L783	S781-L783 PolarHBondContact O-N 2.76Å
782	A	69.1	Low	81.8	Confident	101 Å²	101	77.8 Å²	77.8	84%	0.835	45%	0.45	S	S	*	.			trans	-62.9	101.4	170.8	0	0	0	0	0	110.4	Q784	A782-Q784 VanDerWaalsContact C-N 3.28Å
783	L	70	Confident	81.4	Confident	161 Å²	161	84.1 Å²	84.1	84%	0.843	47%	0.474	S	S	*	.			trans	-81.4	-8.2	176.4	-68.4	171	0	0	0	112.9	S781 N785	S781-L783 PolarHBondContact O-N 2.76Å; L783-N785 PolarHBondContact O-N 2.89Å
784	Q	73	Confident	81.1	Confident	180 Å²	180	89.5 Å²	89.5	84%	0.841	49%	0.494	S	S	*	.	S	Bend	trans	-68.1	130	178.8	-69.4	-174.8	-3.9	0	0	110	A782	A782-Q784 VanDerWaalsContact C-N 3.28Å
785	N	73.6	Confident	81	Confident	114 Å²	114	96.5 Å²	96.5	61%	0.61	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-58.2	140.9	169.8	-77.3	-49.4	0	0	0	110.1	L783 L787 I790	L783-N785 PolarHBondContact O-N 2.89Å; N785-L787 PolarHBondContact O-N 3.44Å; N785-I790 HydrophobicContact CB-CD1 3.83Å; N785-I790 HydrophobicContact CB-CG1 3.91Å
786	D	78.8	Confident	80.8	Confident	103 Å²	103	102.4 Å²	102.4	55%	0.551	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-52	122.5	174.8	169.7	47.1	0	0	0	111.2	V788 G789 I790	D786-V788 VanDerWaalsContact C-N 3.27Å; D786-V788 PolarHBondContact O-N 2.87Å; D786-V788 PolarHBondContact OD1-N 3.35Å; D786-G789 CarbonylContact O-C 3.52Å; D786-G789 WeakPolarHBondContact O-CA 3.49Å; D786-G789 PolarHBondContact O-N 3.18Å; D786-G789 VanDerWaalsContact O-N 3.12Å; D786-G789 PolarHBondContact OD2-N 3.22Å; D786-I790 WeakPolarHBondContact O-CG1 3.46Å; D786-I790 PolarHBondContact O-N 2.98Å
787	L	82.3	Confident	80.6	Confident	117 Å²	117	107.3 Å²	107.3	61%	0.613	56%	0.557	S	S	*	*	H	α-helix	trans	-62.7	-37.1	-174.3	-175.5	64.1	0	0	0	111.2	N785 I790 L791	N785-L787 PolarHBondContact O-N 3.44Å; L787-I790 PolarHBondContact O-N 3.13Å; L787-L791 HydrophobicContact CG-CD1 4.45Å; L787-L791 WeakPolarHBondContact O-CG 3.43Å; L787-L791 PolarHBondContact O-N 3.06Å
788	V	82	Confident	80.6	Confident	88 Å²	88	117.2 Å²	117.2	53%	0.533	59%	0.593	S	S	.	*	H	α-helix	trans	-64	-46.1	176	177.6	0	0	0	0	109.8	D786 I790 L791 L792	D786-V788 VanDerWaalsContact C-N 3.27Å; D786-V788 PolarHBondContact O-N 2.87Å; D786-V788 PolarHBondContact OD1-N 3.35Å; V788-I790 VanDerWaalsContact C-N 3.33Å; V788-I790 PolarHBondContact O-N 3.44Å; V788-L791 PolarHBondContact O-N 3.35Å; V788-L792 HydrophobicContact CG1-CD1 4.01Å; V788-L792 HydrophobicContact CG1-CG 4.39Å; V788-L792 WeakPolarHBondContact O-CB 3.41Å; V788-L792 WeakPolarHBondContact O-CG 3.42Å; V788-L792 PolarHBondContact O-N 3.48Å
789	G	83.6	Confident	80.9	Confident	16 Å²	16	123.2 Å²	123.2	17%	0.165	62%	0.618	C	S	.	*	H	α-helix	trans	-58.8	-39.1	173.5	0	0	0	0	0	113.4	D786 R793	D786-G789 CarbonylContact O-C 3.52Å; D786-G789 WeakPolarHBondContact O-CA 3.49Å; D786-G789 PolarHBondContact O-N 3.18Å; D786-G789 VanDerWaalsContact O-N 3.12Å; D786-G789 PolarHBondContact OD2-N 3.22Å; G789-R793 WeakPolarHBondContact O-CB 3.31Å; G789-R793 WeakPolarHBondContact O-CG 3.37Å; G789-R793 PolarHBondContact O-N 2.98Å; G789-R793 VanDerWaalsContact O-N 3.07Å; G789-R793 PolarHBondContact O-NE 3.11Å
790	I	84.4	Confident	81.4	Confident	65 Å²	65	119.5 Å²	119.5	33%	0.333	60%	0.597	S	S	.	*	H	α-helix	trans	-61.5	-51.9	172.2	-64.4	169.8	0	0	0	110.2	N785 D786 L787 V788 L792 R793 Y794	N785-I790 HydrophobicContact CB-CD1 3.83Å; N785-I790 HydrophobicContact CB-CG1 3.91Å; D786-I790 WeakPolarHBondContact O-CG1 3.46Å; D786-I790 PolarHBondContact O-N 2.98Å; L787-I790 PolarHBondContact O-N 3.13Å; V788-I790 VanDerWaalsContact C-N 3.33Å; V788-I790 PolarHBondContact O-N 3.44Å; I790-L792 VanDerWaalsContact C-N 3.34Å; I790-L792 PolarHBondContact O-N 3.25Å; I790-R793 PolarHBondContact O-N 3.24Å; I790-Y794 WeakPolarHBondContact O-CB 3.44Å; I790-Y794 PolarHBondContact O-N 3.48Å
791	L	87.6	Confident	82.1	Confident	97 Å²	97	124 Å²	124	51%	0.508	62%	0.615	S	S	.	*	H	α-helix	trans	-62	-39.5	-177.6	-69.8	172.7	0	0	0	112.6	L787 V788 Y794 R795	L787-L791 HydrophobicContact CG-CD1 4.45Å; L787-L791 WeakPolarHBondContact O-CG 3.43Å; L787-L791 PolarHBondContact O-N 3.06Å; V788-L791 PolarHBondContact O-N 3.35Å; L791-Y794 PolarHBondContact O-N 2.69Å; L791-R795 PolarHBondContact O-N 3.44Å; L791-R795 VanDerWaalsContact O-N 3.1Å
792	L	87.2	Confident	83	Confident	117 Å²	117	128.9 Å²	128.9	61%	0.613	63%	0.632	S	S	*	*	H	α-helix	trans	-65.1	-43.7	175.6	-71.7	173.2	0	0	0	111.6	V788 I790 Y794 R795 R796	V788-L792 HydrophobicContact CG1-CD1 4.01Å; V788-L792 HydrophobicContact CG1-CG 4.39Å; V788-L792 WeakPolarHBondContact O-CB 3.41Å; V788-L792 WeakPolarHBondContact O-CG 3.42Å; V788-L792 PolarHBondContact O-N 3.48Å; I790-L792 VanDerWaalsContact C-N 3.34Å; I790-L792 PolarHBondContact O-N 3.25Å; L792-Y794 VanDerWaalsContact C-N 3.32Å; L792-Y794 PolarHBondContact O-N 3.28Å; L792-R795 PolarHBondContact O-N 2.91Å; L792-R796 PolarHBondContact O-N 3.3Å; L792-R796 VanDerWaalsContact O-N 3.13Å
793	R	83.3	Confident	83.7	Confident	139 Å²	139	129 Å²	129	53%	0.525	63%	0.632	S	S	.	*	H	α-helix	trans	-63.1	-40	174.2	-75.3	-176.6	-68.8	-120.3	0.1	111.7	G789 I790 R795 R796	G789-R793 WeakPolarHBondContact O-CB 3.31Å; G789-R793 WeakPolarHBondContact O-CG 3.37Å; G789-R793 PolarHBondContact O-N 2.98Å; G789-R793 VanDerWaalsContact O-N 3.07Å; G789-R793 PolarHBondContact O-NE 3.11Å; I790-R793 PolarHBondContact O-N 3.24Å; R793-R795 VanDerWaalsContact C-N 3.26Å; R793-R795 PolarHBondContact O-N 3.47Å; R793-R796 WeakPolarHBondContact O-CB 3.28Å; R793-R796 PolarHBondContact O-N 3.28Å; R793-R796 VanDerWaalsContact O-N 3.16Å
794	Y	86.7	Confident	84.2	Confident	119 Å²	119	128.7 Å²	128.7	47%	0.467	63%	0.631	S	S	.	*	H	α-helix	trans	-62.5	-32.7	178.7	-151.1	-89.6	0	0	0	112.5	I790 L791 L792 A800	I790-Y794 WeakPolarHBondContact O-CB 3.44Å; I790-Y794 PolarHBondContact O-N 3.48Å; L791-Y794 PolarHBondContact O-N 2.69Å; L792-Y794 VanDerWaalsContact C-N 3.32Å; L792-Y794 PolarHBondContact O-N 3.28Å; Y794-A800 HydrophobicContact CD1-CB 3.98Å; Y794-A800 HydrophobicContact CD2-CB 3.85Å; Y794-A800 HydrophobicContact CE1-CB 3.62Å; Y794-A800 HydrophobicContact CE2-CB 3.49Å; Y794-A800 VanDerWaalsContact CE2-CB 3.49Å; Y794-A800 HydrophobicContact CG-CB 4.09Å
795	R	87.5	Confident	84.6	Confident	220 Å²	220	124.6 Å²	124.6	83%	0.83	62%	0.618	S	S	*	*	H	α-helix	trans	-87.6	-12.4	176.4	-73	-170.7	174.5	147.6	0.3	114.8	L791 L792 R793	L791-R795 PolarHBondContact O-N 3.44Å; L791-R795 VanDerWaalsContact O-N 3.1Å; L792-R795 PolarHBondContact O-N 2.91Å; R793-R795 VanDerWaalsContact C-N 3.26Å; R793-R795 PolarHBondContact O-N 3.47Å
796	R	85.6	Confident	84.9	Confident	207 Å²	207	126.6 Å²	126.6	78%	0.781	62%	0.624	S	S	*	*	H	α-helix	trans	-71.9	-33.1	-173.6	-176.7	176.2	171.9	-175	-2.7	112.9	L792 R793	L792-R796 PolarHBondContact O-N 3.3Å; L792-R796 VanDerWaalsContact O-N 3.13Å; R793-R796 WeakPolarHBondContact O-CB 3.28Å; R793-R796 PolarHBondContact O-N 3.28Å; R793-R796 VanDerWaalsContact O-N 3.16Å
797	L	86.6	Confident	84.9	Confident	125 Å²	125	123.3 Å²	123.3	65%	0.654	61%	0.611	S	S	*	*	S	Bend	trans	-116.5	153.5	-174.3	-60	178.1	0	0	0	110.9	F799	L797-F799 PolarHBondContact O-N 2.91Å
798	R	89.3	Confident	84.9	Confident	228 Å²	228	123.3 Å²	123.3	86%	0.86	61%	0.609	S	S	*	*	S	Bend	trans	-63	-28.7	-179.1	-176.5	173.5	-179.9	164.5	0.4	113.1
799	F	91	Very high	84.7	Confident	161 Å²	161	127.6 Å²	127.6	71%	0.706	62%	0.621	S	S	*	*			trans	-125.7	134.7	-179.9	-55.6	-72.7	0	0	0	109.1	L797	L797-F799 PolarHBondContact O-N 2.91Å
800	A	86.9	Confident	84.7	Confident	46 Å²	46	129.2 Å²	129.2	38%	0.38	63%	0.626	S	S	.	*			trans	-113.4	134	173.3	0	0	0	0	0	109	Y794	Y794-A800 HydrophobicContact CD1-CB 3.98Å; Y794-A800 HydrophobicContact CD2-CB 3.85Å; Y794-A800 HydrophobicContact CE1-CB 3.62Å; Y794-A800 HydrophobicContact CE2-CB 3.49Å; Y794-A800 VanDerWaalsContact CE2-CB 3.49Å; Y794-A800 HydrophobicContact CG-CB 4.09Å
801	V	87.8	Confident	84.7	Confident	143 Å²	143	129.8 Å²	129.8	87%	0.867	63%	0.627	S	S	*	*			trans	-108.1	128	174.1	-177.9	0	0	0	0	107.2
802	Q	86.6	Confident	84.7	Confident	160 Å²	160	128.2 Å²	128.2	75%	0.748	62%	0.621	S	S	*	*			trans	-118.6	141.6	173.8	62.2	179.9	-16	0	0	108.9
803	A	84.5	Confident	84.9	Confident	102 Å²	102	124.7 Å²	124.7	84%	0.843	60%	0.602	S	S	*	*			trans	-136.5	143.6	171.8	0	0	0	0	0	107.6
804	D	80.5	Confident	85.2	Confident	156 Å²	156	119.9 Å²	119.9	83%	0.834	59%	0.586	S	S	*	*			trans	-114.8	145.5	172.6	-170.9	24.4	0	0	0	108.3
805	V	80.7	Confident	85.3	Confident	93 Å²	93	115.6 Å²	115.6	56%	0.564	57%	0.57	S	S	*	*			trans	-91.8	109.4	175.2	179.9	0	0	0	0	107.3	A807 M808	V805-A807 PolarHBondContact O-N 2.99Å; V805-M808 HydrophobicContact CB-CB 4.02Å; V805-M808 HydrophobicContact CB-CG 4.36Å; V805-M808 HydrophobicContact CG1-CB 3.79Å; V805-M808 HydrophobicContact CG1-CG 4.07Å; V805-M808 PolarHBondContact O-N 3.46Å
806	E	79.5	Confident	85.3	Confident	157 Å²	157	112.1 Å²	112.1	73%	0.734	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	125.1	-180	-172.5	171.7	-167.3	0	0	110.6	M808	E806-M808 PolarHBondContact O-N 3.29Å; E806-M808 VanDerWaalsContact O-N 3.14Å
807	A	78.8	Confident	85.3	Confident	33 Å²	33	108.3 Å²	108.3	27%	0.273	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	52.9	34.6	176.7	0	0	0	0	0	114.6	W727 V805 F809 L810 Q811	W727-A807 HydrophobicContact CH2-CB 3.84Å; W727-A807 HydrophobicContact CZ2-CB 3.84Å; V805-A807 PolarHBondContact O-N 2.99Å; A807-F809 VanDerWaalsContact C-N 3.32Å; A807-F809 PolarHBondContact O-N 3.47Å; A807-F809 VanDerWaalsContact O-N 3.08Å; A807-L810 HydrophobicContact CB-CB 4.3Å; A807-L810 HydrophobicContact CB-CD1 4.27Å; A807-L810 WeakPolarHBondContact O-CA 3.48Å; A807-L810 WeakPolarHBondContact O-CB 3.08Å; A807-L810 PolarHBondContact O-N 2.93Å; A807-Q811 PolarHBondContact O-N 2.87Å
808	M	82.3	Confident	85.5	Confident	118 Å²	118	102.7 Å²	102.7	58%	0.581	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-41.1	-51.4	-174.3	-175.5	-176	172.4	0	0	114.9	V805 E806 L810 Q811	V805-M808 HydrophobicContact CB-CB 4.02Å; V805-M808 HydrophobicContact CB-CG 4.36Å; V805-M808 HydrophobicContact CG1-CB 3.79Å; V805-M808 HydrophobicContact CG1-CG 4.07Å; V805-M808 PolarHBondContact O-N 3.46Å; E806-M808 PolarHBondContact O-N 3.29Å; E806-M808 VanDerWaalsContact O-N 3.14Å; M808-L810 VanDerWaalsContact C-N 3.27Å; M808-L810 PolarHBondContact O-N 3.2Å; M808-Q811 PolarHBondContact O-N 3.14Å
809	F	79.1	Confident	85.6	Confident	178 Å²	178	94.2 Å²	94.2	78%	0.781	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-67	-25.9	-178	-65.3	-67.2	0	0	0	113.9	A807 Q811 T812	A807-F809 VanDerWaalsContact C-N 3.32Å; A807-F809 PolarHBondContact O-N 3.47Å; A807-F809 VanDerWaalsContact O-N 3.08Å; F809-Q811 VanDerWaalsContact C-N 3.34Å; F809-T812 PolarHBondContact O-OG1 2.85Å
810	L	83.9	Confident	85.5	Confident	49 Å²	49	88.4 Å²	88.4	26%	0.257	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-85.3	-12.5	179	-58.3	169.7	0	0	0	111.7	Y722 W727 A807 M808 T812	Y722-L810 HydrophobicContact CE1-CD1 4.42Å; Y722-L810 HydrophobicContact CE1-CD2 3.89Å; Y722-L810 HydrophobicContact CE2-CD1 4.19Å; W727-L810 HydrophobicContact CD2-CB 3.68Å; W727-L810 HydrophobicContact CD2-CD1 4.1Å; W727-L810 HydrophobicContact CD2-CG 4.29Å; W727-L810 HydrophobicContact CE3-CB 4.07Å; W727-L810 HydrophobicContact CE3-CD1 3.55Å; W727-L810 HydrophobicContact CE3-CD2 4.4Å; W727-L810 HydrophobicContact CE3-CG 4.19Å; W727-L810 HydrophobicContact CG-CB 4.05Å; W727-L810 HydrophobicContact CH2-CB 4.2Å; W727-L810 HydrophobicContact CH2-CD1 3.63Å; W727-L810 HydrophobicContact CZ2-CB 3.81Å; W727-L810 HydrophobicContact CZ2-CD1 4.16Å; W727-L810 HydrophobicContact CZ3-CB 4.34Å; W727-L810 HydrophobicContact CZ3-CD1 3.32Å; W727-L810 HydrophobicContact CZ3-CG 4.35Å; W727-L810 PolarHBondContact NE1-O 2.91Å; A807-L810 HydrophobicContact CB-CB 4.3Å; A807-L810 HydrophobicContact CB-CD1 4.27Å; A807-L810 WeakPolarHBondContact O-CA 3.48Å; A807-L810 WeakPolarHBondContact O-CB 3.08Å; A807-L810 PolarHBondContact O-N 2.93Å; M808-L810 VanDerWaalsContact C-N 3.27Å; M808-L810 PolarHBondContact O-N 3.2Å; L810-T812 VanDerWaalsContact C-N 3.32Å
811	Q	84.2	Confident	85.7	Confident	77 Å²	77	86.5 Å²	86.5	36%	0.36	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-85.2	-6.3	172.5	-62.4	-62.3	-15.6	0	0	113.2	R674 A807 M808 F809	R674-Q811 WeakPolarHBondContact CB-O 3.43Å; A807-Q811 PolarHBondContact O-N 2.87Å; M808-Q811 PolarHBondContact O-N 3.14Å; F809-Q811 VanDerWaalsContact C-N 3.34Å
812	T	87.7	Confident	85.9	Confident	64 Å²	64	81.7 Å²	81.7	39%	0.393	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.5	169.7	27.4	0	0	0	0	110.4	Y675 F809 L810	Y675-T812 WeakPolarHBondContact O-CA 3.46Å; F809-T812 PolarHBondContact O-OG1 2.85Å; L810-T812 VanDerWaalsContact C-N 3.32Å
813	E	89.6	Confident	86.2	Confident	44 Å²	44	74.4 Å²	74.4	21%	0.206	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	142.9	176.5	-170.1	-177	150.1	0	0	110	N671 R674 Y675 V676 V677 R819	N671-E813 PolarHBondContact ND2-OE2 3.34Å; R674-E813 HydrophobicContact CB-CB 4.18Å; Y675-E813 PolarHBondContact O-N 3.02Å; V676-E813 CarbonylContact C-O 3.54Å; V676-E813 VanDerWaalsContact CA-O 3.27Å; V676-E813 WeakPolarHBondContact CA-O 3.08Å; V676-E813 HydrophobicContact CG2-CB 4.26Å; V677-E813 PolarHBondContact N-O 3.07Å; E813-R819 IonicContact OE1-CZ 3.53Å; E813-R819 IonicContact OE1-NH2 2.7Å; E813-R819 PolarHBondContact OE1-NH2 2.93Å
814	L	90.8	Very high	86.6	Confident	38 Å²	38	72.7 Å²	72.7	20%	0.199	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	142.7	173.2	-68.9	177.5	0	0	0	111.1	V677 L679 Q816 R819 V822	V677-L814 HydrophobicContact CG2-CD2 4.27Å; V677-L814 CarbonylContact O-C 3.56Å; V677-L814 WeakPolarHBondContact O-CA 3.21Å; L679-L814 HydrophobicContact CD1-CD1 4.49Å; L679-L814 HydrophobicContact CD2-CD1 4.31Å; L679-L814 HydrophobicContact CD2-CD2 3.89Å; L679-L814 HydrophobicContact CG-CD1 4.28Å; L679-L814 HydrophobicContact CG-CD2 3.98Å; L814-Q816 PolarHBondContact O-N 2.87Å; L814-R819 HydrophobicContact CB-CG 4.08Å; L814-R819 PolarHBondContact O-NE 3.45Å; L814-R819 VanDerWaalsContact O-NE 3.1Å; L814-V822 HydrophobicContact CD1-CB 4.37Å; L814-V822 HydrophobicContact CD1-CG1 3.95Å; L814-V822 HydrophobicContact CD1-CG2 3.5Å; L814-V822 VanDerWaalsContact CD1-CG2 3.5Å
815	Q	89.3	Confident	87.1	Confident	28 Å²	28	68.9 Å²	68.9	13%	0.131	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-51.8	140	167.3	-76.3	-170.9	-10.4	0	0	110	V676 V677 P678 E817 D818 R819	V676-Q815 HydrophobicContact CG1-CG 3.86Å; V677-Q815 PolarHBondContact O-N 3.13Å; P678-Q815 HydrophobicContact CB-CG 4.42Å; Q815-E817 PolarHBondContact O-N 3.09Å; Q815-E817 VanDerWaalsContact O-N 3.07Å; Q815-D818 PolarHBondContact O-N 3.49Å; Q815-R819 PolarHBondContact O-N 3.4Å
816	Q	87.3	Confident	87.4	Confident	147 Å²	147	67.7 Å²	67.7	69%	0.687	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-55.2	-34	-172.5	-168.4	159.1	18.8	0	0	113.5	L814 D818 R819	L814-Q816 PolarHBondContact O-N 2.87Å; Q816-D818 PolarHBondContact O-N 3.08Å; Q816-R819 PolarHBondContact O-N 2.85Å
817	E	85.9	Confident	87.8	Confident	127 Å²	127	62.9 Å²	62.9	59%	0.593	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-62.8	-24.6	176.1	-61.9	155	-148.6	0	0	114.3	R666 Q815	R666-E817 IonicContact CZ-OE2 3.26Å; R666-E817 IonicContact NH1-OE2 3.3Å; R666-E817 PolarHBondContact NH1-OE2 2.98Å; R666-E817 IonicContact NH2-OE2 2.83Å; Q815-E817 PolarHBondContact O-N 3.09Å; Q815-E817 VanDerWaalsContact O-N 3.07Å
818	D	90	Very high	88.3	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.037	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-103.6	-9.2	-173.4	-74.6	-31.4	0	0	0	112.9	P678 L679 W681 Q815 Q816 D820 F821	P678-D818 WeakPolarHBondContact CA-OD2 3.46Å; L679-D818 HydrophobicContact CB-CB 4.2Å; L679-D818 HydrophobicContact CD1-CB 4.01Å; L679-D818 HydrophobicContact CG-CB 3.99Å; L679-D818 PolarHBondContact N-OD2 2.93Å; W681-D818 PolarHBondContact NE1-OD1 3.27Å; Q815-D818 PolarHBondContact O-N 3.49Å; Q816-D818 PolarHBondContact O-N 3.08Å; D818-D820 PolarHBondContact O-N 3.04Å; D818-F821 WeakPolarHBondContact O-CB 3.3Å; D818-F821 PolarHBondContact O-N 3.38Å
819	R	90.2	Very high	88.7	Confident	51 Å²	51	61.5 Å²	61.5	19%	0.192	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-66	-36.4	-174.6	-65.4	-177.1	-168.7	169.2	0.7	113.1	E729 E813 L814 Q815 Q816 F821 V822	E729-R819 VanDerWaalsContact CD-NH1 3.32Å; E729-R819 WeakPolarHBondContact OE1-CD 3.41Å; E729-R819 IonicContact OE1-CZ 3.82Å; E729-R819 IonicContact OE1-NE 3.67Å; E729-R819 IonicContact OE1-NH1 3.93Å; E729-R819 PolarHBondContact OE1-NH1 3.33Å; E729-R819 IonicContact OE2-NH1 2.65Å; E729-R819 PolarHBondContact OE2-NH1 2.98Å; E813-R819 IonicContact OE1-CZ 3.53Å; E813-R819 IonicContact OE1-NH2 2.7Å; E813-R819 PolarHBondContact OE1-NH2 2.93Å; L814-R819 HydrophobicContact CB-CG 4.08Å; L814-R819 PolarHBondContact O-NE 3.45Å; L814-R819 VanDerWaalsContact O-NE 3.1Å; Q815-R819 PolarHBondContact O-N 3.4Å; Q816-R819 PolarHBondContact O-N 2.85Å; R819-F821 PolarHBondContact O-N 3.2Å; R819-V822 WeakPolarHBondContact O-CG2 3.49Å; R819-V822 PolarHBondContact O-N 2.88Å
820	D	90.2	Very high	89.3	Confident	38 Å²	38	54.2 Å²	54.2	20%	0.203	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-62.9	-16.5	179.4	-73.4	-8.8	0	0	0	113	S734 K739 V740 W741 D818 V822 C823	S734-D820 WeakPolarHBondContact CB-OD2 3.41Å; S734-D820 PolarHBondContact OG-OD2 2.69Å; K739-D820 CarbonylContact O-C 3.59Å; K739-D820 WeakPolarHBondContact O-CB 3.42Å; V740-D820 WeakPolarHBondContact CA-O 3.36Å; V740-D820 HydrophobicContact CG2-CB 4.33Å; W741-D820 PolarHBondContact N-O 3.29Å; D818-D820 PolarHBondContact O-N 3.04Å; D820-V822 VanDerWaalsContact C-N 3.32Å; D820-C823 PolarHBondContact O-SG 3.19Å
821	F	91.1	Very high	89.7	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.026	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-83.1	-6.1	176	-63.6	-83.1	0	0	0	114.1	L679 W681 P685 L687 K739 W741 L773 D818 R819	L679-F821 HydrophobicContact CD1-CB 3.96Å; W681-F821 HydrophobicContact CH2-CB 3.87Å; W681-F821 AromaticContact CH2-CD1 3.52Å; W681-F821 HydrophobicContact CH2-CD1 3.52Å; W681-F821 HydrophobicContact CH2-CD2 4.07Å; W681-F821 AromaticContact CH2-CE1 3.99Å; W681-F821 HydrophobicContact CH2-CE1 3.99Å; W681-F821 HydrophobicContact CH2-CE2 4.48Å; W681-F821 AromaticContact CH2-CG 3.55Å; W681-F821 HydrophobicContact CH2-CG 3.55Å; W681-F821 HydrophobicContact CH2-CZ 4.44Å; W681-F821 HydrophobicContact CZ2-CB 3.99Å; W681-F821 AromaticContact CZ2-CD1 3.84Å; W681-F821 HydrophobicContact CZ2-CD1 3.84Å; W681-F821 AromaticContact CZ2-CD2 3.53Å; W681-F821 HydrophobicContact CZ2-CD2 3.53Å; W681-F821 HydrophobicContact CZ2-CE1 4.15Å; W681-F821 AromaticContact CZ2-CE2 3.84Å; W681-F821 HydrophobicContact CZ2-CE2 3.84Å; W681-F821 AromaticContact CZ2-CG 3.5Å; W681-F821 HydrophobicContact CZ2-CG 3.5Å; W681-F821 HydrophobicContact CZ2-CZ 4.14Å; P685-F821 HydrophobicContact CB-CD1 4.44Å; P685-F821 HydrophobicContact CB-CE1 3.62Å; P685-F821 HydrophobicContact CB-CZ 3.9Å; P685-F821 HydrophobicContact CG-CE1 3.74Å; P685-F821 HydrophobicContact CG-CE2 4.23Å; P685-F821 HydrophobicContact CG-CZ 3.44Å; P685-F821 VanDerWaalsContact CG-CZ 3.44Å; L687-F821 HydrophobicContact CD1-CD1 3.83Å; L687-F821 HydrophobicContact CD1-CE1 4.36Å; K739-F821 HydrophobicContact CB-CE1 4.45Å; K739-F821 HydrophobicContact CB-CZ 3.98Å; K739-F821 HydrophobicContact CG-CZ 4.1Å; W741-F821 WeakPolarHBondContact CB-O 3.28Å; L773-F821 HydrophobicContact CD1-CB 4.28Å; D818-F821 WeakPolarHBondContact O-CB 3.3Å; D818-F821 PolarHBondContact O-N 3.38Å; R819-F821 PolarHBondContact O-N 3.2Å
822	V	92.1	Very high	90.1	Very high	43 Å²	43	52.9 Å²	52.9	26%	0.261	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-125.9	24.5	179.5	-61.2	0	0	0	0	112.6	L679 L743 L773 L814 R819 D820	L679-V822 HydrophobicContact CD1-CG1 4.42Å; L743-V822 HydrophobicContact CD1-CB 3.83Å; L743-V822 HydrophobicContact CD1-CG1 4.07Å; L773-V822 HydrophobicContact CD2-CG1 3.96Å; L814-V822 HydrophobicContact CD1-CB 4.37Å; L814-V822 HydrophobicContact CD1-CG1 3.95Å; L814-V822 HydrophobicContact CD1-CG2 3.5Å; L814-V822 VanDerWaalsContact CD1-CG2 3.5Å; R819-V822 WeakPolarHBondContact O-CG2 3.49Å; R819-V822 PolarHBondContact O-N 2.88Å; D820-V822 VanDerWaalsContact C-N 3.32Å
823	C	92.2	Very high	90.2	Very high	6 Å²	6	52.1 Å²	52.1	4%	0.041	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-56.6	158.7	172.9	-64	0	0	0	0	111.2	W741 Y742 L743 D820	W741-C823 WeakPolarHBondContact O-CB 3.39Å; W741-C823 PolarHBondContact O-N 3.35Å; W741-C823 VanDerWaalsContact O-N 3.1Å; Y742-C823 CarbonylContact C-O 3.6Å; Y742-C823 VanDerWaalsContact CA-O 3.28Å; Y742-C823 WeakPolarHBondContact CA-O 3.48Å; Y742-C823 HydrophobicContact CD1-CB 3.83Å; Y742-C823 HydrophobicContact CE1-CB 3.99Å; Y742-C823 HydrophobicContact CG-CB 4.43Å; L743-C823 PolarHBondContact N-O 2.9Å; D820-C823 PolarHBondContact O-SG 3.19Å
824	F	93.2	Very high	90.3	Very high	66 Å²	66	52.8 Å²	52.8	29%	0.289	26%	0.255	S	S	.	.			trans	-148.1	159.4	169.2	60.7	-88.3	0	0	0	110.1	M719 V728 F762	M719-F824 HydrophobicContact CE-CE2 4.35Å; M719-F824 HydrophobicContact SD-CE2 4.41Å; V728-F824 HydrophobicContact CB-CE1 4.16Å; V728-F824 HydrophobicContact CB-CZ 3.99Å; V728-F824 HydrophobicContact CG1-CE1 3.64Å; V728-F824 HydrophobicContact CG1-CZ 3.66Å; V728-F824 HydrophobicContact CG2-CZ 4.36Å; F762-F824 HydrophobicContact CD1-CB 4.25Å; F762-F824 HydrophobicContact CD1-CD1 4.23Å; F762-F824 HydrophobicContact CD1-CG 4.25Å; F762-F824 HydrophobicContact CE1-CB 4.02Å; F762-F824 AromaticContact CE1-CD1 3.56Å; F762-F824 HydrophobicContact CE1-CD1 3.56Å; F762-F824 AromaticContact CE1-CD2 3.98Å; F762-F824 HydrophobicContact CE1-CD2 3.98Å; F762-F824 AromaticContact CE1-CE1 3.98Å; F762-F824 HydrophobicContact CE1-CE1 3.98Å; F762-F824 HydrophobicContact CE1-CE2 4.35Å; F762-F824 AromaticContact CE1-CG 3.58Å; F762-F824 HydrophobicContact CE1-CG 3.58Å; F762-F824 HydrophobicContact CE1-CZ 4.36Å; F762-F824 HydrophobicContact CZ-CD1 4.34Å; F762-F824 HydrophobicContact CZ-CE1 4.31Å; F762-F824 HydrophobicContact CZ-CZ 4.5Å
825	L	91.1	Very high	90.2	Very high	76 Å²	76	54.1 Å²	54.1	40%	0.398	26%	0.26	S	S	.	.			trans	-96.3	0	-178.6	-59.5	179.7	0	0	0	112.6	Y691 A694 L695 L698 Y742 H745	Y691-L825 HydrophobicContact CD2-CD1 4.07Å; Y691-L825 HydrophobicContact CD2-CD2 3.77Å; Y691-L825 HydrophobicContact CD2-CG 4.46Å; Y691-L825 HydrophobicContact CE2-CD1 3.91Å; Y691-L825 HydrophobicContact CE2-CD2 3.4Å; Y691-L825 VanDerWaalsContact CE2-CD2 3.4Å; Y691-L825 HydrophobicContact CE2-CG 4.29Å; A694-L825 HydrophobicContact CB-CD1 3.89Å; A694-L825 HydrophobicContact CB-CG 4.37Å; L695-L825 HydrophobicContact CB-CD1 3.77Å; L695-L825 HydrophobicContact CD1-CD1 4.29Å; L698-L825 HydrophobicContact CD2-CB 3.76Å; Y742-L825 HydrophobicContact CD1-CD2 3.53Å; Y742-L825 HydrophobicContact CD1-CG 3.9Å; Y742-L825 HydrophobicContact CE1-CD2 3.64Å; Y742-L825 HydrophobicContact CE1-CG 4.49Å; Y742-L825 HydrophobicContact CG-CD2 4.44Å; H745-L825 PolarHBondContact NE2-O 3.15Å

Retrieved 825 of 825 residues in 785.3 ms (Link to these results)

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